Model name: model_name=MEAM_LAMMPS_ChoiKimSeol_2017_NiMn__MO_348689608050_002
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391771733761
cohesive_energy=4.450350014532301
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.44846235384514e-19, 3.22705611090378e-19, 3.8083898807843395e-19, 4.2789331364237998e-19, 4.6747188303208195e-19, 5.014941038550719e-19, 5.311327694074379e-19, 5.57166537533304e-19, 5.80149761348034e-19, 6.004909958932979e-19, 6.18501063436092e-19, 6.34434710061222e-19, 6.484954122012059e-19, 6.608449896960779e-19, 6.71621229736362e-19, 6.8094429556960795e-19, 6.889119199704899e-19, 6.95613824830512e-19, 7.01125312451472e-19, 7.05515276428632e-19, 7.08844599474084e-19, 7.1116455124011595e-19, 7.12524799202382e-19, 7.1296860213e-19, 7.124879491398e-19, 7.109322356281859e-19, 7.0809798516264e-19, 7.037464734246959e-19, 6.97590910796868e-19, 6.89283624949578e-19, 6.784032434280839e-19, 6.64435467532872e-19, 6.4675224402341395e-19, 6.245749150555859e-19, 5.969405724723539e-19, 5.626379707384139e-19, 5.20143439874832e-19, 4.67510335271298e-19, 4.02240863555406e-19, 3.21081003983502e-19, 2.1974653623626997e-19, 9.252169517191499e-20, -6.83413249762602e-20, -2.73526799309748e-19, -5.380541724663179e-19, -8.835058852295938e-19, -1.3417428221432999e-18, -1.9611763523803798e-18, -2.8180845033089394e-18, -4.03794974890386e-18, -5.8381714366325995e-18, -8.6213925763857e-18, -1.3199708438638738e-17, -2.14119691897662e-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: 0.022155128199309426
Energy: 0.8722419383600517
Energy: 1.8039648407661915
Energy: 1.368817822501086
Energy: 1.4001858526545574
Energy: 0.5004065538869488
Energy: 0.022774103249533353
Energy: 1.3837479158541253
Energy: 1.3900503613258572
Energy: 0.4013808026657993
Energy: 0.8709579483021268
Energy: 0.9741052867759369
Energy: 0.02329673677961419
Energy: 0.15439855475203115
Energy: 0.022600713807627137
Energy: 1.3904719459722628
Energy: 1.2155315777884315
Energy: 1.217811477727797
Energy: 0.8719454285408055
Energy: 0.15293576290741634
Energy: 0.1545862545559733
Energy: 0.0255413668621998
Energy: 0.8727557241973294
Energy: 1.2155621564119632
Energy: 1.3688315850976724
Energy: 1.401486028826665
Energy: 0.15348751326031296
Energy: 0.023152993622460916
Energy: 1.6956956819225173
Energy: 1.394784949758747
Energy: 0.40132452553503395
Energy: 0.8709006709852204
Energy: 0.9739767818729954
Energy: 0.022922849887696353
Energy: 0.1525233231367971
Energy: 0.022585374524921573
Energy: 1.2778951042586184
Energy: 1.2145896089816879
Energy: 1.2172240538684158
Energy: 1.1010765783946497
Energy: 0.15280524678458127
Energy: 0.1545609375838069

minimum gb energy = 0.022155128199309426 eV
minimum distance =  2.4682210527616 Angstroms
sigma value = 5


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

Energy: 1.7729753789283704
Energy: 1.7102554086745823
Energy: 1.8841154486199703
Energy: 2.067034754655504
Energy: 1.9804827305929105
Energy: 1.9230260877017245
Energy: 1.7737500431563353
Energy: 1.6114619492380926
Energy: 1.894194143661533
Energy: 1.662016960411034
Energy: 2.0378079445738684
Energy: 1.885815015110243
Energy: 1.7031602257354819
Energy: 1.915934287100755
Energy: 1.9118126761821204
Energy: 1.8942563450509946
Energy: 1.9155194528746318
Energy: 1.9350683019501076
Energy: 1.8190990942309975
Energy: 1.9145214169171336
Energy: 1.80508445011291
Energy: 1.6700815078507938
Energy: 1.966213506085418
Energy: 1.7208783102536338
Energy: 1.8820253399702207
Energy: 1.9027243105008045
Energy: 1.649008006402005
Energy: 1.8593542298129042
Energy: 1.8845254606095883
Energy: 1.7732333144280505
Energy: 1.769489266534075
Energy: 1.6506893567430792
Energy: 1.811176838860952
Energy: 1.9190118893296224
Energy: 1.9192381737314521
Energy: 1.7434435044243397
Energy: 1.76645771535122
Energy: 1.709270876959147
Energy: 1.6427664287477792
Energy: 1.9483762331595555
Energy: 1.716553531886747
Energy: 2.102418756783526
Energy: 1.7996710783273073
Energy: 1.9772013742374954
Energy: 1.801469143307666
Energy: 1.8703991261434996
Energy: 1.8237104833396547
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Energy: 1.7058173892709272
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Energy: 1.8054641677426357
Energy: 1.7886259923683117
Energy: 1.862584821121456
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Energy: 1.8197398191139407
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Energy: 1.7474714508151505
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Energy: 1.641803229788759
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Energy: 1.7509795208050738
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Energy: 1.8259158190161873
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Energy: 1.8603368008598407
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Energy: 1.9425837666295087
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Energy: 1.9360778397985123
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Energy: 1.7679989041200552
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Energy: 1.6889352460485443
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Energy: 1.7585587368941429
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Energy: 1.7678784841037696
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Energy: 1.9085150005353586
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Energy: 1.7461534519941784
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Energy: 1.6337177119642716
Energy: 1.7716076478629523
Energy: 1.7808904324605164
Energy: 1.97977433653621
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Energy: 1.7774218469355056
Energy: 1.8930252736462114
Energy: 1.7618733574745926
Energy: 1.8964466037938403
Energy: 1.8585837957471254
Energy: 1.8850091109206466
Energy: 1.8458125123736624
Energy: 1.7925630947324598
Energy: 1.8017718818347022
Energy: 1.670646513427799
Energy: 1.9612474226044214
Energy: 1.7365723627075704
Energy: 1.8800806314706229
Energy: 1.7835926247077238
Energy: 1.7931524133579275
Energy: 1.8470244211754983
Energy: 1.8944280692700841
Energy: 1.7732577647156054
Energy: 1.7697035575744082
Energy: 1.65320342047358
Energy: 1.8380255428337606
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Energy: 2.0633994986359685
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Energy: 1.999857338252346
Energy: 1.769285797585035
Energy: 1.6555299326553854
Energy: 1.903659909405248
Energy: 1.8798389534654731
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Energy: 1.8881635015751572
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Energy: 1.8801998822304182
Energy: 1.6559463440900097
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Energy: 1.7735975111406304
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Energy: 1.8511883420754414
Energy: 1.9107515644474147
Energy: 1.7584416909121026
Energy: 1.8587478931892687
Energy: 1.6739241917553322
Energy: 1.984867010863839
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Energy: 1.6370597804406293
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Energy: 1.8994030402491704
Energy: 1.8521467209884956
Energy: 1.848112802677762
Energy: 1.7606246454096641
Energy: 1.9272633121335132
Energy: 1.8431053993908966
Energy: 1.8957861440280142
Energy: 1.688972056769609
Energy: 1.8369661709654554
Energy: 1.7577652588903843
Energy: 1.850361860441768
Energy: 1.8229707354844533
Energy: 1.7895732607978205
Energy: 1.7837504957352779
Energy: 1.964866103526609
Energy: 1.649195542076312
Energy: 1.7835535661039643
Energy: 1.7217516525394891
Energy: 1.9665325344689362
Energy: 1.9223034470603715
Energy: 1.8340608688306765
Energy: 1.775670058200453
Energy: 1.6611642395839357
Energy: 1.643505406036697
Energy: 1.8929683130878552
Energy: 1.968801228042807
Energy: 1.63705162866176
Energy: 1.887803047656796
Energy: 1.85001919441367
Energy: 1.9747298422482602
Energy: 1.8090448224907232
Energy: 1.7582388282255093
Energy: 1.7317508136767017
Energy: 1.837832245692205
Energy: 1.909217234067238
Energy: 1.6865199358996188
Energy: 1.873685508347869
Energy: 1.6739093029762453
Energy: 1.917605922828497
Energy: 1.9064286199796852
Energy: 1.677366308932816
Energy: 1.7303261197383115
Energy: 1.8413616551719223
Energy: 1.813428366435527
Energy: 1.8531036273431942
Energy: 1.8231658013163845
Energy: 1.8947415126930307
Energy: 1.9174662596987113
Energy: 1.7488673927910134
Energy: 1.661390621975676
Energy: 1.7823506074441204
Energy: 1.774136401681492
Energy: 2.0299016305722084
Energy: 1.8445748574698448
Energy: 1.6543968693610003
Energy: 1.9572846256018592
Energy: 1.7711027636558614
Energy: 1.7138299844159028
Energy: 1.8669234388066014
Energy: 1.912012186695431
Energy: 1.8824642985307187
Energy: 1.7656736971397875
Energy: 1.7235967328847936

minimum gb energy = 1.6114619492380926 eV
minimum distance =  2.22403611213505 Angstroms
sigma value = 401


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

Energy: 1.7641592047289523
Energy: 1.7583473646491332
Energy: 1.8480631475170222
Energy: 1.9623672221026849
Energy: 2.1029609854860523
Energy: 1.7563897215463278
Energy: 1.7828327772892314
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Energy: 1.7304945936472027
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Energy: 1.9095120681559787
Energy: 1.9244777397554453
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Energy: 1.7502528919145355
Energy: 1.8357808505456947
Energy: 1.7872213890595363
Energy: 1.7180525921997651
Energy: 1.6358701384690448
Energy: 1.9014527228330618
Energy: 1.9023288152160485
Energy: 1.6295345068435743
Energy: 1.8327853818884108
Energy: 1.7405982606949466
Energy: 1.772277688679561
Energy: 1.9500772636545969
Energy: 1.8032842631416384
Energy: 1.8134511234364072
Energy: 1.8400627042617739
Energy: 1.6991426779202286
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Energy: 1.7133011562772946
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Energy: 2.011103898450039
Energy: 1.9140179673610445
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Energy: 1.6658916571660718
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Energy: 2.0063980974188476
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Energy: 1.66428247177887
Energy: 1.6726981690725802
Energy: 1.666052309307903
Energy: 1.9127432098972665
Energy: 2.02354297477636
Energy: 1.9892019506657967
Energy: 1.7734935066575066
Energy: 1.667081537729629
Energy: 1.6668508602203171
Energy: 1.664830717491122
Energy: 1.846618402186389
Energy: 1.7034585024032889
Energy: 1.774583067797396
Energy: 1.900335187155948
Energy: 1.664719440699111
Energy: 1.645284105368306
Energy: 1.6502784270122781
Energy: 1.708372093476436
Energy: 1.766799416549539
Energy: 1.9587949188835718
Energy: 1.8055011112086885
Energy: 1.6658883434154712
Energy: 1.8807098528024673
Energy: 1.9560819909687852
Energy: 1.842676353322923
Energy: 1.8006474620153516
Energy: 1.7904548230192918
Energy: 1.6197586307431797
Energy: 1.7962139569794575
Energy: 1.9016379008907134
Energy: 1.863786968595583
Energy: 1.7319141252629262
Energy: 1.6618032674371126
Energy: 1.769433401817761
Energy: 1.7235493309396404
Energy: 1.8814170897725293
Energy: 1.8747052199339127
Energy: 1.8078500747302582
Energy: 1.8177194022033374
Energy: 1.7320307796424228
Energy: 1.7319647560734464
Energy: 1.9054543149034968
Energy: 1.707715688315155
Energy: 1.8085226926101292
Energy: 1.7283765492857683
Energy: 1.87422264713589
Energy: 1.8534222237147862
Energy: 1.6795818109270393
Energy: 1.8047018616318733
Energy: 1.843104507467072
Energy: 1.9505029601672637
Energy: 1.8650477814471724
Energy: 1.8161538625231717
Energy: 1.851556543076063
Energy: 1.8996745685678327
Energy: 1.8795904866452267
Energy: 1.8499871256109335
Energy: 1.7399455236985857
Energy: 1.6739553762744945
Energy: 1.7469875110171784
Energy: 1.855703941147963
Energy: 1.7644194826517283
Energy: 1.7775787137995196
Energy: 1.7999521671236285
Energy: 1.7028746590516235
Energy: 1.7839727282117874
Energy: 1.8233981689954173
Energy: 2.0923247919593346
Energy: 1.8810486030490066
Energy: 1.7389523207106838
Energy: 1.7359308451269335
Energy: 1.7208128032226915
Energy: 1.6733759828339765
Energy: 1.9068039448665017
Energy: 1.7328099871749931
Energy: 1.6895653778543527
Energy: 1.731619420784774
Energy: 1.7547602045369737
Energy: 1.7252822875538025
Energy: 1.6771754203131441
Energy: 1.84646506631922
Energy: 1.6647110104195755
Energy: 1.9506873121221038
Energy: 1.8657989746193624
Energy: 1.7216883747516811
Energy: 1.701557974584784
Energy: 1.651943677470627
Energy: 1.705060088153515
Energy: 1.6804170807536716
Energy: 1.9414794457417366
Energy: 1.7439951905644904
Energy: 1.7320927610150683
Energy: 1.8748329937226547
Energy: 1.9687851006158528
Energy: 1.789602661196572
Energy: 1.8218333799783266
Energy: 1.7373766145447136
Energy: 1.8393129197416778
Energy: 1.813795084765956
Energy: 1.7448386665841336
Energy: 1.6312569773143826
Energy: 1.706576948048848
Energy: 1.7642102342280144
Energy: 1.716783447556857
Energy: 1.6910667488974935
Energy: 1.9667160260104724
Energy: 1.8701588261292958
Energy: 1.7024291760430013
Energy: 1.8070152360617002
Energy: 1.7510168543173577
Energy: 1.7535169081843414
Energy: 1.934285227752721
Energy: 1.7269072603560636
Energy: 1.7495911686335588
Energy: 1.801305210072762
Energy: 1.6646300946706192
Energy: 1.8491295443891123
Energy: 1.6861852893755216
Energy: 1.64199141041562
Energy: 1.9450382870334593
Energy: 1.9379011124035566
Energy: 1.7598696957194386
Energy: 1.9231475959861504
Energy: 1.8452554532441128
Energy: 1.699979826114421
Energy: 1.8774767864733821
Energy: 1.9587658318358285
Energy: 1.7365127280419712
Energy: 1.6492406341102182
Energy: 1.7398523107876314
Energy: 1.6630810152887898
Energy: 1.7165980943978278
Energy: 1.8016121833179635
Energy: 1.8093693562513034
Energy: 1.6640356999173993
Energy: 1.8111931200045006
Energy: 1.9366445927376121
Energy: 1.7556288654545897
Energy: 1.8110725150865106
Energy: 1.6418668130485934
Energy: 1.8159096422453775
Energy: 1.6634703717827886
Energy: 1.7414793348842903
Energy: 1.9011335702232108
Energy: 1.771540036594753
Energy: 1.7073151645435043
Energy: 1.8002487894759558
Energy: 1.7495514300973727

minimum gb energy = 1.6197586307431797 eV
minimum distance =  2.24913368050511 Angstroms
sigma value = 311


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

Energy: 1.8007280884982104
Energy: 1.7393746384260838
Energy: 1.8173201871526015
Energy: 1.707167499760148
Energy: 1.8018868164350683
Energy: 1.7631250151150102
Energy: 1.7543159710142346
Energy: 1.7040603164228887
Energy: 1.7845852393382955
Energy: 1.7247540158530228
Energy: 1.7515233817843963
Energy: 1.7256145689109434
Energy: 1.7086939664314262
Energy: 1.831896234286565
Energy: 1.7909985879189874
Energy: 1.675823707102612
Energy: 1.7408185401521081
Energy: 1.7287498839834334
Energy: 1.730616655047768
Energy: 1.718099607239268
Energy: 1.7727280466533613
Energy: 1.6602173456289617
Energy: 1.8948476312167046
Energy: 1.7211586917221489
Energy: 1.6717665799395813
Energy: 1.770455151315567
Energy: 1.67000123158506
Energy: 1.9369716037985814
Energy: 1.8331422249783613
Energy: 1.822180634560776
Energy: 1.7785553943764716
Energy: 1.893130167437959
Energy: 1.7839126594681727
Energy: 1.8565701600196642
Energy: 1.7472936647358766
Energy: 1.6695956248963104
Energy: 1.761828581446543
Energy: 1.7078610472706324
Energy: 1.7533470420001018
Energy: 1.7166855607732612
Energy: 1.7397642433868772
Energy: 1.7749430683656264
Energy: 1.8159081749903554
Energy: 1.782464246561593
Energy: 1.8073310949389159
Energy: 1.6972206078019447
Energy: 1.9038712746574529
Energy: 1.808227630693261
Energy: 1.823136511147112
Energy: 1.7243636113430727
Energy: 1.8318092382230085
Energy: 1.7081397180879556
Energy: 1.7271646922637376
Energy: 1.839343977304947
Energy: 1.738057978626446
Energy: 1.7330730974232051
Energy: 1.7570397574000596
Energy: 1.764622239194021
Energy: 1.7412346551846065
Energy: 1.715711942158363
Energy: 1.7522520914486746
Energy: 1.74501169750898
Energy: 1.6723969743355616
Energy: 1.655906736307951
Energy: 1.8125460560190558
Energy: 1.669239873648215
Energy: 1.744987777436927
Energy: 1.7808303605355364
Energy: 1.65928148226021
Energy: 1.7819880308244145
Energy: 1.8387174638417227
Energy: 1.864921407881975
Energy: 1.786444742478407
Energy: 1.8998283666420255
Energy: 1.8418345656018347
Energy: 1.8845975473374685
Energy: 1.7335564543349775
Energy: 1.6725721790105095
Energy: 1.8279812865958875
Energy: 1.6994877315085632
Energy: 1.7121042231645642
Energy: 1.7154987743620047
Energy: 1.7902881065857237
Energy: 1.7709346165081967
Energy: 1.8072770278665036
Energy: 1.6913571940095569
Energy: 1.813154188117486
Energy: 1.721619914948926
Energy: 1.9211588322432378
Energy: 1.7955957374064433
Energy: 1.8363614162354884
Energy: 1.7152609274157613
Energy: 1.7945012470956352
Energy: 1.7392924849459868
Energy: 1.7886527013433102
Energy: 1.8973764330518927
Energy: 1.7660019198738093
Energy: 1.9247492251693734
Energy: 1.8231810941872124
Energy: 1.722474921362151
Energy: 1.771709092764049
Energy: 1.7955471213617873
Energy: 1.9393700652494024
Energy: 1.7501210571275885
Energy: 1.7239210377093726
Energy: 1.669030689203281
Energy: 1.7063579690361859
Energy: 1.6583570711282531
Energy: 1.7480338371320736
Energy: 1.75693396406781
Energy: 1.7188320238204962
Energy: 1.820981579341732
Energy: 1.8481737859883622
Energy: 1.8356975874207802
Energy: 1.9231481298005535
Energy: 1.8978187707987633
Energy: 1.7600023827342994
Energy: 1.836126970614267
Energy: 1.7391767347497997
Energy: 1.68513786610332
Energy: 1.8227111888522114
Energy: 1.787375904948154
Energy: 1.709423744536371
Energy: 1.7079717894636448
Energy: 1.662586282790288
Energy: 1.7631867566398436
Energy: 1.8119883429197081
Energy: 1.8177123536139423
Energy: 1.8232654645776687
Energy: 1.8532570203425038
Energy: 1.9440280254687767
Energy: 1.7944632888985468
Energy: 1.7756923376298257
Energy: 1.7833793807429117
Energy: 1.8243822320156478
Energy: 1.7876983093726755
Energy: 1.8137777700648647
Energy: 1.85429967123624
Energy: 1.7646924285279666
Energy: 1.8747409563022726
Energy: 1.7147981593446737
Energy: 1.7125628488177276
Energy: 1.7323726494174165
Energy: 1.8889469876692433
Energy: 1.8256310876914377
Energy: 1.7724583358975081
Energy: 1.7740406419479005
Energy: 1.6625137899973104
Energy: 1.8619606596290246
Energy: 1.7883611895260372
Energy: 1.7032024608688936
Energy: 1.7260559035596332
Energy: 1.6502375177978006
Energy: 1.7899032874397967
Energy: 1.9099168177701815
Energy: 1.7804838775866765
Energy: 1.8406127757395407
Energy: 1.8936300791592755
Energy: 1.7743909368991493
Energy: 1.8488165324182564
Energy: 1.7642713158596275
Energy: 1.742109249332204
Energy: 1.8354362604768664
Energy: 1.810730558831945
Energy: 1.6922665417328446
Energy: 1.7742726056142115
Energy: 1.6870940255155182
Energy: 1.7757646672592955
Energy: 1.817280733981236
Energy: 1.7085688526844978
Energy: 1.8077899418322732
Energy: 1.8548591731156685
Energy: 1.9065617712540188
Energy: 1.8096036414644123
Energy: 1.755037448777193
Energy: 1.8105467536807294
Energy: 1.8224039348364265
Energy: 1.771108876771332
Energy: 1.835173313107076
Energy: 1.8766676687689108
Energy: 1.7848146168314791
Energy: 1.7666878716867234
Energy: 1.764047840025892
Energy: 1.7074847054327735
Energy: 1.8208510781556524
Energy: 1.6997439141903055
Energy: 1.8964560262288819
Energy: 1.734720800676951
Energy: 1.7877071686953796
Energy: 1.6539815220293972
Energy: 1.7915883036292266
Energy: 1.6910364223293222
Energy: 1.6672015380284249
Energy: 1.7222378361969621
Energy: 1.6816717035721804
Energy: 1.7699862404086772
Energy: 1.828905264984941
Energy: 1.8675128591046883
Energy: 1.7596062902668157
Energy: 1.8481526574330172
Energy: 1.801186986612367
Energy: 1.8863056247942662
Energy: 1.7235024361503615
Energy: 1.7393311177934674
Energy: 1.7517081808896662
Energy: 1.7437521819885686
Energy: 1.7293611505879058
Energy: 1.7878759806097448
Energy: 1.7546312187315605
Energy: 1.7226253311547008
Energy: 1.8079590192477308
Energy: 1.7052209175537847
Energy: 1.7749094598212003
Energy: 1.7326881352192798
Energy: 1.8340029728228224
Energy: 1.7070710554561463
Energy: 1.6933729463100917
Energy: 1.7630387824938578
Energy: 1.767655642745532
Energy: 1.796781985034023
Energy: 1.785011838258557
Energy: 1.909949858481986
Energy: 1.8135156770423118
Energy: 1.7567395834015815
Energy: 1.7743141107489344
Energy: 1.709682544635204
Energy: 1.7469777077597435
Energy: 1.6718236831360718
Energy: 1.8591927503915955
Energy: 1.7179952715083173
Energy: 1.706789729869419
Energy: 1.6654566665114223
Energy: 1.6949911915035614
Energy: 1.7561672126916263
Energy: 1.7045239365763651
Energy: 1.7298635405106637
Energy: 1.694729830516168
Energy: 1.6957347673328778
Energy: 1.8493973161401238
Energy: 1.887005652354552
Energy: 1.783948337587079
Energy: 1.8730399679734917
Energy: 1.7505206445606063
Energy: 1.8318703162362484
Energy: 1.7984868506576674
Energy: 1.7103057476273844
Energy: 1.8454343080785562
Energy: 1.7947994816633277
Energy: 1.709980262297737
Energy: 1.8154476389285792
Energy: 1.7463661809759294
Energy: 1.8530804822334248

minimum gb energy = 1.6502375177978006 eV
minimum distance =  2.22842023820229 Angstroms
sigma value = 39


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

Energy: 1.6153820276382664
Energy: 1.8231500701312873
Energy: 2.0150233013455923
Energy: 1.9201843790571662
Energy: 1.8323085470310971
Energy: 1.7279671606810334
Energy: 1.558039097811364
Energy: 1.6501518699950954
Energy: 1.7348955431841808
Energy: 1.7156909492904007
Energy: 1.6098162064609236
Energy: 1.6000373387735702
Energy: 1.6521082871181272
Energy: 1.6780717190447445
Energy: 1.6498703415618101
Energy: 1.6375652494674342
Energy: 1.732018668233095
Energy: 1.6065842741302583
Energy: 1.5987549669465793
Energy: 1.6666361634412878
Energy: 1.7681314559535921
Energy: 1.6268242015206766
Energy: 1.6186149477653362
Energy: 1.7048608219863468
Energy: 1.7238646355941083
Energy: 1.6270488079779846
Energy: 1.7183942050079977
Energy: 1.77516773156048
Energy: 1.6681379195854646
Energy: 1.598855838708675
Energy: 1.6903941453905904
Energy: 1.7118221334468096
Energy: 1.627463386974222
Energy: 1.9515135174514802
Energy: 1.6673243088368308
Energy: 1.5598944040788516
Energy: 1.5979309388849268
Energy: 1.7108113882818752
Energy: 1.878774620348477
Energy: 1.7624253032039157
Energy: 1.6777541174645387
Energy: 1.6673271444573794
Energy: 1.9589594416833072
Energy: 1.7788083820727467
Energy: 1.6769916219691345
Energy: 1.8598733516910773
Energy: 1.5599008336868134
Energy: 1.5609401606337967
Energy: 1.6533639469372177
Energy: 1.55750590632225
Energy: 1.7375614320748674
Energy: 1.9843514893392948
Energy: 1.7471954737521365
Energy: 1.7857545506153973
Energy: 1.737523266052825
Energy: 1.666818971799155
Energy: 1.5601247253498365
Energy: 1.738073651663307
Energy: 1.9253139942607693
Energy: 1.619744782889865
Energy: 1.598534246812693
Energy: 1.9184976826758184
Energy: 1.6672484203182891
Energy: 1.959642006976916
Energy: 1.71943690880788
Energy: 1.7180639070990078
Energy: 1.6086816026200856
Energy: 1.6013504520907975
Energy: 1.651553437424865
Energy: 1.6667702770126567
Energy: 1.6244179655622368
Energy: 1.6174203782064531
Energy: 1.6999306215022192
Energy: 1.6190387017939474
Energy: 1.5988892256567053
Energy: 1.6880053649214968
Energy: 1.7788679998392183
Energy: 1.6664143196354184
Energy: 1.5980986421563073
Energy: 1.6833766245942012
Energy: 1.6489250900398502
Energy: 1.628079064260836
Energy: 1.6950372439924113
Energy: 1.6798221861676896
Energy: 1.5583819074382435
Energy: 1.600117807631493
Energy: 1.73266818360622
Energy: 1.7687033169582493
Energy: 1.7436969575600383
Energy: 1.736852323246854
Energy: 1.6664937936756623
Energy: 1.7407266840496078
Energy: 1.6182726303380273
Energy: 1.7119903173443634
Energy: 1.8625553392339247
Energy: 1.5606269755479374
Energy: 1.5589691405210309
Energy: 1.691683249673155
Energy: 1.557707844335525
Energy: 1.7300292638059278
Energy: 1.6773066878552547
Energy: 1.862558646731343
Energy: 1.5613771289198553
Energy: 1.5587299697590837
Energy: 1.6778186983302814
Energy: 1.55726128103649
Energy: 1.8480412565922253
Energy: 1.9459738429842541
Energy: 1.6933857342749443
Energy: 1.8293740348945149
Energy: 1.7308676602940491
Energy: 1.5579513245734187
Energy: 1.6492375533565244
Energy: 1.7347751060159498
Energy: 1.7191550995556817
Energy: 1.6305588657786618
Energy: 1.5999035616271589
Energy: 1.651818907114259
Energy: 1.6797359592698418
Energy: 1.6498927022934573
Energy: 1.637160896429202
Energy: 1.6881572461948617
Energy: 1.606915811490313
Energy: 1.5984538882192993
Energy: 1.666547446207851
Energy: 1.7680042323898502
Energy: 1.6261424469168573
Energy: 1.6394474629252025
Energy: 1.7051451631994623
Energy: 1.7232026392552569
Energy: 1.626993619295993
Energy: 1.7185051283379165
Energy: 1.7755422370727665
Energy: 1.6684442379634405
Energy: 1.5987207937877963
Energy: 1.6906268767685644
Energy: 1.7124253184340563
Energy: 1.6270959259179179
Energy: 1.9510653400831726
Energy: 1.6672727469060817
Energy: 1.5590086008362136
Energy: 1.5976648459820293
Energy: 1.710851530735129
Energy: 1.878864152781986
Energy: 1.7618006903571641
Energy: 1.5589061448728214
Energy: 1.666872591830163
Energy: 1.958012855742256
Energy: 1.7500305474478166
Energy: 1.676152246494746
Energy: 1.8446520580991488
Energy: 1.5596155723506198
Energy: 1.5614138263369064
Energy: 1.692010680885405
Energy: 1.561954939046737
Energy: 1.7351459954048254
Energy: 1.9858877499883392
Energy: 1.7486481249994679
Energy: 1.7870522965535822
Energy: 1.7374724835642767
Energy: 1.6681880346090032
Energy: 1.5594873434539696
Energy: 1.7394969639016264
Energy: 1.9254269546420844
Energy: 1.6193941179183458
Energy: 1.597936555464956
Energy: 1.717773742702127
Energy: 1.6672660649357027
Energy: 1.9575274704801555
Energy: 1.7196770428861976
Energy: 1.7178269389635157
Energy: 1.609827996976904
Energy: 1.5987054155047635
Energy: 1.6508574156641969
Energy: 1.6665339946796818
Energy: 1.6241444835783754
Energy: 1.617634057203424
Energy: 1.7000151813225959
Energy: 1.619735655232596
Energy: 1.5993568194909529
Energy: 1.7162198193175204
Energy: 1.777867967022744
Energy: 1.6678062571889984
Energy: 1.598553721828356
Energy: 1.6822845670757927
Energy: 1.648825079585921
Energy: 1.6283365384780257
Energy: 1.6939740429986665
Energy: 1.67954601314478
Energy: 1.5587018390736753
Energy: 1.5998142906169777
Energy: 1.7329758473766337
Energy: 1.768543680125582
Energy: 1.7436816724222601
Energy: 1.7287697548164482
Energy: 1.6681729883399203
Energy: 1.7409554061098318
Energy: 1.618291980655268
Energy: 1.7122986493139727
Energy: 1.8627357717873132
Energy: 1.5604440337787457
Energy: 1.558931219892444
Energy: 1.6906776449881797
Energy: 1.559153906437784
Energy: 1.7321828434538378
Energy: 1.676741308305551
Energy: 1.8795983031511443
Energy: 1.561353773024062
Energy: 1.5585576907353056
Energy: 1.6778290359141141

minimum gb energy = 1.55726128103649 eV
minimum distance =  2.23025048412304 Angstroms
sigma value = 21


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

Energy: 2.0091155671524157
Energy: 1.7676573551767445
Energy: 1.6478120972081638
Energy: 1.8539312509875405
Energy: 1.787984713951538
Energy: 1.688770327558221
Energy: 1.6578055936827685
Energy: 1.6659464274702505
Energy: 1.829268457953857
Energy: 1.8712820278448121
Energy: 1.86345525497009
Energy: 1.9394414742718018
Energy: 1.8330954735896414
Energy: 1.8319028124792818
Energy: 1.8907494320423324
Energy: 1.727478906447266
Energy: 1.6455204876223575
Energy: 1.930659291086317
Energy: 1.5715915943717358
Energy: 1.5721560769108487
Energy: 1.8502990277793765
Energy: 1.7907602079144698
Energy: 1.840921195360788
Energy: 1.7221168310423398
Energy: 1.8034559562494767
Energy: 1.6940569546283208
Energy: 1.6337533411014646
Energy: 1.8496178882584988
Energy: 1.5721876061016733
Energy: 1.7204312414335592
Energy: 1.664383693429303
Energy: 1.5818226848028798
Energy: 1.6359974673203574
Energy: 1.6288864792794595
Energy: 1.5903261602048178
Energy: 1.5562962958873203
Energy: 1.6314456858451352
Energy: 1.6236379694401082
Energy: 1.7134213301233832
Energy: 1.5977982311546117
Energy: 1.5822040294791626
Energy: 1.6436165957139142
Energy: 1.9803213885803121
Energy: 1.6744035519168807
Energy: 1.6354508389958626
Energy: 1.7353266383424468
Energy: 1.5891457844156713
Energy: 1.5574364578450353
Energy: 1.6564727656925449
Energy: 1.6346331599774369
Energy: 1.6069115578615172
Energy: 1.6459480514779425
Energy: 1.7760936268030456
Energy: 1.5718393927253698
Energy: 1.5729863485734745
Energy: 1.704021380182185
Energy: 1.626766621835234
Energy: 1.7670002503776776
Energy: 1.8536427058906855
Energy: 1.660916322774818
Energy: 1.986568675351036
Energy: 2.087049048063546
Energy: 2.032429008201697
Energy: 1.5716070917918448
Energy: 1.8696098708043352
Energy: 1.6494157333907824
Energy: 1.8549330305146643
Energy: 1.6664696722873227
Energy: 1.8904572458633335
Energy: 1.7907768814277363
Energy: 1.787386412218812
Energy: 1.7777705015876726
Energy: 1.643992451863037
Energy: 1.6630185291993307
Energy: 1.5585243774549573
Energy: 1.5567057449261374
Energy: 1.8326664508916068
Energy: 1.8625990973026174
Energy: 1.7219495659818622
Energy: 1.8542693212894963
Energy: 2.2047347292260686
Energy: 1.5572955860967856
Energy: 1.5569197406969137
Energy: 1.9224465697625615
Energy: 1.556948000271896
Energy: 1.7243149179074195
Energy: 2.031983975177602
Energy: 1.8202610259888545
Energy: 1.7340191372948635
Energy: 1.6325576545881528
Energy: 1.6563558870428174
Energy: 1.5569086324868604
Energy: 1.8413237120171155
Energy: 1.6454703435893534
Energy: 1.6832725884136965
Energy: 1.7979509775253295
Energy: 1.702753419207515
Energy: 1.8324726882496956
Energy: 1.8894457262256081
Energy: 1.6374058834980167
Energy: 1.6475711870003242
Energy: 1.9602049858973773
Energy: 1.8328026911730664
Energy: 1.8006780816858736
Energy: 1.7919391844438055
Energy: 1.8016098107116123
Energy: 1.7266720164581841
Energy: 1.6937287028911907
Energy: 1.6700078601250015
Energy: 1.6941733879281857
Energy: 1.8407048680995843
Energy: 2.0623671609089795
Energy: 1.5721705440844815
Energy: 1.7210154749587374
Energy: 1.6251666486906162
Energy: 1.632111746585582
Energy: 1.6685440301971517
Energy: 1.628139448238338
Energy: 1.5920970189383383
Energy: 1.556813548299686
Energy: 1.6318789288391882
Energy: 1.6546664446493333
Energy: 1.920508565403957
Energy: 1.9803767389360099
Energy: 2.1318513329223467
Energy: 1.8957233757465275
Energy: 1.5553850549014376
Energy: 1.5911405742070932
Energy: 1.6236111399229491
Energy: 1.666656299075092
Energy: 1.5880751085189595
Energy: 1.5581005929004461
Energy: 1.656565753899858
Energy: 1.6277422097371008
Energy: 1.6066009287519212
Energy: 1.7021449698273838
Energy: 1.6597191604536865
Energy: 1.7202382919150985
Energy: 1.5722199718094951
Energy: 1.5913157609667656
Energy: 1.6345442629482285
Energy: 1.6325996604925628
Energy: 1.8295290293928295
Energy: 1.950147765463299
Energy: 1.9387276543646537
Energy: 2.050506583815634
Energy: 2.0292756934122527
Energy: 1.5716667331051641
Energy: 1.8045427540482153
Energy: 1.6471262857030928
Energy: 1.6880397246968157
Energy: 1.612045252023035
Energy: 1.7840847344968234
Energy: 1.5695230584885274
Energy: 1.8333175757243954
Energy: 1.6651117747864344
Energy: 1.9547274135227535
Energy: 1.885298144441384
Energy: 1.6920439409615446
Energy: 1.6524114238149654
Energy: 1.8335726543157942
Energy: 1.6537388858682711
Energy: 1.637586972606724
Energy: 1.768702444967044
Energy: 2.1486913373206695
Energy: 1.5565175804786326
Energy: 1.556155240197659
Energy: 1.8091524015617741
Energy: 1.55677295544775
Energy: 1.7568885407929462
Energy: 1.9021594564980522
Energy: 1.6814388270240481
Energy: 1.6922698814115502
Energy: 1.9821225767829467
Energy: 1.8329899965801357

minimum gb energy = 1.5553850549014376 eV
minimum distance =  2.22562024909709 Angstroms
sigma value = 113


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

Energy: 1.9279553800780191
Energy: 2.1355866325871933
Energy: 2.04837580022501
Energy: 2.0845239571612697
Energy: 2.0004815853137212
Energy: 2.0055488196743605
Energy: 2.1545722738619455
Energy: 2.063422369129635
Energy: 2.0855231114090933
Energy: 1.9832522967532087
Energy: 2.1399410860547885
Energy: 2.071931094390523
Energy: 2.0316540051514043
Energy: 2.0540806229542095
Energy: 2.082804293229024
Energy: 2.0057876395363055
Energy: 1.932498095374038
Energy: 2.007078033241085
Energy: 2.0600159870819295
Energy: 1.970613968407907
Energy: 2.084442759962995
Energy: 1.888002870176369
Energy: 2.178002520523607
Energy: 1.9670719828630285
Energy: 2.0580638791293033
Energy: 2.024564751491618
Energy: 1.928741090093549
Energy: 2.0627784697105334
Energy: 1.8893526391093152
Energy: 2.022924880109462
Energy: 1.8614066763301766
Energy: 1.9291285836545906
Energy: 1.9355617152668463
Energy: 1.9145201834620524
Energy: 1.985743622883513
Energy: 1.7833360257336621
Energy: 1.9251289908327667
Energy: 1.9751077998551452
Energy: 1.8470404585274944
Energy: 1.8258251434675137
Energy: 1.8027517714523515
Energy: 1.9465951469005254
Energy: 1.9583976045183398
Energy: 2.0376861505382933
Energy: 1.87533712494457
Energy: 1.9359873540442762
Energy: 1.9744240814908076
Energy: 1.880667520390479
Energy: 2.0805818262655533
Energy: 1.8542908010407149
Energy: 1.7637235707884957
Energy: 1.914930115082917
Energy: 1.9893842321468622
Energy: 2.0032945639633644
Energy: 1.972350326526813
Energy: 1.7756111756379727
Energy: 1.666062612921042
Energy: 1.9524091295284645
Energy: 1.9867414715931973
Energy: 1.7943516587604604
Energy: 1.9055587963660148
Energy: 1.9590327472039997
Energy: 2.0011024851517814
Energy: 1.9208613547996036
Energy: 1.9038966405035007
Energy: 1.9230260676050095
Energy: 1.7261148506093962
Energy: 1.9252883445782822
Energy: 1.949098277321641
Energy: 1.9239998941745324
Energy: 1.9086940937815118
Energy: 1.8533815761358536
Energy: 1.8927842102863301
Energy: 1.8478786799169327
Energy: 1.866941044582544
Energy: 1.9099091106015598
Energy: 1.8209237156175617
Energy: 1.7304146900576445
Energy: 1.9556634496559333
Energy: 1.9952366635026062
Energy: 1.9816547181341688
Energy: 1.9025420885450102
Energy: 1.9966068742024947
Energy: 1.957708781346053
Energy: 1.9425400813740923
Energy: 1.7491297246203314
Energy: 1.8980631168524638
Energy: 1.9932269128336828
Energy: 1.9838700841554693
Energy: 1.8423589059308891
Energy: 1.771363452303355
Energy: 1.9443237079829963
Energy: 1.962150619393578
Energy: 2.0181623948191123
Energy: 1.8312517909647603
Energy: 1.7950633685812452
Energy: 1.8871836570067089
Energy: 2.0236075938915055
Energy: 1.7231219194180407
Energy: 1.972258055446646
Energy: 1.946101434821046
Energy: 1.82497128550997
Energy: 1.7225618716845226
Energy: 1.8665292330736736
Energy: 1.9184229290755852
Energy: 1.874047184807542
Energy: 1.882665910691884
Energy: 1.8866258675118381
Energy: 1.9472760046834456
Energy: 1.9403331327730666
Energy: 1.884077217750796
Energy: 1.912070158022732
Energy: 1.900150167246495
Energy: 2.1516814755090214
Energy: 1.921099220313757
Energy: 2.0234092046396692
Energy: 1.9923080534281392
Energy: 1.97434136835958
Energy: 2.0029412007749525
Energy: 1.8699591716160566
Energy: 1.9867479029559545
Energy: 1.8921900270259842
Energy: 1.9299769480743239
Energy: 1.9357685058665386
Energy: 1.9890753512187291
Energy: 1.9743105928805225
Energy: 2.0340756394734196
Energy: 2.109597303188706
Energy: 1.9848404871912866
Energy: 2.087761548217704
Energy: 2.1762460474110967
Energy: 2.0027922250176844
Energy: 2.152467360584011
Energy: 1.8620123059946616
Energy: 2.021720987085847
Energy: 1.9379775719690302
Energy: 2.0555739492712046
Energy: 2.025512290559782
Energy: 1.9195361696876176
Energy: 2.023587042729216
Energy: 2.0595117810700736
Energy: 1.9390480129103125
Energy: 1.9240058508995532
Energy: 2.132213739336481
Energy: 2.0508672712651297
Energy: 1.8986675683827396
Energy: 1.9275526348760603
Energy: 2.0619480865674014
Energy: 1.9063004281785885
Energy: 1.9379102738243874
Energy: 1.9937942799285084
Energy: 2.0549877880635474
Energy: 1.9035536598599343
Energy: 2.002342534951239
Energy: 1.8603094933663522
Energy: 2.053888344995795
Energy: 2.040251887296477
Energy: 2.04259860549298
Energy: 2.028611117108373
Energy: 1.930859318732693
Energy: 2.025870858841856
Energy: 2.0595012104178347
Energy: 2.159180182772601
Energy: 1.9877962624212084
Energy: 2.1528360844695014
Energy: 2.079625914244584
Energy: 2.060253953498682
Energy: 2.052860506917078
Energy: 1.9118567974509713
Energy: 1.9774161495544285
Energy: 1.9314874640804809
Energy: 2.0132300691505685
Energy: 1.9890603589261169
Energy: 1.9546188209172832
Energy: 1.9845569764310533
Energy: 1.8633106269447535
Energy: 2.1001617155034067
Energy: 1.927693690561794
Energy: 2.0088984432693353
Energy: 2.028156799896445
Energy: 1.93176570805275
Energy: 2.044346212940458
Energy: 1.876168674275996
Energy: 2.0544139893513593
Energy: 1.9803341727520887
Energy: 1.9402345039026088
Energy: 1.9491031077176422
Energy: 1.949324221094784
Energy: 1.999328454655773
Energy: 1.782486253691074
Energy: 1.9680998148474438
Energy: 1.9123088327130708
Energy: 1.8941358345576558
Energy: 1.7581921974372703
Energy: 1.8218303733784822
Energy: 1.9468570860719487
Energy: 1.95650606157843
Energy: 1.9795426680599797
Energy: 1.8736828204124751
Energy: 1.9413157008247972
Energy: 1.9224843272212506
Energy: 1.898488218372555
Energy: 2.0759866856703915
Energy: 1.9125822872787026
Energy: 1.757381853044659
Energy: 1.8317487354418283
Energy: 2.0047435987818756
Energy: 2.018474606840018
Energy: 1.7741746419272517
Energy: 1.7776727221054929
Energy: 1.6473980635182992
Energy: 1.916425382534804
Energy: 2.0035314819699677
Energy: 1.9823140460348982
Energy: 1.9049797929306174
Energy: 1.9606265008588954
Energy: 1.988679280101057
Energy: 1.8719604463107344
Energy: 1.8855594635038255
Energy: 1.9157145154425872
Energy: 1.9041913805584312
Energy: 1.9094355116141648
Energy: 1.897713946513685
Energy: 1.9277024833629548
Energy: 1.9071451661098562
Energy: 1.8632744135536228
Energy: 1.7962270144389123
Energy: 1.9696494321905567
Energy: 1.8066463959463315
Energy: 1.8798565777718963
Energy: 1.8772372215438138
Energy: 1.7395746923868207
Energy: 1.954970489335303
Energy: 1.9802004424848643
Energy: 1.9857648955745077
Energy: 1.974538401942644
Energy: 1.9973407882696743
Energy: 2.0399683037774072
Energy: 1.9357906956509447
Energy: 1.749790298191174
Energy: 1.9003445301725972
Energy: 1.9552215828706765
Energy: 1.9830553940264442
Energy: 1.96694250313541
Energy: 1.7612704819666825
Energy: 1.9584013387879753
Energy: 1.953513486258467
Energy: 1.9943427295066023
Energy: 1.9928381765998027
Energy: 1.8057009124526546
Energy: 1.801234793143565
Energy: 2.0199023693028515
Energy: 1.7075365271256884
Energy: 1.9116151973065587
Energy: 1.9497938567155406
Energy: 1.7975740865814989
Energy: 1.729188293910151
Energy: 1.8718862083552938
Energy: 1.9075254541827285
Energy: 1.8080600949447017
Energy: 1.918590035226669
Energy: 1.8168724367662563
Energy: 1.9486819287119252
Energy: 1.882078074880754
Energy: 1.8491635922822103
Energy: 1.9054805172601383
Energy: 1.872720535285117
Energy: 2.149645494657462
Energy: 1.9159947461375408
Energy: 2.0208514149526278
Energy: 1.9780303315940433
Energy: 1.8855650930467287
Energy: 1.9898971109242578
Energy: 1.8713148841986338
Energy: 1.9084945765651031
Energy: 1.8853609699545755
Energy: 1.9312347266122212
Energy: 2.039899962894684
Energy: 1.9635709707855544
Energy: 1.9326369286413632
Energy: 2.0223314450403302
Energy: 2.10656597908097
Energy: 1.9095285487323368
Energy: 2.1566104828967947
Energy: 2.043599021947399
Energy: 2.0319413331943297
Energy: 1.9897807272709052
Energy: 1.8922473514152538
Energy: 2.012361955723963
Energy: 1.977299119122592
Energy: 2.086165573835726
Energy: 2.0234295401742624
Energy: 2.027011046796775
Energy: 2.098015759859091
Energy: 2.0847646333602965
Energy: 1.9556248494910298
Energy: 1.9259253277028046
Energy: 2.1596757364615113
Energy: 2.027106471371884
Energy: 1.8925765774447365
Energy: 2.080601727873459
Energy: 2.080503076114971
Energy: 1.9676039256841575
Energy: 1.9346964675579201
Energy: 2.1312008323617824
Energy: 2.0317892405032008
Energy: 1.9130311963894446
Energy: 2.042241287751313
Energy: 1.914660064748191
Energy: 1.9828310364970745
Energy: 2.0529097753592036
Energy: 2.091244593494448
Energy: 2.001488622896816
Energy: 1.9050546662917176
Energy: 2.069073707700482

minimum gb energy = 1.6473980635182992 eV
minimum distance =  2.16032158575497 Angstroms
sigma value = 365


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

Energy: 1.7708832899590126
Energy: 1.9998340559416747
Energy: 1.7500335061284353
Energy: 1.7311556880753138
Energy: 1.7280303140080844
Energy: 1.7494472172352884
Energy: 1.73074012630471
Energy: 1.7097381088042332
Energy: 1.993910922432609
Energy: 1.7072010794247623
Energy: 1.7109536864002601
Energy: 1.7103755673217171
Energy: 1.7102083785897635
Energy: 1.9945285517704536
Energy: 1.7606865193568184
Energy: 1.99581130090337
Energy: 1.711526333423805
Energy: 1.7092890654937456
Energy: 1.7082882317182067
Energy: 1.7100915148799796
Energy: 1.727877628282254
Energy: 1.7618804076585801
Energy: 1.9995653420146333
Energy: 1.711559202345915
Energy: 1.710075459391002
Energy: 1.7094978903188276
Energy: 1.7108294537855684
Energy: 1.731735457893938
Energy: 1.6605092888595125
Energy: 1.9930632024783292
Energy: 1.62974557969292
Energy: 1.9663476320111137
Energy: 1.7087990776404924
Energy: 1.628639028785084
Energy: 1.9968559589889343
Energy: 1.7087612900638505
Energy: 1.9990115165353048
Energy: 1.7087057040788425
Energy: 1.7300937212253102
Energy: 1.7086436464554633
Energy: 1.7107394826596003
Energy: 1.7296883887123564
Energy: 1.7617236856557594
Energy: 1.9949872140733367
Energy: 1.711172869764615
Energy: 1.7098797421518215
Energy: 1.709260821424362
Energy: 1.7099021391592362
Energy: 2.1469662844655004
Energy: 1.76032906724733
Energy: 1.9648954274102175
Energy: 1.7114781917336654
Energy: 1.7093291408197224
Energy: 1.7082313998077854
Energy: 1.7099117506759047
Energy: 1.9958425033413696
Energy: 1.707935174428401
Energy: 2.000074120805703
Energy: 1.7077979307248004
Energy: 1.7104337382078545
Energy: 1.7095628721130811
Energy: 1.7125731960960953
Energy: 1.7313777558694166
Energy: 1.6288825440211345
Energy: 1.9937572818278197
Energy: 1.6293962058087266
Energy: 1.9650566320655045
Energy: 2.1473963549355615
Energy: 1.6290891323047227
Energy: 1.9958515698690027
Energy: 1.7611178416611166
Energy: 1.9994047741029086
Energy: 1.707954093349744
Energy: 1.7099467601008473
Energy: 1.710587473647624
Energy: 1.7102472591853235
Energy: 1.7308934852102484
Energy: 1.7600218107543013
Energy: 1.9967260875272472
Energy: 1.7111655801014043
Energy: 1.7089646194748918
Energy: 1.7084457015148447
Energy: 1.7101392355179847
Energy: 1.9938219154345458
Energy: 1.761969177601633
Energy: 1.9937477351647341
Energy: 1.7076918241860277
Energy: 1.7103314915975452
Energy: 1.7096186027225373
Energy: 1.7108848753646482
Energy: 1.995338609349678
Energy: 1.7100044228230769
Energy: 2.000082094369987
Energy: 1.7078070908684646
Energy: 1.7311492302113756
Energy: 1.7300987015007363
Energy: 1.7084887089031682
Energy: 1.731940623995023
Energy: 1.6590528803483404
Energy: 2.14726217260027
Energy: 1.6293515055485221
Energy: 1.7118692518278782
Energy: 1.7074981503177133
Energy: 1.7073192762432974
Energy: 1.9950768778408765
Energy: 1.7603642505494559
Energy: 2.0381500449210357
Energy: 1.7121564925426545
Energy: 1.7097340460869492
Energy: 1.7093188364697944
Energy: 1.7102285703594828
Energy: 1.727737693317213
Energy: 1.760552009378348
Energy: 1.996301104888987
Energy: 1.7115967419001896
Energy: 1.7095898980662767
Energy: 1.7086899671630613
Energy: 1.710572187249814
Energy: 1.728156156179017
Energy: 1.6588868285075702
Energy: 1.9940920169527612
Energy: 1.707370355846753
Energy: 1.7111522535585646
Energy: 1.7116392987423255
Energy: 1.7069267221252729
Energy: 1.995305730659426
Energy: 1.728983882183779
Energy: 2.0006966586461825
Energy: 1.709914015484955
Energy: 1.7309793724228533
Energy: 1.7289531941436829
Energy: 1.7095650013334238
Energy: 1.7301142435930188
Energy: 1.7088508634754682
Energy: 1.993777206011432
Energy: 1.707176494896394
Energy: 1.7105638847252476
Energy: 1.7099280079654076
Energy: 1.7099755483552657
Energy: 1.9955594041149873

minimum gb energy = 1.628639028785084 eV
minimum distance =  2.21693136543628 Angstroms
sigma value = 23