Model name: model_name=MEAM_LAMMPS_ChoiKimSeol_2017_CoFe__MO_179158257180_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
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=90.0
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: 0.016398323544664375
Energy: 0.01702062479495223
Energy: 1.0730720817849213
Energy: 1.217925636905405
Energy: 0.01702062479495223
Energy: 1.1998543348408734
Energy: 0.01702062479495223
Energy: 1.1998543348420958
Energy: 1.0730720817842927
Energy: 0.01702062479495223
Energy: 0.016398323544664375
Energy: 0.01702062479495223
Energy: 1.2179256369060336
Energy: 1.1998543348402448
Energy: 0.01702062479495223
Energy: 1.1998543348426893

minimum gb energy = 0.016398323544664375 eV
minimum distance =  2.51642613575985 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.010626627435111
Energy: 0.7871490895967728
Energy: 0.8333044136936936
Energy: 0.8054833217115296
Energy: 0.907726092154896
Energy: 0.870560517163648
Energy: 0.8469737110004006
Energy: 0.870560517163648
Energy: 0.8184906583578547
Energy: 0.8148131361126711
Energy: 0.8584794601129402
Energy: 0.8148131361119089
Energy: 0.8468847778209243
Energy: 0.8503033448079802
Energy: 0.8474012852485875
Energy: 0.8503033448087425
Energy: 0.9227324382590218
Energy: 0.8496424960965206
Energy: 0.8481880668662581
Energy: 0.849642496097283
Energy: 0.846220204518705
Energy: 0.9962478429603195
Energy: 0.8476435886832251
Energy: 0.9962478429587949
Energy: 0.914157715056867
Energy: 0.9998376127806637
Energy: 0.9199180169985358
Energy: 0.9998376127799015
Energy: 0.9218262082437529
Energy: 1.0740581887467018
Energy: 0.8549437023806679
Energy: 1.074058188747464
Energy: 0.8549511293456112
Energy: 1.0699762621961002
Energy: 0.8528297367851585
Energy: 1.0699762621961002
Energy: 0.9173640161248012
Energy: 1.0697228344427148
Energy: 0.9278291541349488
Energy: 1.0697228344427148
Energy: 0.9164436309341871
Energy: 1.0694248356303804
Energy: 0.8535624014684392
Energy: 1.0694248356303804
Energy: 0.9213747769062117
Energy: 1.0677246909588716
Energy: 0.856735383850016
Energy: 1.0677246909581093
Energy: 0.9131297156598653
Energy: 0.9996205719815622
Energy: 0.9161601679702722
Energy: 0.9996205719823245
Energy: 0.8477007579538998
Energy: 1.000328594209732
Energy: 0.9137927047161858
Energy: 1.0003285942104945
Energy: 0.9187260066983852
Energy: 0.8513547304651781
Energy: 0.847735522619545
Energy: 0.8513547304651781
Energy: 0.7837724058381179
Energy: 0.849327047763055
Energy: 0.8469258626529805
Energy: 0.8493270477661043
Energy: 0.8165450857135617
Energy: 0.8155869682529686
Energy: 0.7857787703634442
Energy: 0.8155869682537309
Energy: 0.8474111544072387
Energy: 0.8473583285842181
Energy: 0.9078513513772081
Energy: 0.8473583285842181
Energy: 0.8577666704294661
Energy: 0.8195543113878418
Energy: 0.8193302504903456
Energy: 0.8195543113863172
Energy: 0.8489966787408934
Energy: 0.8471868885405959
Energy: 0.8469895094413543
Energy: 0.8471868885398334
Energy: 0.8499429402935762
Energy: 0.8474675987872099
Energy: 0.9236814032208005
Energy: 0.8474675987879723
Energy: 0.8469961760392484
Energy: 0.8481150191248933
Energy: 0.8460227758569896
Energy: 0.8481150191241308
Energy: 0.9199917255027783
Energy: 0.9979072706514811
Energy: 0.9146859571617998
Energy: 0.9979072706514811
Energy: 0.8542905291333751
Energy: 0.9966478903347449
Energy: 0.9242466086468509
Energy: 0.9966478903347449
Energy: 0.9235963673416777
Energy: 1.070803604915776
Energy: 0.8551532479086407
Energy: 1.070803604915776
Energy: 0.9301790282800495
Energy: 1.068859726182826
Energy: 0.919893588691698
Energy: 1.068859726182826
Energy: 0.854156381028329
Energy: 1.0707727940297194
Energy: 0.9158577159975059
Energy: 1.0707727940304819
Energy: 0.9137845442338884
Energy: 1.068724456179508
Energy: 0.9225895827838603
Energy: 1.068724456179508
Energy: 0.9160753248154543
Energy: 1.0011959485395008
Energy: 0.922284094606734
Energy: 1.0011959485395008
Energy: 0.9134496445508059
Energy: 1.0011807253478853
Energy: 0.8488898497021967
Energy: 1.0011807253463607
Energy: 0.8509014773865033
Energy: 0.8504086107591118
Energy: 0.9192112582115728
Energy: 0.8504086107591118
Energy: 0.8468514550922471
Energy: 0.8480659650091597
Energy: 0.8476309471395577
Energy: 0.848065965009922
Energy: 0.7857200897908886
Energy: 0.847773945064402
Energy: 0.8154022590201746
Energy: 0.8477739450636397

minimum gb energy = 0.7837724058381179 eV
minimum distance =  2.25509531354064 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.936785216050856
Energy: 0.8396673026651902
Energy: 0.8890062586148342
Energy: 0.8396673026677978
Energy: 0.9779697292779843
Energy: 0.9288924588073132
Energy: 0.9086908243189771
Energy: 0.928892458806444
Energy: 0.8711920453245415
Energy: 0.8688505442284375
Energy: 0.916224252345935
Energy: 0.8688505442293067
Energy: 0.9071254099895129
Energy: 0.910663408217983
Energy: 0.9084488716692098
Energy: 0.9106634082197214
Energy: 0.9131125584616108
Energy: 0.9093416887488986
Energy: 0.9081876306403557
Energy: 0.9093416887497678
Energy: 0.9075560038266739
Energy: 1.0903475509053122
Energy: 0.9085465097624654
Energy: 1.0903475509070506
Energy: 0.9078174141776967
Energy: 1.0748028355524195
Energy: 0.9132201377990833
Energy: 1.0748028355524195
Energy: 0.9921435269968178
Energy: 1.0749814021484947
Energy: 0.9115692630806718
Energy: 1.074981402149364
Energy: 0.9121632934269412
Energy: 1.1442902066679828
Energy: 0.8351852081144775
Energy: 1.1442902066662446
Energy: 0.9133278893512421
Energy: 1.1441792254943686
Energy: 0.992569440272339
Energy: 1.144179225491761
Energy: 0.9773218968439947
Energy: 1.077718653876253
Energy: 0.9066674454814442
Energy: 1.077718653874515
Energy: 0.9800334336871601
Energy: 1.0849161243771894
Energy: 0.9088992306292255
Energy: 1.0849161243771894
Energy: 0.9091597845311005
Energy: 0.9126459290554784
Energy: 0.9817874133309912
Energy: 0.9126459290546091
Energy: 0.9081073263854356
Energy: 0.9103356513539774
Energy: 0.8337378271082153
Energy: 0.9103356513548465
Energy: 0.9824622859182799
Energy: 0.8662733726602848
Energy: 0.869493057958231
Energy: 0.8662733726594157
Energy: 0.9783001250878396
Energy: 0.9080998825845552
Energy: 0.9080551722796099
Energy: 0.9080998825828168
Energy: 0.8737007234137096
Energy: 0.8726339503998106
Energy: 0.9861363153181202
Energy: 0.8726339503998106
Energy: 0.9072222885373237
Energy: 0.9078400457552939
Energy: 0.9103475939555119
Energy: 0.9078400457561631
Energy: 0.9131210421117827
Energy: 0.90837582720336
Energy: 0.9088564914530055
Energy: 0.9083758272050982
Energy: 0.9067780071501331
Energy: 0.9118712883348592
Energy: 0.9087753243962873
Energy: 0.9118712883374669
Energy: 0.907636940253782
Energy: 1.0751212014959832
Energy: 0.9794957633113927
Energy: 1.0751212014221423
Energy: 0.9907285001504412
Energy: 1.0751048779740084
Energy: 0.9113588038150146
Energy: 1.0751048779731394
Energy: 0.9124677423811306
Energy: 1.1452791217034795
Energy: 0.8366993326533565
Energy: 1.145279121706956
Energy: 0.9107935339632997
Energy: 1.1439995894890866
Energy: 0.9863348029221467
Energy: 1.1439995894873483
Energy: 0.9771133886778415
Energy: 1.0790028125219921
Energy: 0.9090388031950101
Energy: 1.0790028125228612
Energy: 0.9801084960090125
Energy: 1.0741658136995047
Energy: 0.9092649594662969
Energy: 1.0741658137003738
Energy: 0.9101960764650682
Energy: 0.9107461399139412
Energy: 0.9814973416358725
Energy: 0.9107461399156795
Energy: 0.9083277585967696
Energy: 0.9093818855607038
Energy: 0.8335924393024137
Energy: 0.909381885562442
Energy: 0.8360800756410776
Energy: 0.9078192315617244
Energy: 0.8681823470531369
Energy: 0.9078192315625936

minimum gb energy = 0.8335924393024137 eV
minimum distance =  2.25709441996272 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.8361301913032573
Energy: 0.9010232822326534
Energy: 0.9560644693130629
Energy: 0.9231854163250459
Energy: 1.0649284688438336
Energy: 0.9988516569886778
Energy: 0.981673332628492
Energy: 0.9988516569886778
Energy: 0.9311970744872635
Energy: 0.929820377096773
Energy: 0.9895163674891322
Energy: 0.9298203770977835
Energy: 0.9804324853169659
Energy: 0.9914883242604143
Energy: 0.9819020801443166
Energy: 0.9914883242806224
Energy: 0.9819179631877002
Energy: 0.9852394416297346
Energy: 0.9824719634842305
Energy: 0.9852394416307451
Energy: 0.9817778963090456
Energy: 1.1814048181238133
Energy: 0.9830811134559085
Energy: 1.181404818122803
Energy: 0.981167473811968
Energy: 1.2045440307747892
Energy: 0.9834657711382262
Energy: 1.2045440307747892
Energy: 1.0765048910097759
Energy: 1.1694364540268807
Energy: 1.045345415380145
Energy: 1.1694364540268807
Energy: 0.9804683996162131
Energy: 1.1716401559812326
Energy: 0.8969116629632012
Energy: 1.1716401559913368
Energy: 0.983132955615607
Energy: 1.2041926692422598
Energy: 0.9828408398780472
Energy: 1.2041926692422598
Energy: 1.0488594416252195
Energy: 0.9873627221734308
Energy: 0.9827978314419954
Energy: 0.9873627221774723
Energy: 0.9743906854582398
Energy: 0.9870294670870726
Energy: 0.9824863332051805
Energy: 0.987029467088083
Energy: 0.932011816573775
Energy: 0.930114751431661
Energy: 1.0584727433513306
Energy: 0.9301147514326715
Energy: 0.9819592784021439
Energy: 0.98134101740567
Energy: 1.06854809573323
Energy: 0.9813410174046596
Energy: 0.9887583780756719
Energy: 0.9366445995004871
Energy: 0.939090183448706
Energy: 0.9366445995004871
Energy: 1.0145651142914993
Energy: 0.9816540262777524
Energy: 0.9293714805521677
Energy: 0.9816540262777524
Energy: 0.9835372577947653
Energy: 0.9821981421564098
Energy: 0.9826376323430511
Energy: 0.9821981421553994
Energy: 0.983070533149481
Energy: 0.9862072701909049
Energy: 0.9816888039096964
Energy: 0.9862072701898944
Energy: 0.9827110162854916
Energy: 1.1720862075671334
Energy: 0.9811787221668575
Energy: 1.1720862075701648
Energy: 0.9102792415445028
Energy: 1.1712736470396827
Energy: 0.9818796801386451
Energy: 1.1712736470396827
Energy: 0.8931504798616118
Energy: 1.2062619509646284
Energy: 0.9810311628493943
Energy: 1.206261950963618
Energy: 0.9877172358249673
Energy: 1.201845804848288
Energy: 0.9812994078251058
Energy: 1.201845804848288
Energy: 0.984623454742525
Energy: 0.987975630665182
Energy: 1.0487206990389049
Energy: 0.9879756306601299
Energy: 0.9823697817012617
Energy: 0.9902451133880049
Energy: 0.9737208261575917
Energy: 0.9902451133880049
Energy: 0.8972694073879219
Energy: 0.9810958943489505
Energy: 0.931394867546399
Energy: 0.9810958943489505

minimum gb energy = 0.8931504798616118 eV
minimum distance =  2.26339558298379 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.6855344889251116
Energy: 0.9740174717539466
Energy: 1.0353683876760478
Energy: 0.974017471755152
Energy: 1.1213633302766257
Energy: 1.0779284011914214
Energy: 1.0763666463842918
Energy: 1.0779284011914214
Energy: 1.003828725825209
Energy: 1.0039238922219795
Energy: 1.022009280330376
Energy: 1.0039238922207743
Energy: 1.0029620734406084
Energy: 1.0792299285482836
Energy: 1.076469758426272
Energy: 1.0792299285482836
Energy: 1.170059733660995
Energy: 1.0780554539772214
Energy: 1.0763608827115534
Energy: 1.0780554539760159
Energy: 1.1642454081627565
Energy: 1.3183535255125511
Energy: 1.0763849119445419
Energy: 1.3183535255137564
Energy: 1.184367695623532
Energy: 1.315027009600326
Energy: 1.1646511672477222
Energy: 1.315027009600326
Energy: 1.0945038267969545
Energy: 1.3181549023038273
Energy: 1.1661072478106744
Energy: 1.318154902302649
Energy: 1.0764748920256961
Energy: 1.0774794894081134
Energy: 1.050831893613559
Energy: 1.0774794894081134
Energy: 1.0763865683025262
Energy: 1.0774109528411973
Energy: 1.0520009336868659
Energy: 1.077410952829144
Energy: 1.0599816206141521
Energy: 1.0037669318079543
Energy: 1.0041224590555713
Energy: 1.0037669318079543
Energy: 1.1204985636516966
Energy: 1.0733812602521469
Energy: 1.014893817941005
Energy: 1.0733812602521469
Energy: 1.0168824563902785
Energy: 1.0146328590561773
Energy: 1.0216052652973693
Energy: 1.0146328590573828
Energy: 1.0027787940912831
Energy: 1.0733131050016516
Energy: 1.0896413849083797
Energy: 1.0733131050016516
Energy: 1.0943087835652483
Energy: 1.0740298911821204
Energy: 1.0774098136158468
Energy: 1.0740298911821204
Energy: 1.1630616847716222
Energy: 1.0772301715394947
Energy: 1.076943013340633
Energy: 1.0772301715394947
Energy: 1.179922680151835
Energy: 1.3193387458270711
Energy: 1.0923089578517886
Energy: 1.3193387458270711
Energy: 1.1792612158774434
Energy: 1.3166859696316742
Energy: 1.1645848681151467
Energy: 1.3166859696316742
Energy: 1.0778019817282527
Energy: 1.077364264760052
Energy: 0.9624430622619177
Energy: 1.077364264760052
Energy: 1.0763892582367078
Energy: 1.0769662276823975
Energy: 0.9631475455641866
Energy: 1.0769662276715493
Energy: 0.9672265200983952
Energy: 1.002585525834397
Energy: 1.0042171209797284
Energy: 1.002585525834397

minimum gb energy = 0.9624430622619177 eV
minimum distance =  2.27977669465223 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.3417708568735416
Energy: 1.0706341435505353
Energy: 1.157827572200196
Energy: 1.1019818516738387
Energy: 1.1188612432046323
Energy: 1.1443149478682626
Energy: 1.1257023071390344
Energy: 1.1443149478682626
Energy: 1.1133340812075105
Energy: 1.1134133815831928
Energy: 1.1187617833619068
Energy: 1.1134133815831928
Energy: 1.111961661192448
Energy: 1.1449438502107876
Energy: 1.088069364260613
Energy: 1.1449438502107876
Energy: 1.0894697575405872
Energy: 1.2636079831820048
Energy: 1.0909138984551645
Energy: 1.2636079831834954
Energy: 1.061385847569485
Energy: 1.2703811968490226
Energy: 1.0882519850443921
Energy: 1.2703811968490226
Energy: 1.0575411955180356
Energy: 1.2630943472515905
Energy: 1.0910769186428368
Energy: 1.2630943472530811
Energy: 1.057854400545856
Energy: 1.2625850596261912
Energy: 1.092300778876814
Energy: 1.2625850596261912
Energy: 1.114391511233416
Energy: 1.1139808044309565
Energy: 1.1602629742036557
Energy: 1.1139808044309565
Energy: 1.1251006014675013
Energy: 1.1129184462996835
Energy: 1.1632138429752958
Energy: 1.1129184462996835
Energy: 1.1174192241089944
Energy: 1.112739840099983
Energy: 1.1275758213821612
Energy: 1.112739840099983
Energy: 1.1169537753185066
Energy: 1.0618802242818108
Energy: 1.1139094144517139
Energy: 1.0618802242818108
Energy: 1.0883665432309846
Energy: 1.2697173347436537
Energy: 1.0907933604182032
Energy: 1.2697173347436537
Energy: 1.0888874161842923
Energy: 1.2636215911591075
Energy: 1.0629691667352896
Energy: 1.2636215911591075
Energy: 1.0901862157288045
Energy: 1.2626642692223309
Energy: 1.0573719402630941
Energy: 1.2626642692223309
Energy: 1.088308887678344
Energy: 1.2626346257145635
Energy: 1.0577913296505137
Energy: 1.2626346257145635
Energy: 1.1578741665343477
Energy: 1.1142579593894157
Energy: 1.1130244644156488
Energy: 1.1142579593879252

minimum gb energy = 1.0573719402630941 eV
minimum distance =  2.2828073931037 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 2.0450806377306328
Energy: 1.1689678247113255
Energy: 1.248479542091605
Energy: 1.1888412144056764
Energy: 1.1664665310707958
Energy: 1.345459667398699
Energy: 1.2150908426779472
Energy: 1.345459667398699
Energy: 1.131559626238832
Energy: 1.1315507051872442
Energy: 1.1968650668152245
Energy: 1.1315507051847116
Energy: 1.1317549497150934
Energy: 1.3431914751007419
Energy: 1.130554244595394
Energy: 1.3431914750990535
Energy: 1.2229264870373735
Energy: 1.3976635099869037
Energy: 1.2668157257525037
Energy: 1.3976635099869037
Energy: 1.1332699755496274
Energy: 1.3995087639049104
Energy: 1.1302669914090548
Energy: 1.3995087639049104
Energy: 1.1569874633822685
Energy: 1.1304688917052448
Energy: 1.13411412494235
Energy: 1.1304688917052448
Energy: 1.2256588669572839
Energy: 1.1302788312141687
Energy: 1.1573062651393762
Energy: 1.1302788312141687
Energy: 1.216280082625171
Energy: 1.1926916653782207
Energy: 1.1998873708777646
Energy: 1.1926916653799091
Energy: 1.1940131606327375
Energy: 1.1928913927094567
Energy: 1.220000258411924
Energy: 1.1928913927077678
Energy: 1.223982867494712
Energy: 1.194135806450405
Energy: 1.1264238799946442
Energy: 1.1941358064495609
Energy: 1.192460051564048
Energy: 1.1932528065336134
Energy: 1.1886165305470269
Energy: 1.1932528065336134
Energy: 1.1541157350136693
Energy: 1.1928955735470423
Energy: 1.1896251786097447
Energy: 1.1928955735461981
Energy: 1.154190817395237
Energy: 1.1931015106695297
Energy: 1.1265802719997884
Energy: 1.193101510670374
Energy: 1.1922494441589833
Energy: 1.1914030729171465
Energy: 1.2320889389126508
Energy: 1.1914030729171465
Energy: 1.2170235696378802
Energy: 1.1917595684726148
Energy: 1.2320489940085644
Energy: 1.1917595684726148
Energy: 1.1959565261491374
Energy: 1.1315695715086544
Energy: 1.1595481118147808
Energy: 1.1315695715086544
Energy: 1.1957879657339703
Energy: 1.131023563598532
Energy: 1.131875663671461
Energy: 1.131023563598532
Energy: 1.130638076617521
Energy: 1.3978734627542693
Energy: 1.2252327964702483
Energy: 1.3978734627534253
Energy: 1.2741898709721593
Energy: 1.400666639718422
Energy: 1.1342117054764818
Energy: 1.4006666397192664
Energy: 1.1325647242815455
Energy: 1.1313179806645397
Energy: 1.2261367709069788
Energy: 1.1313179806636955
Energy: 1.1606526632855494
Energy: 1.1581633916430125
Energy: 1.1566153748079708
Energy: 1.1581633916421683
Energy: 1.1775194974004852
Energy: 1.192427130502947
Energy: 1.2156211774870997
Energy: 1.1924271305037912
Energy: 1.2009775044466724
Energy: 1.1928034764384152
Energy: 1.1927785677310558
Energy: 1.1928034764375708
Energy: 1.1896195595684496
Energy: 1.1936028891606434
Energy: 1.1929669776815384
Energy: 1.1936028891597992
Energy: 1.1886767968186491
Energy: 1.1927573569375358
Energy: 1.225345123253547
Energy: 1.192757356929938
Energy: 1.1257030967770345
Energy: 1.271424770439866
Energy: 1.1556507915959853
Energy: 1.271424770439022
Energy: 1.189679882436983
Energy: 1.192770357619636
Energy: 1.1541207991070384
Energy: 1.1927703576213247
Energy: 1.1908262768237965
Energy: 1.3425883535874201
Energy: 1.1539578493647218
Energy: 1.3425883535874201
Energy: 1.2317198862129914
Energy: 1.192869857603713
Energy: 1.1916411480351194
Energy: 1.192869857603713

minimum gb energy = 1.1257030967770345 eV
minimum distance =  2.28764123685594 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.8503428127705726
Energy: 1.1243000943274608
Energy: 1.248212761648987
Energy: 1.1243000943274608
Energy: 1.2396645352914588
Energy: 1.177954994536861
Energy: 1.1811957662953207
Energy: 1.177954994536861
Energy: 1.1784052558305107
Energy: 1.1792097776644774
Energy: 1.1987263954878848
Energy: 1.179209777666421
Energy: 1.1802478902302682
Energy: 1.1824924078713657
Energy: 1.1785336732768905
Energy: 1.1824924078713657
Energy: 1.1978262137668245
Energy: 1.1820847391963254
Energy: 1.1067556344995164
Energy: 1.1820847391963254
Energy: 1.1776416543587416
Energy: 1.1835472120909432
Energy: 1.1068339299987553
Energy: 1.1835472120889994
Energy: 1.2351064614596106
Energy: 1.1780091387300557
Energy: 1.1799233224282573
Energy: 1.1780091387300557
Energy: 1.2345584854603762
Energy: 1.1781424356618113
Energy: 1.177631604575689
Energy: 1.1781424356618113
Energy: 1.1802897833400816
Energy: 1.178538685902304
Energy: 1.2006440240308704
Energy: 1.178538685902304
Energy: 1.1790630198901269
Energy: 1.177718232109713
Energy: 1.1792914405049362
Energy: 1.177718232109713
Energy: 1.1981667903276354
Energy: 1.1848713608757602
Energy: 1.107633065461698
Energy: 1.1848713608757602
Energy: 1.1805754832179358
Energy: 1.18190092933625
Energy: 1.110314375503406
Energy: 1.18190092933625
Energy: 1.2345643080440427
Energy: 1.1790994384504099
Energy: 1.1776802911071154
Energy: 1.1790994384485105

minimum gb energy = 1.1067556344995164 eV
minimum distance =  2.2881668527625 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.7492539840595134
Energy: 1.1976877955805987
Energy: 1.3183528806087532
Energy: 1.2196866922531229
Energy: 1.2517480773868634
Energy: 1.168414784317571
Energy: 1.3224699847980315
Energy: 1.1684147843168518
Energy: 1.168754031974298
Energy: 1.1701234024831373
Energy: 1.2298679123054277
Energy: 1.1701234024824179
Energy: 1.172803173467456
Energy: 1.170102462533472
Energy: 1.2767542440385315
Energy: 1.1701024625341911
Energy: 1.170622803952272
Energy: 1.1684722412797608
Energy: 1.274982330684467
Energy: 1.1684722412790416
Energy: 1.2256052420343988
Energy: 1.1686141322732355
Energy: 1.2747699520146953
Energy: 1.1686141322725163
Energy: 1.319793394165425
Energy: 1.2288571999569566
Energy: 1.3163306911763741
Energy: 1.2288571999562374
Energy: 1.3200120856061366
Energy: 1.227705819651211
Energy: 1.2294197825482989
Energy: 1.2277058196504915
Energy: 1.1612923081112847
Energy: 1.383199684104551
Energy: 1.2032124372272595
Energy: 1.383199684106709
Energy: 1.1963075886351833
Energy: 1.3562932739010336
Energy: 1.2327361475292498
Energy: 1.3562932739010336
Energy: 1.1580693583033683
Energy: 1.1579889381364816
Energy: 1.3478877260861697
Energy: 1.157988938135762
Energy: 1.2600249017533334
Energy: 1.2170333001696982
Energy: 1.2792977925900557
Energy: 1.217033300173295
Energy: 1.3170608805006891
Energy: 1.1587541575329514
Energy: 1.3337475222665962
Energy: 1.158754157532232
Energy: 1.3167267917345857
Energy: 1.15920292139656
Energy: 1.1627542743601744
Energy: 1.15920292139656
Energy: 1.2271412762280283
Energy: 1.355849121043134
Energy: 1.1994561585953964
Energy: 1.355849121043134
Energy: 1.1774608326700038
Energy: 1.3810864128000586
Energy: 1.1991116773001462
Energy: 1.3810864127957427
Energy: 1.2343169699452679
Energy: 1.3829535520877265
Energy: 1.162010947445655
Energy: 1.3829535520891654
Energy: 1.2377888768319776
Energy: 1.2299148430793272
Energy: 1.282789253380718
Energy: 1.2299148430807658
Energy: 1.3206207993813808
Energy: 1.228280724500795
Energy: 1.3060658440504553
Energy: 1.2282807245015142
Energy: 1.2297541417262419
Energy: 1.1704871780781223
Energy: 1.184223517982297
Energy: 1.1704871780788417
Energy: 1.3193811557417983
Energy: 1.1693028071973561
Energy: 1.1719824062645783
Energy: 1.1693028071973561
Energy: 1.2748405075629852
Energy: 1.1680640465255243
Energy: 1.1685714817724489
Energy: 1.168064046524805
Energy: 1.27485374099697
Energy: 1.1689289412336459
Energy: 1.2241985714803418
Energy: 1.168928941234365
Energy: 1.3157691826339402
Energy: 1.2284926236048124
Energy: 1.320672136995173
Energy: 1.228492623603374
Energy: 1.2297642797849024
Energy: 1.228030797946062
Energy: 1.3195709647104283
Energy: 1.2280307979453424
Energy: 1.2016591599732043
Energy: 1.4289679845203083
Energy: 1.1601665417011133
Energy: 1.428967984521747
Energy: 1.2338537215997312
Energy: 1.3557028653587588
Energy: 1.1953830582231173
Energy: 1.3557028653580396
Energy: 1.3484188891080413
Energy: 1.1581069636049808
Energy: 1.159067802794123
Energy: 1.1581069636049808
Energy: 1.2794765283945955
Energy: 1.1741127914488316
Energy: 1.203578023462422
Energy: 1.1741127914488316
Energy: 1.335605820860198
Energy: 1.1589141244942465
Energy: 1.3167967159613525
Energy: 1.158914124495685
Energy: 1.162922108086687
Energy: 1.159495315887055
Energy: 1.2328080529845393
Energy: 1.1594953158856163
Energy: 1.1668046426862082
Energy: 1.335639647510651
Energy: 1.2282823923929715
Energy: 1.335639647510651
Energy: 1.1998899104705993
Energy: 1.3787395028466543
Energy: 1.1771636395777128
Energy: 1.3787395028466543
Energy: 1.1606364447340232
Energy: 1.38221561755994
Energy: 1.1856709657854365
Energy: 1.3822156175592206
Energy: 1.2827282931161672
Energy: 1.2291642843988364
Energy: 1.2359524186000423
Energy: 1.2291642843981168

minimum gb energy = 1.157988938135762 eV
minimum distance =  2.28844308632319 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.8635469616277702
Energy: 1.1622116215016796
Energy: 1.181017694497924
Energy: 1.1622116215016796
Energy: 1.1536314392929272
Energy: 1.1672010274910942
Energy: 1.2044591420553779
Energy: 1.167201027489953
Energy: 1.141427860087738
Energy: 1.1678881911640882
Energy: 1.2053276752941622
Energy: 1.1678881911640882
Energy: 1.167646795883021
Energy: 1.1678318973055157
Energy: 1.2433479887382104
Energy: 1.1678318973043746
Energy: 1.1753306714881282
Energy: 1.1737951538543674
Energy: 1.2733711705696995
Energy: 1.1737951538555087
Energy: 1.1947977492606277
Energy: 1.1738308079569788
Energy: 1.2735369951531825
Energy: 1.1738308079569788
Energy: 1.2278091100814332
Energy: 1.2126129654300792
Energy: 1.2705551052382074
Energy: 1.212612965428938
Energy: 1.2274635987476477
Energy: 1.211612392829006
Energy: 1.212882119754306
Energy: 1.211612392829006
Energy: 1.174503157190988
Energy: 1.532425195119433
Energy: 1.211656381849096
Energy: 1.532425195119433
Energy: 1.2000160009005454
Energy: 1.3845451411381466
Energy: 1.213248381583438
Energy: 1.3845451411381466
Energy: 1.1765023855077632
Energy: 1.108703873758831
Energy: 1.1102305134434511
Energy: 1.108703873758831
Energy: 1.1879905618327231
Energy: 1.111057936169841
Energy: 1.2409801682326278
Energy: 1.1110579361686996
Energy: 1.2051608254385697
Energy: 1.3074813159804821
Energy: 1.2115675197773552
Energy: 1.3074813159804821
Energy: 1.2050018633185817
Energy: 1.1574165386892221
Energy: 1.155919687700801
Energy: 1.1574165386892221
Energy: 1.2303226162576177
Energy: 1.201628590329924
Energy: 1.1586913027201045
Energy: 1.201628590329924
Energy: 1.2735253973387077
Energy: 1.1997892595844073
Energy: 1.2063139671086778
Energy: 1.1997892595855486
Energy: 1.2737905711417212
Energy: 1.1978764840845677
Energy: 1.2069058876689156
Energy: 1.1978764840845677
Energy: 1.2130027501609972
Energy: 1.258819013056093
Energy: 1.2287496574557544
Energy: 1.2588190130572343
Energy: 1.191155821066954
Energy: 1.189532051905887
Energy: 1.2276995640711574
Energy: 1.189532051905887
Energy: 1.244242360962564
Energy: 1.299921935714418
Energy: 1.1819955211490412
Energy: 1.299921935714418
Energy: 1.1890737928599058
Energy: 1.3966804708313643
Energy: 1.2013702410295801
Energy: 1.3966804708302232
Energy: 1.2820883558510503
Energy: 1.1815282127384856
Energy: 1.184253408103501
Energy: 1.1815282127384856

minimum gb energy = 1.108703873758831 eV
minimum distance =  2.27598063079916 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.3929624934872593
Energy: 1.14961582490689
Energy: 1.1838206410550158
Energy: 1.1496158249084671
Energy: 1.263463707190377
Energy: 1.364302603578665
Energy: 1.2849722951225762
Energy: 1.3643026035931543
Energy: 1.1446139386659622
Energy: 1.2022382523586361
Energy: 1.25135600121938
Energy: 1.2022382523586361
Energy: 1.153568196955515
Energy: 1.15438317898231
Energy: 1.282092084206116
Energy: 1.154383178980696
Energy: 1.1496757066578802
Energy: 1.1461495689818184
Energy: 1.2390207074552355
Energy: 1.1461495689802048
Energy: 1.3112207331939651
Energy: 1.146140117595945
Energy: 1.2451846145273662
Energy: 1.146140117596752
Energy: 1.2830300808311024
Energy: 1.146625566205409
Energy: 1.3089306562972929
Energy: 1.146625566205409
Energy: 1.2832911252220243
Energy: 1.1453299563652564
Energy: 1.146136632841592
Energy: 1.1453299563628354
Energy: 1.3182180225983118
Energy: 1.2004436431739995
Energy: 1.2005380878891403
Energy: 1.2004436431723855
Energy: 1.234070722691864
Energy: 1.4605926953674109
Energy: 1.1434072968686038
Energy: 1.4605926953674109
Energy: 1.2817867797308955
Energy: 1.1830850938466175
Energy: 1.3095000877380143
Energy: 1.1830850938466175
Energy: 1.1906424748836013
Energy: 1.184919823434339
Energy: 1.286870390719767
Energy: 1.1849198234319178
Energy: 1.188183965587603
Energy: 1.3651103076990294
Energy: 1.186447460830693
Energy: 1.3651103076982223
Energy: 1.1832657366300807
Energy: 1.2970278764932694
Energy: 1.2421238175663039
Energy: 1.2970278764892345
Energy: 1.1862873600667083
Energy: 1.3644698302774134
Energy: 1.1350552854532605
Energy: 1.3644698302766065
Energy: 1.325624206057845
Energy: 1.1847734296797496
Energy: 1.1905793268587996
Energy: 1.1847734296789425
Energy: 1.3252587823351465
Energy: 1.1820988731109916
Energy: 1.282494375063755
Energy: 1.1820988731085704
Energy: 1.1442895789262901
Energy: 1.460622506749884
Energy: 1.2534277029682777
Energy: 1.4606225067482699
Energy: 1.2009642836509622
Energy: 1.2010163777869352
Energy: 1.283692819270302
Energy: 1.2010163777877423
Energy: 1.1453407340904012
Energy: 1.1447544207369063
Energy: 1.322023661945556
Energy: 1.14475442073852
Energy: 1.3081481527738867
Energy: 1.146567132987722
Energy: 1.2389265709691901
Energy: 1.146567132987722
Energy: 1.2831739826003707
Energy: 1.146299388345932
Energy: 1.3107514459616176
Energy: 1.1462993883475459
Energy: 1.2831607497533493
Energy: 1.146226585226277
Energy: 1.147568665149057
Energy: 1.146226585224663
Energy: 1.317058027327567
Energy: 1.20182509243737
Energy: 1.148500132667752
Energy: 1.201825092436563
Energy: 1.2340059417233271
Energy: 1.2025787292254475
Energy: 1.1448878713753228
Energy: 1.2025787292238332
Energy: 1.238897526156661
Energy: 1.3640556637730765
Energy: 1.2112965399337854
Energy: 1.3640556637722694
Energy: 1.1832391657835166
Energy: 1.1858072439099245
Energy: 1.8650404424520166
Energy: 1.1858072439066962
Energy: 1.1855352388119147
Energy: 1.3651583242324834
Energy: 1.1815981841511138
Energy: 1.3651583242357113
Energy: 1.2505496804021952
Energy: 1.299733896586641
Energy: 1.1882186446337122
Energy: 1.2997338965858338
Energy: 1.1833596169309002
Energy: 1.4135538282102467
Energy: 1.2409168073431147
Energy: 1.4135538282118607
Energy: 1.3257814369776653
Energy: 1.1826140884593483
Energy: 1.1874275527194365
Energy: 1.1826140884593483

minimum gb energy = 1.1350552854532605 eV
minimum distance =  2.28494952045224 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.1935419964852316
Energy: 1.1955566043695263
Energy: 1.0831989189915565
Energy: 1.231487426417121
Energy: 1.077762111986789
Energy: 1.1571199805333263
Energy: 1.0802573578761296
Energy: 1.157119980533045
Energy: 1.081898597843537
Energy: 1.1577657452892778
Energy: 1.1406510818385138
Energy: 1.157765745289559
Energy: 1.0814276823925404
Energy: 1.0817153798128953
Energy: 1.0798279291371395
Energy: 1.0817153798123333
Energy: 1.0810327010182474
Energy: 1.0820732591159767
Energy: 1.0764934817920355
Energy: 1.0820732591148834
Energy: 1.0798169184042203
Energy: 1.1575540951141756
Energy: 1.0819822476307632
Energy: 1.1575540951141756
Energy: 1.1407197475248818
Energy: 1.1576465292018978
Energy: 1.0803228928062494
Energy: 1.1576465292018978
Energy: 1.0799913087906114
Energy: 1.0837845033931788
Energy: 1.0796283587657145
Energy: 1.0837845033928977
Energy: 1.0773815079285618
Energy: 1.1406152590660281
Energy: 1.0820769672972004
Energy: 1.1406152590660281

minimum gb energy = 1.0764934817920355 eV
minimum distance =  2.2678818245115 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.40590774448205
Energy: 1.0827128069191427
Energy: 1.2734822222321327
Energy: 1.0865055589437667
Energy: 1.3055234950721977
Energy: 1.0723453699628858
Energy: 1.2377321533722299
Energy: 1.0723453699621233
Energy: 1.2381175662419077
Energy: 1.1674174900186476
Energy: 1.2439063083571842
Energy: 1.1674174900194099
Energy: 1.0918190093768911
Energy: 1.0974833080769555
Energy: 1.2415551654407166
Energy: 1.0974833080792425
Energy: 1.2409526931825616
Energy: 1.0745153444963624
Energy: 1.3530094042125036
Energy: 1.0745153444956
Energy: 1.0768280410889792
Energy: 1.0742651010282969
Energy: 1.3516416160583826
Energy: 1.0742651010298216
Energy: 1.1077595022950155
Energy: 1.1085206780673118
Energy: 1.3425201872952774
Energy: 1.1085206780673118
Energy: 1.0727014882142962
Energy: 1.073098817601869
Energy: 1.38402881819687
Energy: 1.073098817600344
Energy: 1.3039075429628446
Energy: 1.291551979061296
Energy: 1.3860470859826077
Energy: 1.291551979061296
Energy: 1.2748392470935166
Energy: 1.0686915054111124
Energy: 1.072652209749027
Energy: 1.0686915054103499
Energy: 1.3024147169733538
Energy: 1.0689983241680296
Energy: 1.0690936451819
Energy: 1.0689983241672676
Energy: 1.3904507581108072
Energy: 1.0700091174277309
Energy: 1.0716040121200838
Energy: 1.0700091174277309
Energy: 1.393726175199847
Energy: 1.0592696899946663
Energy: 1.3444027693117246
Energy: 1.0592696899931415
Energy: 1.3005986976376678
Energy: 1.1147288429070854
Energy: 1.2446116540319834
Energy: 1.1147288429055606
Energy: 1.0749330050181616
Energy: 1.0780247623225088
Energy: 1.240797624502553
Energy: 1.078024762323271
Energy: 1.07238662751306
Energy: 1.0727224455188633
Energy: 1.3470321121782454
Energy: 1.0727224455188633
Energy: 1.0720948800935088
Energy: 1.0894340282212656
Energy: 1.097186884069154
Energy: 1.089434028220503
Energy: 1.2368894807633546
Energy: 1.0718796341823802
Energy: 1.3075757913257617
Energy: 1.0718796341823802
Energy: 1.268535692130685
Energy: 1.1677956530730897
Energy: 1.2376801603003156
Energy: 1.1677956530730897
Energy: 1.238937261050667
Energy: 1.0993399430514148
Energy: 1.1338650094617515
Energy: 1.0993399430537016
Energy: 1.3506216007580951
Energy: 1.074278320298366
Energy: 1.238585428814703
Energy: 1.0742783202991282
Energy: 1.3542961270400586
Energy: 1.07491338555437
Energy: 1.0792586611275803
Energy: 1.07491338555437
Energy: 1.343608425535422
Energy: 1.1076271595064464
Energy: 1.0756904739493407
Energy: 1.1076271595064464
Energy: 1.394650149658423
Energy: 1.0744411838871293
Energy: 1.0727645537900978
Energy: 1.0744411838871293
Energy: 1.3887340997462405
Energy: 1.1175309895806462
Energy: 1.3022651206962308
Energy: 1.1175309895806462
Energy: 1.0700287355336873
Energy: 1.0690133929031733
Energy: 1.2735516411719707
Energy: 1.0690133929039356
Energy: 1.0692569833785164
Energy: 1.0688332000335932
Energy: 1.3032935038353486
Energy: 1.0688332000328309
Energy: 1.0692211855728606
Energy: 1.0686299499438796
Energy: 1.3046801387699885
Energy: 1.0686299499446419
Energy: 1.19120090397947
Energy: 1.0595810384235644
Energy: 1.3962071829141693
Energy: 1.0595810384235644
Energy: 1.2425135529407207
Energy: 1.1138886513673913
Energy: 1.301639857292167
Energy: 1.1138886513696782
Energy: 1.2432566612066727
Energy: 1.0742703800004814
Energy: 1.073690588654306
Energy: 1.0742703800020064
Energy: 1.346024691860485
Energy: 1.07392921325452
Energy: 1.0743524501455943
Energy: 1.0739292132560447
Energy: 1.0927467485670164
Energy: 1.0793693129214583
Energy: 1.0818391266426863
Energy: 1.0793693129214583

minimum gb energy = 1.0592696899931415 eV
minimum distance =  2.30095559769968 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.478095849812375
Energy: 1.0031305955662089
Energy: 1.213746557038172
Energy: 1.0031305955672631
Energy: 1.3499892538077864
Energy: 1.017196241869391
Energy: 1.2449986652918292
Energy: 1.017196241868337
Energy: 1.2447244119005487
Energy: 1.1230703867112362
Energy: 1.243314559636431
Energy: 1.1230703867101826
Energy: 1.0596367553021508
Energy: 1.1362115084291464
Energy: 1.2473765474104748
Energy: 1.1362115084302002
Energy: 1.2480654296401803
Energy: 1.0199350987091287
Energy: 1.4016384740289003
Energy: 1.0199350987070204
Energy: 1.0216391016471549
Energy: 1.0194962266679541
Energy: 1.4023704498288523
Energy: 1.019496226665846
Energy: 1.0320526215526995
Energy: 1.0328091086730036
Energy: 1.3988138616479542
Energy: 1.0328091086719495
Energy: 1.0177499591586638
Energy: 1.0177655785447688
Energy: 1.4510439453105186
Energy: 1.0177655785426607
Energy: 1.4013809993655517
Energy: 1.0759473157719694
Energy: 1.4552984020798256
Energy: 1.0759473157698614
Energy: 1.268093601661218
Energy: 1.0177589664462379
Energy: 1.0191119427323596
Energy: 1.0177589664451838
Energy: 1.399081719514536
Energy: 1.0333892932290833
Energy: 1.0316239935557574
Energy: 1.0333892932290833
Energy: 1.4583540286353482
Energy: 1.0189188920783399
Energy: 1.0201075854166177
Energy: 1.018918892080448
Energy: 1.4541034963489972
Energy: 1.0213062021452821
Energy: 1.2432447104742488
Energy: 1.0213062021442283
Energy: 1.3997840083099453
Energy: 1.018756892508305
Energy: 1.2435999062857825
Energy: 1.018756892506197
Energy: 1.0348440825222158
Energy: 1.1220359474260144
Energy: 1.2453070555698782
Energy: 1.1220359474260144
Energy: 1.0332278165022304
Energy: 1.3110088196823189
Energy: 1.4031625463913395
Energy: 1.311008819681265
Energy: 1.0356801148444907
Energy: 1.032925578632661
Energy: 1.2476088159317735
Energy: 1.032925578633715
Energy: 1.0177069633175202
Energy: 1.017882147478826
Energy: 1.4037882276997613
Energy: 1.017882147478826
Energy: 1.0318339108651262
Energy: 1.0326851640733445
Energy: 1.4532329114230491
Energy: 1.0326851640722903
Energy: 1.0217314307877472
Energy: 1.0790305630740498
Energy: 1.4510366923024829
Energy: 1.079030563078266
Energy: 1.2487510056758824
Energy: 1.036119984100729
Energy: 1.3990300755223781
Energy: 1.0361199840986208
Energy: 1.2512198719389291
Energy: 1.0180597599144028
Energy: 1.018353746471669
Energy: 1.0180597599144028
Energy: 1.3998082012954298
Energy: 1.0203982048080802
Energy: 1.0190270532417038
Energy: 1.020398204809134
Energy: 1.4540975828712976
Energy: 1.0319810098900142
Energy: 1.0208619349151422
Energy: 1.0319810098889601

minimum gb energy = 1.0031305955662089 eV
minimum distance =  2.28114970344848 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.5579096080048949
Energy: 1.0001026878673889
Energy: 1.2344271023318545
Energy: 1.0109076164371407
Energy: 1.2326894464955358
Energy: 1.0112890564318329
Energy: 1.1565115892672788
Energy: 1.0112890564324843
Energy: 1.2862516290409447
Energy: 1.2394262696820555
Energy: 1.1645494964557084
Energy: 1.239426269682707
Energy: 1.294075128039443
Energy: 1.0660021688993393
Energy: 1.1635907955959985
Energy: 1.0660021688973849
Energy: 1.285040892584136
Energy: 0.9967773557645786
Energy: 1.4220156183992723
Energy: 0.9967773557652301
Energy: 0.9976935844674881
Energy: 0.9976950920110598
Energy: 1.5134084454970087
Energy: 0.9976950920117112
Energy: 0.9968421424417936
Energy: 0.9972804496038098
Energy: 1.35022662553474
Energy: 0.9972804496044613
Energy: 0.9983492795346401
Energy: 0.9976595935583619
Energy: 1.552531187237856
Energy: 0.9976595935596648
Energy: 1.4130824436589013
Energy: 0.9977509483957888
Energy: 1.4751465376664046
Energy: 0.9977509483944857
Energy: 1.1706231466465937
Energy: 1.0612635248238322
Energy: 1.1596252659602035
Energy: 1.0612635248244242
Energy: 1.413047706867105
Energy: 1.0201351978563258
Energy: 1.038244335281165
Energy: 1.0201351978556743
Energy: 1.5106922628754174
Energy: 1.013374776101406
Energy: 1.1605011869865294
Energy: 1.0133747760994516
Energy: 1.5171441637422851
Energy: 1.0195692754071797
Energy: 1.021497829528964
Energy: 1.0195692754078312
Energy: 1.390300830358885
Energy: 1.0187283422095739
Energy: 1.01683361422903
Energy: 1.0187283422095739
Energy: 1.2921389138533907
Energy: 1.0169509465023896
Energy: 1.011794887076724
Energy: 1.0169509465023896
Energy: 1.5469750389324084
Energy: 1.0189117599550739
Energy: 1.5042761072796076
Energy: 1.0189117599557251
Energy: 1.015712126897228
Energy: 1.0122493582105456
Energy: 1.4251756100481368
Energy: 1.0122493582105456
Energy: 1.0192978452339148
Energy: 1.0198599018736796
Energy: 1.507290900828278
Energy: 1.0198599018723766
Energy: 1.0111733026745315
Energy: 1.0109992264336365
Energy: 1.4723695223518898
Energy: 1.0109992264336365
Energy: 1.1605663769078591
Energy: 1.0203592493265758
Energy: 1.555793250245723
Energy: 1.0203592493252727
Energy: 1.1577880108708576
Energy: 1.0120352195779632
Energy: 1.2557966065950517
Energy: 1.0120352195766602
Energy: 1.1594801656435851
Energy: 1.2403508207872314
Energy: 1.2876842689337842
Energy: 1.2403508207859284
Energy: 1.1667909180294762
Energy: 1.0652964738654016
Energy: 1.291687654565952
Energy: 1.0652964738647501
Energy: 1.4233422569727603
Energy: 0.9970062204056119
Energy: 1.147889406287923
Energy: 0.9970062204056119
Energy: 1.5103806743975825
Energy: 0.9979124056043451
Energy: 0.99829779281227
Energy: 0.9979124056049965
Energy: 1.3501129831316085
Energy: 0.9965996515496538
Energy: 0.9962984526448246
Energy: 0.9965996515496538
Energy: 1.5567028751453535
Energy: 0.9983843610005679
Energy: 1.0000485229595062
Energy: 0.9983843610012194
Energy: 1.4713391299842247
Energy: 0.997262645829887
Energy: 1.4142781991463584
Energy: 0.9972626458324929
Energy: 1.1586386729729747
Energy: 1.0604761553629485
Energy: 1.1690665816084007
Energy: 1.060476155364903
Energy: 1.037618788582163
Energy: 1.0204166720494425
Energy: 1.414185571606573
Energy: 1.0204166720500938
Energy: 1.1634689479735063
Energy: 1.0204810282048764
Energy: 1.5128450144141068
Energy: 1.0204810282055279
Energy: 1.020305781016556
Energy: 1.020346361636166
Energy: 1.513935746284476
Energy: 1.020346361636166
Energy: 1.0190723772857349
Energy: 1.0196199942412782
Energy: 1.3906795203214706
Energy: 1.0196199942419297
Energy: 1.0122821274490916
Energy: 1.0113629641793074
Energy: 1.2950643281235559
Energy: 1.0113629641806103
Energy: 1.5058092955087947
Energy: 1.0200727290867384
Energy: 1.5435543618659517
Energy: 1.0200727290867384
Energy: 1.4273081635024143
Energy: 1.0126252959647881
Energy: 1.0138408247524524
Energy: 1.0126252959660909
Energy: 1.5051382740204715
Energy: 1.019982770805366
Energy: 1.0189134577789254
Energy: 1.0199827708060176
Energy: 1.4758385332253554
Energy: 1.011658400620612
Energy: 1.0124009109348768
Energy: 1.011658400621915

minimum gb energy = 0.9962984526448246 eV
minimum distance =  2.298383444348 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 2.032041460443903
Energy: 0.9109365287148627
Energy: 0.9094843364578491
Energy: 0.9089060291469703
Energy: 1.5948336106269905
Energy: 0.9865637906967446
Energy: 0.9127518039754127
Energy: 0.9865637906967446
Energy: 0.9077389060114143
Energy: 0.986563239278584
Energy: 0.9150104763271297
Energy: 0.986563239278584
Energy: 0.9046647166465391
Energy: 0.9869596772094826
Energy: 0.910728438539824
Energy: 0.9869596772094826
Energy: 0.9079500569631692
Energy: 0.906244499755428
Energy: 1.2617736522160328
Energy: 0.906244499755428
Energy: 0.9056894866998911
Energy: 0.9061420584218929
Energy: 1.261210674415576
Energy: 0.9061420584218929
Energy: 0.9048460738720024
Energy: 0.9059783878772878
Energy: 0.9105929960314185
Energy: 0.9059783878772878
Energy: 0.9075401016754976
Energy: 0.9064560410790106
Energy: 1.5920502302709845
Energy: 0.9064560410790106
Energy: 0.9126476243723647
Energy: 0.9061924361752645
Energy: 1.5960996725851102
Energy: 0.9061924361769691
Energy: 1.2565157266499474
Energy: 0.9876330696519436
Energy: 0.9092444761636949
Energy: 0.9876330696519436
Energy: 0.9128482597526363
Energy: 0.9886388359666244
Energy: 0.9050676107605587
Energy: 0.9886388359666244
Energy: 1.2601357088391278
Energy: 0.9058804222433849
Energy: 0.9084344578117132
Energy: 0.9058804222450896
Energy: 1.262638319974935
Energy: 0.9060888489695896
Energy: 0.9068053129698446
Energy: 0.9060888489679237
Energy: 0.9098775630400323
Energy: 0.9057376667938143
Energy: 0.9052294694875547
Energy: 0.9057376667938143
Energy: 1.589317296258447
Energy: 0.9065936177734112
Energy: 0.9063509673457282
Energy: 0.9065936177717067

minimum gb energy = 0.9046647166465391 eV
minimum distance =  2.29145927702508 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.482639394108343
Energy: 0.8315235239835504
Energy: 1.1072018174346918
Energy: 0.8315235239799781
Energy: 1.4672297465162183
Energy: 0.8391905310368283
Energy: 1.012938209365307
Energy: 0.8391905310368283
Energy: 1.46736503780541
Energy: 0.8372926395074176
Energy: 1.0075090412890524
Energy: 0.83729263951099
Energy: 1.1909632044674139
Energy: 0.8395440837928263
Energy: 1.1657743962176044
Energy: 0.839544083792112
Energy: 1.1669577476907962
Energy: 0.8377758651556788
Energy: 1.3215503903971813
Energy: 0.8377758651542498
Energy: 1.0093139282654122
Energy: 0.8385635360035113
Energy: 1.3197933934519008
Energy: 0.8385635360020823
Energy: 1.0093229631355773
Energy: 0.8373771076724934
Energy: 1.1634952094324233
Energy: 0.8373771076732079
Energy: 1.011534305343349
Energy: 0.837757566817324
Energy: 1.6231250957366459
Energy: 0.8377575668158952
Energy: 0.8366412181608899
Energy: 0.8420029300849707
Energy: 1.4512998724655783
Energy: 0.8420029300856852
Energy: 0.8358106550828778
Energy: 0.8368396513558463
Energy: 1.3238958676534023
Energy: 0.8368396513558463
Energy: 0.8384866962510347
Energy: 0.8416958700648866
Energy: 1.481014979391954
Energy: 0.841695870064172
Energy: 1.3196425873933817
Energy: 0.8839953590145203
Energy: 1.1690037423728734
Energy: 0.8839953590123768
Energy: 1.323113712824785
Energy: 0.881443522507944
Energy: 1.318149723534794
Energy: 0.8814435225086584
Energy: 1.323593834456346
Energy: 0.8849244876866721
Energy: 1.1887919401679774
Energy: 0.8849244876888155
Energy: 1.619007304727936
Energy: 0.840325467343521
Energy: 1.1652426117552264
Energy: 0.8403254673449497
Energy: 1.6167494202239798
Energy: 0.8380858421977382
Energy: 0.8423836550711473
Energy: 0.838085842203454
Energy: 1.4427009665033868
Energy: 0.8370560116406461
Energy: 0.8400295799870476
Energy: 0.8370560116363593
Energy: 1.477589383734408
Energy: 0.83856303179029
Energy: 0.8379570018278636
Energy: 0.8385630317924334
Energy: 1.757419907247608
Energy: 0.8413221736367847
Energy: 1.0056995966733593
Energy: 0.8413221736353559
Energy: 1.3247550623659832
Energy: 0.8365683447915874
Energy: 1.0165198989745634
Energy: 0.836568344789444
Energy: 1.1934027407424612
Energy: 0.8385722878663875
Energy: 1.0081095135876557
Energy: 0.838572287865673
Energy: 1.3263938336072794
Energy: 0.8362041277407747
Energy: 1.3197790826746965
Energy: 0.8362041277450616
Energy: 1.0122105127332892
Energy: 0.8399500797565727
Energy: 1.3217219207219049
Energy: 0.8399500797537148
Energy: 0.8428707342989088
Energy: 0.8366998308181246
Energy: 1.1653971772421172
Energy: 0.8366998308174101
Energy: 1.0091337320515896
Energy: 0.837702341966091
Energy: 1.6207313727608603
Energy: 0.837702341966091
Energy: 0.8368079521816697
Energy: 0.8366573291655978
Energy: 1.6176111758981404
Energy: 0.8366573291648833
Energy: 0.8364261301450063
Energy: 0.8360600564499794
Energy: 1.3235690118616008
Energy: 0.8360600564471216
Energy: 0.8440628175512327
Energy: 0.8406477018513175
Energy: 1.4771004315113663
Energy: 0.840647701852032
Energy: 1.3180725076368132
Energy: 0.8369479578902231
Energy: 1.1842440024222942
Energy: 0.8369479578887942
Energy: 1.018962055023884
Energy: 0.8846156939117289
Energy: 1.3183257801236716
Energy: 0.8846156939117289
Energy: 1.320120423118422
Energy: 0.8874423218945172
Energy: 1.1759221223555285
Energy: 0.8874423218916594
Energy: 1.615573101580831
Energy: 0.8379005212465536
Energy: 1.1647941281569085
Energy: 0.8379005212429812
Energy: 1.6181559436262174
Energy: 0.8402824065327907
Energy: 0.8388876080650763
Energy: 0.8402824065313617
Energy: 1.4445406680247364
Energy: 0.8362033784006925
Energy: 0.8357240899456431
Energy: 0.8362033784042647
Energy: 1.762862475038367
Energy: 0.8378524291566257
Energy: 0.8391902201628268
Energy: 0.8378524291587041

minimum gb energy = 0.8315235239799781 eV
minimum distance =  2.28895414817347 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.3233694736386536
Energy: 0.743715952709393
Energy: 0.7310996097707424
Energy: 0.7361881120935417
Energy: 1.3103615785485785
Energy: 0.7279142740783557
Energy: 1.0200790632351833
Energy: 0.7279142740783557
Energy: 1.3090617365288082
Energy: 0.7269759358472907
Energy: 1.0213048704953525
Energy: 0.7269759358472907
Energy: 1.308709579362801
Energy: 0.8165210008099466
Energy: 1.0214458388205399
Energy: 0.8165210008099466
Energy: 1.3143902475097151
Energy: 0.8161698149139821
Energy: 1.0266198207886177
Energy: 0.8161698149139821
Energy: 0.7332953102917146
Energy: 0.7279761104833347
Energy: 1.2776758697157733
Energy: 0.7279761104845639
Energy: 0.7309352442309015
Energy: 0.7267522325685934
Energy: 1.3139046231053348
Energy: 0.7267522325685934
Energy: 0.7320729723742262
Energy: 0.7315318701613904
Energy: 1.56273104536236
Energy: 0.7315318701613904
Energy: 0.7266693800210575
Energy: 0.7293264871011333
Energy: 1.5642301447866314
Energy: 0.7293264871035917
Energy: 0.7264041604389614
Energy: 0.7283577291980284
Energy: 1.3077589136275793
Energy: 0.7283577291980284
Energy: 0.7310996083553092
Energy: 0.7437159527118514
Energy: 1.3233694736509458
Energy: 0.7437159527118514
Energy: 1.0200790632339543
Energy: 0.727914274079585
Energy: 1.4450392276828694
Energy: 0.7279142740783557
Energy: 1.0213048704953525
Energy: 0.7269759358485198
Energy: 1.3090617365288082
Energy: 0.7269759358485198
Energy: 1.0214458388181094
Energy: 0.8165210008099466
Energy: 1.3087095793640304
Energy: 0.8165210008111758
Energy: 1.0266198207886177
Energy: 0.8161698149139821
Energy: 1.3143902475109444
Energy: 0.8161698149139821
Energy: 1.1827035250026041
Energy: 0.7279761104833347
Energy: 0.7332953102917146
Energy: 0.7279761104845639
Energy: 1.3139046231041056
Energy: 0.7267522325685934
Energy: 0.7309352442309015
Energy: 0.7267522325685934
Energy: 1.56273104536236
Energy: 0.7315318701613904
Energy: 0.7320729723754554
Energy: 0.7315318701626197
Energy: 1.5642301447866314
Energy: 0.7293264871023625
Energy: 0.7266693800210575
Energy: 0.7293264871035917
Energy: 1.3103623265460387
Energy: 0.7283577291980284
Energy: 0.7264041604377323
Energy: 0.7283577291967993

minimum gb energy = 0.7264041604377323 eV
minimum distance =  2.29548667078826 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.5395651578470448
Energy: 0.6470944372413748
Energy: 0.9288434969098205
Energy: 0.6453701039315628
Energy: 1.5366964883804266
Energy: 0.6350993005358295
Energy: 0.8744327079646729
Energy: 0.6350993005358295
Energy: 1.5275488384126295
Energy: 0.6347464693741796
Energy: 0.875542530996652
Energy: 0.6347464693741796
Energy: 1.117906481012594
Energy: 0.6383719636056211
Energy: 1.117796072796025
Energy: 0.6383719636046612
Energy: 1.533135669512099
Energy: 0.9456023894496921
Energy: 1.3224436545294207
Energy: 0.9456023894496921
Energy: 1.1115889043084775
Energy: 0.7002760861423077
Energy: 1.3207303454667607
Energy: 0.7002760861432676
Energy: 1.1143069862827326
Energy: 0.9453521858726982
Energy: 1.5328085697271978
Energy: 0.9453521858717383
Energy: 1.1178848157818457
Energy: 0.637372649337377
Energy: 1.327677089306404
Energy: 0.6373726493383368
Energy: 0.8755110460888667
Energy: 0.6345646449512967
Energy: 1.5372393691620156
Energy: 0.6345646449503368
Energy: 0.8759847640258431
Energy: 0.6352476989264695
Energy: 1.5347096106440536
Energy: 0.6352476989274292
Energy: 0.6396082785008722
Energy: 0.6384884907216364
Energy: 1.330500714465159
Energy: 0.6384884907206766
Energy: 0.6357579698876638
Energy: 0.6356994546165439
Energy: 1.5346380774469397
Energy: 0.6356994546175037
Energy: 0.6350325959224289
Energy: 0.6369404707031148
Energy: 1.5282598909723126
Energy: 0.6369404707021549
Energy: 0.8794393046687068
Energy: 0.6395626694250574
Energy: 1.5357239759969583
Energy: 0.6395626694231377
Energy: 0.8754886426267425
Energy: 0.634634450812481
Energy: 1.5329636210841586
Energy: 0.6346344508115211
Energy: 0.8775439378905188
Energy: 0.6355783141627459
Energy: 1.5307248198336951
Energy: 0.635578314161786
Energy: 1.322252901109554
Energy: 0.6374124647715341
Energy: 1.533256591834918
Energy: 0.6374124647705742
Energy: 0.8788531717883751
Energy: 0.7025714142723424
Energy: 1.3259823205325834
Energy: 0.7025714142723424
Energy: 1.3196990380337976
Energy: 0.70178874610676
Energy: 1.113683591523247
Energy: 0.7017887461096395
Energy: 1.5353278243734023
Energy: 0.9450703062351065
Energy: 1.1127798560849123
Energy: 0.9450703062351065
Energy: 1.3288702992825785
Energy: 0.6380144050824172
Energy: 0.8778397205267985
Energy: 0.6380144050824172
Energy: 1.5341090112599833
Energy: 0.6341754501260696
Energy: 0.6361739611598087
Energy: 0.6341754501260696
Energy: 1.7361579079233302
Energy: 0.6363248559360635
Energy: 0.8745761969468727
Energy: 0.6363248559360635
Energy: 1.3287457107881793
Energy: 0.639514051221531
Energy: 0.6381738254262539
Energy: 0.639514051221531
Energy: 1.5327767142245299
Energy: 0.6346743975102388
Energy: 0.6341844893273182
Energy: 0.634674397509279
Energy: 1.5314948956726122
Energy: 0.6359277768011617
Energy: 0.6373758468566729
Energy: 0.635927776800202

minimum gb energy = 0.6341754501260696 eV
minimum distance =  2.30105666648091 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.6819438272489615
Energy: 0.5802646141793998
Energy: 0.884279229790332
Energy: 0.5807100966129738
Energy: 1.6800718396887775
Energy: 0.5725199578379787
Energy: 0.7705836453913935
Energy: 0.5725199578403395
Energy: 1.6714090243886153
Energy: 0.5702877473864147
Energy: 0.773169785315871
Energy: 0.5702877473864147
Energy: 1.3255627254010391
Energy: 0.5740947877474594
Energy: 1.1505385553300072
Energy: 0.5740947877466724
Energy: 1.674124703515191
Energy: 0.5692043280308879
Energy: 1.1475863297223972
Energy: 0.5692043280301009
Energy: 1.3183105123784236
Energy: 0.8521274381008704
Energy: 1.1441086795127522
Energy: 0.8521274381008704
Energy: 1.322773093476407
Energy: 0.6250686497283009
Energy: 1.4956333205413994
Energy: 0.6250686497290879
Energy: 1.3233265374354666
Energy: 0.6274194143493077
Energy: 1.151545984217531
Energy: 0.6274194143547446
Energy: 0.9720958461804998
Energy: 0.5696109410339165
Energy: 1.4941139465370166
Energy: 0.5696109410331296
Energy: 0.9708660005588451
Energy: 0.5691884109891503
Energy: 1.676409122107645
Energy: 0.5691884109875766
Energy: 0.7768502714411646
Energy: 0.5764663336609696
Energy: 1.5047299994677272
Energy: 0.5764663336586088
Energy: 0.7725845630012198
Energy: 0.5694248133477958
Energy: 1.675838971316198
Energy: 0.5694248133485829
Energy: 0.7717951987539049
Energy: 0.572986353600928
Energy: 1.8466260761343258
Energy: 0.5729863535993541
Energy: 0.5753304067493034
Energy: 0.5762017580331973
Energy: 1.5040428259296368
Energy: 0.5762017580331973
Energy: 0.5700228702189952
Energy: 0.5696339988411697
Energy: 1.6750728284843803
Energy: 0.5696339988403829
Energy: 0.5741810401786235
Energy: 0.5718762504105982
Energy: 1.675450309438716
Energy: 0.5718762504113851
Energy: 0.7753267392549626
Energy: 0.5730293366736221
Energy: 1.678308503623931
Energy: 0.5730293366728352
Energy: 0.7747613564805514
Energy: 0.5708666243779308
Energy: 1.6760962480053956
Energy: 0.5708666243779308
Energy: 0.7728341735579601
Energy: 0.5720656446984311
Energy: 1.3217130936173673
Energy: 0.572065644699218
Energy: 1.1459260825191657
Energy: 0.5705056313437189
Energy: 1.3208969271839173
Energy: 0.5705056313437189
Energy: 1.1505861685985026
Energy: 0.5698227875671192
Energy: 1.4955266917465009
Energy: 0.5698227875663321
Energy: 1.1460779317774215
Energy: 0.6275542793066234
Energy: 1.324870568650058
Energy: 0.6275542793066234
Energy: 1.494661337436447
Energy: 0.6233658541121256
Energy: 1.3174421435106125
Energy: 0.6233658541129126
Energy: 1.1498247347207984
Energy: 0.6284907784706828
Energy: 1.1461122982901744
Energy: 0.628490778469896
Energy: 1.4962322741030354
Energy: 0.5746103475586469
Energy: 0.9780410597610265
Energy: 0.5746103475602207
Energy: 1.4973533881715484
Energy: 0.5705086735604251
Energy: 1.1449427977170945
Energy: 0.5705086735572775
Energy: 1.4998443832546338
Energy: 0.5724104852671293
Energy: 0.7768271773006006
Energy: 0.5724104852679163
Energy: 1.6748672705964023
Energy: 0.5698887920083798
Energy: 0.7736583829918573
Energy: 0.5698887920091666
Energy: 1.5003874801099406
Energy: 0.5740583904021646
Energy: 0.7747623183219517
Energy: 0.5740583904021646
Energy: 1.498804993012064
Energy: 0.5720009346605346
Energy: 0.5747200917456532
Energy: 0.5720009346597477
Energy: 1.674650710278542
Energy: 0.569308514994461
Energy: 0.5705686281168496
Energy: 0.5693085149952479
Energy: 1.6804098204272522
Energy: 0.5756606482704871
Energy: 0.5762363949170568
Energy: 0.5756606482704871

minimum gb energy = 0.5691884109875766 eV
minimum distance =  2.30330325135141 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.4776120198721514
Energy: 0.5253437407751714
Energy: 0.8489783734956998
Energy: 0.5315099040294942
Energy: 1.7789464618462165
Energy: 0.5229838501645466
Energy: 0.7027041426614985
Energy: 0.5229838501645466
Energy: 1.7716117745671665
Energy: 0.5229732997723052
Energy: 0.6968017899499455
Energy: 0.5229732997723052
Energy: 1.4747035984816885
Energy: 0.5264250136011023
Energy: 1.0221156788760117
Energy: 0.526425013601769
Energy: 1.7744384171683316
Energy: 0.519875425933776
Energy: 1.0171592916111256
Energy: 0.5198754259351093
Energy: 1.4673825741056075
Energy: 0.5211528011776623
Energy: 1.0142420072577105
Energy: 0.5211528011803288
Energy: 1.1674525973640848
Energy: 0.7846109098623955
Energy: 1.3161184224026496
Energy: 0.7846109098617287
Energy: 1.4709382615939717
Energy: 0.5711592897849627
Energy: 1.021435496485033
Energy: 0.5711592897962349
Energy: 1.1640358106103121
Energy: 0.5712430917665875
Energy: 1.3133545640055566
Energy: 0.5712430917699207
Energy: 1.163099194416912
Energy: 0.7845841710499274
Energy: 1.6176331888177569
Energy: 0.7845841710925918
Energy: 1.022146029109286
Energy: 0.5232056292344821
Energy: 1.3247925986529803
Energy: 0.5232056292331487
Energy: 0.8693496976619267
Energy: 0.5201435149180895
Energy: 1.6174913898205616
Energy: 0.5201435149174229
Energy: 1.016028651447631
Energy: 0.5208752036172053
Energy: 1.6186664461644849
Energy: 0.5208752036172053
Energy: 0.7036259062795069
Energy: 0.5264012679638482
Energy: 1.3211818201446999
Energy: 0.5264012679645148
Energy: 0.697751351159935
Energy: 0.5215191308779172
Energy: 1.774434085867614
Energy: 0.5215191308792505
Energy: 0.6967071577536288
Energy: 0.5237208148474386
Energy: 1.6230858556336822
Energy: 0.523720814846772
Energy: 0.526617159885499
Energy: 0.5246584723724768
Energy: 1.6253899782481134
Energy: 0.52465847237381
Energy: 0.5211080197823418
Energy: 0.5219646419946986
Energy: 1.7743827573456903
Energy: 0.5219646419953653
Energy: 0.527263689331518
Energy: 0.5241899613794834
Energy: 1.472366651532217
Energy: 0.5241899613781501
Energy: 0.6983161937194241
Energy: 0.5244257261759219
Energy: 1.776824474477964
Energy: 0.5244257261759219
Energy: 0.6968562540842971
Energy: 0.5217446199590767
Energy: 1.7739631810072019
Energy: 0.5217446199590767
Energy: 0.6991536900360928
Energy: 0.5258969805297851
Energy: 1.473604442820305
Energy: 0.5258969805297851
Energy: 1.0147240747363317
Energy: 0.5209620392493203
Energy: 1.4660730363640535
Energy: 0.5209620392453205
Energy: 1.0189179201525345
Energy: 0.520661354122815
Energy: 1.6202873347062088
Energy: 0.5206613539642172
Energy: 1.0204644547006134
Energy: 0.5271247354842511
Energy: 1.1701322514066053
Energy: 0.5271247354782516
Energy: 1.3151562070915768
Energy: 0.7837148033612681
Energy: 1.619969216311638
Energy: 0.7837148033619347
Energy: 1.0173450410134222
Energy: 1.0131864534940256
Energy: 1.3160466645548703
Energy: 1.0131864534926924
Energy: 1.3205153253882447
Energy: 0.7868289132803183
Energy: 1.1704823286659831
Energy: 0.7868289132803183
Energy: 1.319215820020095
Energy: 0.7842410271802763
Energy: 1.3168893762566676
Energy: 0.7842410271796098
Energy: 1.3156454483894664
Energy: 0.5213296153693318
Energy: 1.0167481825572011
Energy: 0.521329615365332
Energy: 1.6260737486798493
Energy: 0.5202012954125035
Energy: 0.8696194418230953
Energy: 0.5202012954105036
Energy: 1.3215388275130067
Energy: 0.5257104453833868
Energy: 1.020447621498546
Energy: 0.5257104453840534
Energy: 1.6191729415256346
Energy: 0.5219536134711704
Energy: 0.696609331847742
Energy: 0.5219536134698372
Energy: 1.7764448388006715
Energy: 0.5225124506317738
Energy: 0.6961251889129217
Energy: 0.5225124506311072
Energy: 1.6296404061242602
Energy: 0.5301245871410416
Energy: 0.7028888427530591
Energy: 0.5301245871410416
Energy: 1.7760858495602392
Energy: 0.5231956528179073
Energy: 0.5238335438403773
Energy: 0.5231956528172405
Energy: 1.771369809803598
Energy: 0.5230764040780846
Energy: 0.5226897689604605
Energy: 0.5230764040780846

minimum gb energy = 0.519875425933776 eV
minimum distance =  2.30328652447761 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.6417372214661703
Energy: 0.44938923526863045
Energy: 0.4474360837017359
Energy: 0.4493892352680523
Energy: 1.8242705484263568
Energy: 0.4477116991793299
Energy: 0.6053010909749197
Energy: 0.4477116991793299
Energy: 1.628021659758989
Energy: 0.4464554205842073
Energy: 0.6059397438089943
Energy: 0.44645542058362914
Energy: 1.35903489861429
Energy: 0.45066807297708256
Energy: 0.8947616550673516
Energy: 0.45066807297766076
Energy: 1.6942590990758088
Energy: 0.4469252355407744
Energy: 0.8963422101196545
Energy: 0.4469252355396181
Energy: 1.35986342951016
Energy: 0.4475710111743058
Energy: 0.8948867839391217
Energy: 0.4475710111743058
Energy: 1.361591536561941
Energy: 0.448119002490777
Energy: 1.1631229983017857
Energy: 0.44811900247863545
Energy: 1.4314121424127575
Energy: 0.4470576653147739
Energy: 0.959239401194793
Energy: 0.44705766686879234
Energy: 1.3634670157467699
Energy: 0.7075466386479604
Energy: 1.1607333236693131
Energy: 0.7075466386468041
Energy: 1.3633091849956822
Energy: 0.9154556727866796
Energy: 1.426981462026893
Energy: 0.9154556727878359
Energy: 1.164766432835293
Energy: 0.4452509724109968
Energy: 1.2247028789606322
Energy: 0.4452513686151174
Energy: 1.096044063684794
Energy: 0.44546116080417514
Energy: 1.426840959087922
Energy: 0.4454611608151604
Energy: 1.1623985005041806
Energy: 0.44573307785657906
Energy: 1.4945335902539854
Energy: 0.44573307785600086
Energy: 0.8983620337803278
Energy: 0.4465668310078884
Energy: 1.2231898051217234
Energy: 0.44656683101077926
Energy: 0.8290086341714863
Energy: 0.4450464839617425
Energy: 1.6887981424964813
Energy: 0.4450464839617425
Energy: 0.8973123825280017
Energy: 0.44633108528519355
Energy: 1.4949623817519127
Energy: 0.44633108528519355
Energy: 0.595835474769093
Energy: 0.4467922581311963
Energy: 1.4964958844275895
Energy: 0.4467922581317744
Energy: 0.597993206156434
Energy: 0.4454349652799552
Energy: 1.7562136659694563
Energy: 0.44543496527879883
Energy: 0.5952808520299517
Energy: 0.4447070915315555
Energy: 1.7664592071761458
Energy: 0.4447070915315555
Energy: 0.5255213904077207
Energy: 0.4446032486990455
Energy: 1.764453953852505
Energy: 0.4446032487002018
Energy: 0.5240283140414913
Energy: 0.44358123185026954
Energy: 1.819994428767299
Energy: 0.44358123185026954
Energy: 0.5227318559137868
Energy: 0.44406702891904476
Energy: 1.5587596217356015
Energy: 0.4440670289202011
Energy: 0.6816532837985472
Energy: 0.44545347643217154
Energy: 1.8260607309550942
Energy: 0.4454534764315934
Energy: 0.6864365326398719
Energy: 0.44463069016245854
Energy: 1.817708610316594
Energy: 0.44463069016361495
Energy: 0.6807866506651477
Energy: 0.44937764835328425
Energy: 1.35351963272154
Energy: 0.4493776483538625
Energy: 0.8875530510291898
Energy: 0.44509511777294475
Energy: 1.822672058242298
Energy: 0.44509511777178845
Energy: 0.8879387346610811
Energy: 0.4450765886701501
Energy: 1.6245157442876912
Energy: 0.4450765886701501
Energy: 1.167023932085853
Energy: 0.44719978789543396
Energy: 1.3586261767900047
Energy: 0.4471997878960122
Energy: 1.1661770106457756
Energy: 0.4447533297344847
Energy: 1.626882644307939
Energy: 0.4447534575413788
Energy: 1.1643392404565094
Energy: 0.4446460971725257
Energy: 1.3602112587129496
Energy: 0.4446460965934611
Energy: 1.4300781899327977
Energy: 0.7108242980059036
Energy: 1.0898765894156663
Energy: 0.7108242980030128
Energy: 1.2288891306714527
Energy: 0.6397270283811207
Energy: 1.366942347822937
Energy: 0.6397270283788081
Energy: 1.4291025110129758
Energy: 0.7035625739815892
Energy: 1.0929976725768564
Energy: 0.7035625739804329
Energy: 1.6901077266188824
Energy: 0.44730858444069455
Energy: 1.0937760025029342
Energy: 0.44730858441123406
Energy: 1.2198370914578927
Energy: 0.4494747568036519
Energy: 1.1287458801629477
Energy: 0.4494747568036519
Energy: 1.690100083808723
Energy: 0.44693061598541284
Energy: 0.896370386505638
Energy: 0.44693061598541284
Energy: 1.757777616424698
Energy: 0.44744890859094555
Energy: 0.8945651655627394
Energy: 0.44744890859210185
Energy: 1.4918989342088465
Energy: 0.44639829524201646
Energy: 0.6048235184113018
Energy: 0.4463982952408601
Energy: 1.8192325790461448
Energy: 0.4463875221344634
Energy: 0.6049065517977439
Energy: 0.4463875221338853
Energy: 1.7638308633215591
Energy: 0.4484064351854969
Energy: 0.6057618488981235
Energy: 0.44840643518491874
Energy: 1.493168588768927
Energy: 0.44758380330038156
Energy: 0.44685729910935207
Energy: 0.4475838033015379
Energy: 1.8182120804630644
Energy: 0.4458513729091095
Energy: 0.44723594005399325
Energy: 0.4458513729091095
Energy: 1.6310840804690445
Energy: 0.45140384124157223
Energy: 0.45074937609807675
Energy: 0.4514038412433068

minimum gb energy = 0.44358123185026954 eV
minimum distance =  2.29152336543913 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.01855258524411606
Energy: 0.019135090428828178
Energy: 1.4371495073425562
Energy: 0.019135090428828178
Energy: 0.019329374297376814
Energy: 0.10865604206025078
Energy: 1.0849454982257871
Energy: 0.10865604206025078
Energy: 0.01940836713139052
Energy: 0.1106104246824448
Energy: 1.0835302231627326
Energy: 0.11061042468283987
Energy: 0.020311000774872943
Energy: 0.11219755244499516
Energy: 1.0876577488510524
Energy: 0.11219755244499516
Energy: 1.0935139486370848
Energy: 0.11054456514200452
Energy: 1.086481016892319
Energy: 0.11054456514244897
Energy: 0.026249367187848854
Energy: 0.10801449440075794
Energy: 1.0848602539985286
Energy: 0.10801449439991838

minimum gb energy = 0.01855258524411606 eV
minimum distance =  2.51700086229223 Angstroms
sigma value = 1