Model name: model_name=EAM_Dynamo_MendelevSunZhang_2019_CuZr__MO_609260676108_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.639087408781052
cohesive_energy=3.2833744154333835
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.6525650891392998e-19, 2.0798976409597799e-19, 2.4851361769973997e-19, 2.83413831318162e-19, 3.1394971578556796e-19, 3.3924007395325803e-19, 3.60683606022714e-19, 3.8026060231356e-19, 3.9913904959198197e-19, 4.17573693942786e-19, 4.35237691332636e-19, 4.51512601580808e-19, 4.65839265042036e-19, 4.77964537808148e-19, 4.88035820129472e-19, 4.96532162819574e-19, 5.03874938333196e-19, 5.1016187944501195e-19, 5.1534812520927e-19, 5.19412847329728e-19, 5.224121219885759e-19, 5.2444848849039e-19, 5.256292926696479e-19, 5.260138150618079e-19, 5.25630894846282e-19, 5.24353960068984e-19, 5.21713572976152e-19, 5.1724029581402395e-19, 5.105624236035119e-19, 5.01306649188894e-19, 4.89117289357422e-19, 4.73717167551414e-19, 4.54998937936392e-19, 4.3300425710483994e-19, 4.07683457581104e-19, 3.7877698675047594e-19, 3.45722480614422e-19, 3.0754100924956794e-19, 2.62777796272242e-19, 2.0922664445742599e-19, 1.4343870838277158e-19, 6.110493399113579e-20, -4.4746390122669e-20, -1.89358052019192e-19, -4.0485401364545996e-19, -7.605612590429699e-19, -1.415377258065306e-18, -2.74755668788026e-18, -5.5916445179590196e-18, -1.1628261552478859e-17, -2.5767326151631798e-17, -6.40369172313558e-17, -1.9111243543342197e-16]
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: 0.01413702704068354
Energy: 0.11002441242672605
Energy: 0.11124622445928696
Energy: 0.11103974249406362
Energy: 0.018545991468007846
Energy: 0.015504057282997244
Energy: 0.11017822135871096
Energy: 0.11163261267088247
Energy: 0.11075357022194952
Energy: 0.017554941873249044
Energy: 0.1099990696468597
Energy: 0.10990153418482876
Energy: 0.11051742557194666
Energy: 0.7623415254925485
Energy: 0.11196546789066332
Energy: 0.11026242904301232
Energy: 0.10982301574413598
Energy: 0.11019564347758856
Energy: 0.7618703791889296
Energy: 0.11140501372615051
Energy: 0.11102493167969102
Energy: 0.014514505855499862
Energy: 0.01455119779378334
Energy: 0.11025086777901455
Energy: 0.7622956825392243
Energy: 0.11116380902166141
Energy: 0.016962317215740715
Energy: 0.014447507246320589
Energy: 0.10993359212193489
Energy: 0.11047247152951631
Energy: 0.11045675970345091
Energy: 0.01563767012717529
Energy: 0.015471777594735777
Energy: 0.10975423440696744
Energy: 0.11002306595224547
Energy: 0.11096967898193405
Energy: 0.016279875518184894
Energy: 0.014687362286813421
Energy: 0.10958920465041672
Energy: 0.11053258650834849
Energy: 0.11046563689125691
Energy: 0.11081582121327836
Energy: 0.10979671262769547
Energy: 0.016156661189858562
Energy: 0.014871024135864299
Energy: 0.10977644907224994
Energy: 0.11126163853026623
Energy: 0.11116978593705942
Energy: 0.01645013083232289
Energy: 0.1094757428656728
Energy: 0.10977175922942346
Energy: 0.7653573076522344
Energy: 0.11098955631962505
Energy: 0.015251304610145738
Energy: 0.014716380574824566
Energy: 0.10975246368997632
Energy: 0.7647072221601291
Energy: 0.11146833390998931
Energy: 0.015732932231789173
Energy: 0.014636692201341006
Energy: 0.01471232830202803
Energy: 0.10963187808523397
Energy: 0.11040346168146416
Energy: 0.1114352640991639
Energy: 0.11191338682588092
Energy: 0.014668710388446643
Energy: 0.10964782948498877
Energy: 0.10999517344409634
Energy: 0.11205150340828952
Energy: 0.11154728074659145

minimum gb energy = 0.01413702704068354 eV
minimum distance =  2.53903579957291 Angstroms
sigma value = 3


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

Energy: 1.2123624986877415
Energy: 0.9420784452495069
Energy: 0.9415802985358646
Energy: 0.941390554500336
Energy: 0.9789819640190268
Energy: 1.1428209714167674
Energy: 0.9224070413307229
Energy: 0.9420312872613398
Energy: 0.9435353242901225
Energy: 1.0068254570071304
Energy: 0.9373374427374506
Energy: 0.9752863806494653
Energy: 0.9426433596793384
Energy: 0.9449501054303849
Energy: 0.8117646577307394
Energy: 0.901027481007025
Energy: 0.9250974726770089
Energy: 0.950209435967464
Energy: 0.8338237536064541
Energy: 0.9441976946802325
Energy: 0.9314880319845573
Energy: 1.005990161004765
Energy: 0.829220684091866
Energy: 0.9400157743228157
Energy: 0.9442783769191995
Energy: 0.7997042234665921
Energy: 1.0058815249261164
Energy: 0.8338087854148734
Energy: 0.9176343127872281
Energy: 0.9376013156921018
Energy: 0.9291351263341733
Energy: 0.9484860297798954
Energy: 0.9822846041144269
Energy: 0.7996495539836951
Energy: 0.8287950265905089
Energy: 0.8096514581188359
Energy: 0.9542851008728699
Energy: 0.9797607467874954
Energy: 0.9310038987650434
Energy: 0.9369745848633338
Energy: 1.0887787619084652
Energy: 1.0076293133085503
Energy: 0.9875263555491286
Energy: 1.0256944712106484
Energy: 0.8464910084572209
Energy: 1.0896398102142306
Energy: 0.973475095601265
Energy: 1.037359329105316
Energy: 1.0672607665771543
Energy: 0.8520295733806879
Energy: 0.9571922300764423
Energy: 1.0552365165185837
Energy: 1.0419750998476431
Energy: 0.8449278444659554
Energy: 0.9849224872158474
Energy: 0.9563652074759093
Energy: 1.049727790640267
Energy: 1.0294885359649835
Energy: 0.8458488605480048
Energy: 1.025316057008234
Energy: 1.0259666438622075
Energy: 1.0336087390771085
Energy: 1.088679784401109
Energy: 0.8504565456948475
Energy: 0.9832521936787482
Energy: 1.0269630961874727
Energy: 1.1066725392758128
Energy: 0.9754317802170994
Energy: 0.8557198550490883
Energy: 0.9841687361888765
Energy: 1.0255892673518188
Energy: 0.9809185750164141
Energy: 0.9799131575085982
Energy: 0.9129720230379763
Energy: 0.9812613169687842
Energy: 1.0199586813291543
Energy: 0.9785248235371246
Energy: 1.02507429846611
Energy: 0.9239466930872364
Energy: 0.982825962317249
Energy: 1.0197400874646525
Energy: 0.8709871975196877
Energy: 0.7956644098979654
Energy: 1.0563066426418384
Energy: 1.0513315165784454
Energy: 1.02960435030936
Energy: 0.9295532821048156
Energy: 0.7848665437689154
Energy: 1.0522822584978688
Energy: 0.9826990161763272
Energy: 0.8314441258761556
Energy: 0.8457561356770013
Energy: 0.8467816053309251
Energy: 0.9031754771777357
Energy: 0.9571433981987133
Energy: 0.8995339037993048
Energy: 0.9257712419511137
Energy: 0.852467740772862
Energy: 0.900153590107771
Energy: 0.9515403470138809
Energy: 1.0888659239589735
Energy: 0.8441148373041458
Energy: 0.8870942432775417
Energy: 0.8417475615655042
Energy: 0.9743597150139096
Energy: 1.056287497949208
Energy: 0.8461154063553846
Energy: 0.9401997127225499
Energy: 0.8994523114819745
Energy: 1.0461877862287323
Energy: 0.9052995441526849
Energy: 0.7271423766131415
Energy: 1.0527156851520567
Energy: 1.1007972005174667
Energy: 0.9845119951054936
Energy: 1.0250503820337162
Energy: 0.8499351651508623
Energy: 0.9721920582519422
Energy: 1.0558993104652543
Energy: 0.9674700610826723
Energy: 0.7283412343370284
Energy: 0.7288443078453457
Energy: 0.9059245917025646
Energy: 0.9963618841617642
Energy: 0.9551374909518969
Energy: 0.851136462859091
Energy: 0.8997542545634423
Energy: 1.0172032221114018
Energy: 0.9971720909368788
Energy: 0.9558004154922375
Energy: 0.7257434039424968
Energy: 0.7274279259817574
Energy: 1.0377875884898409
Energy: 0.9893350381870687
Energy: 1.0196203324170527
Energy: 0.9162914616675569
Energy: 0.8572677954074538
Energy: 1.0520489628534875
Energy: 0.9970824306560345
Energy: 0.9694428809662722
Energy: 1.0712217515260154
Energy: 0.9716979016365912
Energy: 0.994210892038053
Energy: 0.9957511892259122
Energy: 0.9793694829092892
Energy: 1.141568580771016
Energy: 0.9853575044186687
Energy: 0.9986343468227755
Energy: 0.9844763227056181
Energy: 0.9700271352402012
Energy: 0.7255546378151432
Energy: 1.064040309003927
Energy: 0.9900545854866123
Energy: 1.0512641052388563
Energy: 0.857553545167716
Energy: 0.8025147532970796
Energy: 1.0533341832511118
Energy: 1.0006537541928135
Energy: 0.9850437124963359
Energy: 0.7263286532573996
Energy: 0.7263565106357892
Energy: 1.0402566052100066
Energy: 0.8294584617391099
Energy: 0.9010736394293658
Energy: 0.8454962801801302
Energy: 0.8442359094750483
Energy: 0.8830562693156275
Energy: 0.8296659654599647
Energy: 0.9115338122417119
Energy: 0.7254045940427919
Energy: 0.7735491617233582
Energy: 0.8323094775517027
Energy: 0.980296733309776
Energy: 0.8634529083411729
Energy: 0.8193930396166148
Energy: 0.8989309889745312
Energy: 0.8331901734933442
Energy: 0.9795299406237878
Energy: 0.7734062265285674
Energy: 0.818853244295271
Energy: 1.0223424370190293
Energy: 1.09910703566141
Energy: 1.033027212841118
Energy: 1.0149162615484841
Energy: 0.8585579740821525
Energy: 1.009319285313746
Energy: 1.050401215302087
Energy: 0.9874888269321656
Energy: 0.9708655892412703
Energy: 0.9023409017459757
Energy: 0.9683254612629162
Energy: 0.996271734203422
Energy: 1.034506921537591
Energy: 0.8505300746079801
Energy: 1.0318556874717542
Energy: 0.9675893048129108
Energy: 0.9958012681654537
Energy: 1.0303707304685685
Energy: 0.9906924192153745
Energy: 1.0264139944105841
Energy: 1.0293412605137084
Energy: 1.0699943375733592
Energy: 1.056281167813749
Energy: 0.8530860859107966
Energy: 1.0449264278602906
Energy: 1.0238127977865576
Energy: 1.101669011469414
Energy: 1.0774733394254399
Energy: 0.8495548356645831
Energy: 1.0446390130722238
Energy: 1.0219843725608773
Energy: 0.9817101599940652
Energy: 0.9888479935244949
Energy: 0.8047079448788194
Energy: 0.9778118154121315
Energy: 1.0233071659587378
Energy: 0.9788950649884859
Energy: 0.9894909654091661
Energy: 1.0935684967162673
Energy: 0.9791854680528495
Energy: 1.0209727095179117
Energy: 0.8732751932317283
Energy: 0.7851529668810289
Energy: 1.0419959707290911
Energy: 0.9846442978284555
Energy: 1.0205941790577056
Energy: 0.8720311135587736
Energy: 0.7851385279302148
Energy: 1.0516296842403248
Energy: 0.9857065675608198
Energy: 0.9003998613922265
Energy: 0.9374912684205009
Energy: 0.8512419484724524
Energy: 0.9369798893995638
Energy: 0.9774923522049486
Energy: 0.8865789901541784
Energy: 0.8869638332448023
Energy: 0.8450755795654394
Energy: 1.1044748062336407
Energy: 0.9520212360152411
Energy: 1.050678426572741
Energy: 0.8499521421098789
Energy: 0.9012513641850259
Energy: 0.9023167826116092
Energy: 0.9222585211649352
Energy: 0.9314631685560002
Energy: 0.8461447842725339
Energy: 0.9077296208816896
Energy: 0.9059295356335323
Energy: 0.9520697648989611
Energy: 1.090453551878676
Energy: 0.9546040981166423
Energy: 0.8497474571742194
Energy: 0.972447455794609
Energy: 0.9375547503599453
Energy: 1.0024756445163352
Energy: 0.8122195727406867
Energy: 0.8838711793773243
Energy: 1.0372168744850814
Energy: 0.9924127724509416
Energy: 0.928954743009062
Energy: 0.9923434079387561
Energy: 1.046422564891033
Energy: 0.9961037853710225
Energy: 0.9672384483031983
Energy: 0.8107747094297989
Energy: 0.9422703096866244
Energy: 0.9339699160414862
Energy: 0.9967219514752998
Energy: 0.9680417138722383
Energy: 0.9329346225933679
Energy: 0.9402681175908577
Energy: 0.9886992451772328
Energy: 0.9519472532636715
Energy: 0.9251634718705332
Energy: 0.8123056414361647
Energy: 0.944909519321861
Energy: 0.9899213760094269
Energy: 0.9788702562174746
Energy: 1.0603244789303334
Energy: 1.0706995128841066
Energy: 0.9411888500677065
Energy: 0.9442263758465427
Energy: 0.9417190764453002
Energy: 0.9440811989834981
Energy: 1.0398299481071207
Energy: 0.9238489315999565
Energy: 0.9810912189297568
Energy: 0.9418820967612221
Energy: 0.9532820961981839

minimum gb energy = 0.7254045940427919 eV
minimum distance =  2.07019072883305 Angstroms
sigma value = 75


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

Energy: 1.6403860779869472
Energy: 1.0236147563670914
Energy: 0.9163782534977799
Energy: 1.0326855353107194
Energy: 1.0092938600652288
Energy: 1.0009830594004518
Energy: 1.0231374198201668
Energy: 0.9257667083490612
Energy: 1.032576635912362
Energy: 1.0572843772169183
Energy: 1.0299122898607007
Energy: 1.0536741329058543
Energy: 0.9160188854482693
Energy: 1.0316265248689538
Energy: 0.9486113618317363
Energy: 1.0225620658571262
Energy: 1.0713194694339578
Energy: 0.9223378444238528
Energy: 1.0468400847101629
Energy: 0.9581802752480375
Energy: 1.0286646503530759
Energy: 1.091144833648417
Energy: 1.2319728733520376
Energy: 0.9288106518230276
Energy: 0.9584308343936615
Energy: 0.9518995687100736
Energy: 1.0910538305320372
Energy: 1.2309759332323895
Energy: 1.0059683613852075
Energy: 1.0054456151183033
Energy: 0.9852048339748016
Energy: 1.0551471232192753
Energy: 1.1206820501505508
Energy: 0.943069515064846
Energy: 1.0019915357895064
Energy: 0.9518368600324592
Energy: 0.9582021265593981
Energy: 1.0700463946073877
Energy: 0.9237530295834397
Energy: 1.0018221882308809
Energy: 1.0946735628219193
Energy: 0.93161735383942
Energy: 1.0992319749536794
Energy: 1.0560526146845342
Energy: 1.0261607652223235
Energy: 1.1017707873597422
Energy: 0.9374493977590491
Energy: 1.0460068328922814
Energy: 1.0498435649003863
Energy: 1.0472837904440173
Energy: 1.0182343349346519
Energy: 1.0509121154058632
Energy: 1.040297081518866
Energy: 0.9472481343426451
Energy: 1.043047593439741
Energy: 1.021021660141343
Energy: 1.0365105364459808
Energy: 1.0440806117392678
Energy: 0.9477715606557259
Energy: 1.0421512061571279
Energy: 0.9743899536183959
Energy: 1.1098608993597587
Energy: 1.090320064220421
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Energy: 0.9625212836710628
Energy: 0.9764417532296441
Energy: 1.0691343895867862
Energy: 1.0913475147783411
Energy: 1.067317444058459
Energy: 0.966778895562571
Energy: 1.0034611362897852
Energy: 1.0033733586592286
Energy: 1.0819768582025977
Energy: 1.105022261189317
Energy: 0.9447473321325812
Energy: 1.0034644450393286
Energy: 0.9825450087464839
Energy: 1.0908515815027828
Energy: 1.1064307618063611
Energy: 0.9787854432036988
Energy: 1.0050945047631297
Energy: 0.9563945514686967
Energy: 0.985817644367872
Energy: 1.0908996655858312
Energy: 0.9336708283250688
Energy: 0.9593238542404817
Energy: 0.9554604312096208
Energy: 0.9361645808024848
Energy: 1.058720641499336
Energy: 0.959132957663386
Energy: 1.0382129705987775
Energy: 1.0622255628128032
Energy: 0.9288621959278723
Energy: 1.059909461617244
Energy: 1.0628867906429997
Energy: 1.0414455948054189
Energy: 1.0419908420906283
Energy: 0.9221610779648968
Energy: 1.0304634370578538
Energy: 1.1857958750897335
Energy: 1.0400714100901847
Energy: 1.0232587553312973
Energy: 1.0705431184752772
Energy: 1.0505855193253437
Energy: 1.065981697572079
Energy: 1.0264699528300647
Energy: 0.9244731678505274
Energy: 1.0418710507679307
Energy: 1.026907035304776
Energy: 1.0745408472128999
Energy: 0.9644698044324717
Energy: 0.9863592458849054
Energy: 1.0984034820647517
Energy: 1.0779414652730932
Energy: 1.0424003906568942
Energy: 0.9471527602141507
Energy: 0.939102661968713
Energy: 1.0725162098765428
Energy: 1.0505647986083702
Energy: 1.0619123776392037
Energy: 1.0079911576992702
Energy: 1.0009603101481668
Energy: 1.0137640176269649
Energy: 1.1297051101876272
Energy: 1.026974974657689
Energy: 0.933008799943392
Energy: 1.0018478338366958
Energy: 1.0079100009999598
Energy: 1.244044209736018
Energy: 1.0113814619671844
Energy: 0.9452960176717621
Energy: 0.968861729466578
Energy: 1.0921877014598147
Energy: 0.9534883580365086
Energy: 1.0584610852180436
Energy: 0.9190463411665278
Energy: 0.9324679626649406
Energy: 1.0934314987740728
Energy: 0.9583228828420798
Energy: 1.0285649654324929
Energy: 1.1809308462211738
Energy: 1.062088682074073
Energy: 1.0563170943504325
Energy: 0.9250679619209851
Energy: 1.0644615268641597
Energy: 1.1849071158252726
Energy: 1.0298328922356668
Energy: 1.0678053016556335
Energy: 0.9295419833763051
Energy: 1.0434604958323555
Energy: 1.0761795267043015
Energy: 1.0446245027785157
Energy: 0.956285702960611
Energy: 1.0580183999885342
Energy: 0.9443464918992236
Energy: 1.0545646007332155
Energy: 1.0409093600120578
Energy: 0.9454766237553908
Energy: 1.0709621123163704
Energy: 0.9438378188773765
Energy: 0.9925388041650193
Energy: 0.9849226159795188
Energy: 0.9621740655673401
Energy: 1.0908784741586701
Energy: 1.0830616302014242
Energy: 0.9548545685261229
Energy: 0.9572000590980828
Energy: 0.9706209070139928
Energy: 1.0483868647006656
Energy: 1.0845992860313738
Energy: 1.00290936147506
Energy: 0.9638885745282859
Energy: 1.0012375113661331
Energy: 1.0242638613653334
Energy: 1.2451216794673867
Energy: 1.0012739354518636
Energy: 0.9622517477753558
Energy: 0.975881579811916
Energy: 1.0286770352108803
Energy: 1.2449146109875682
Energy: 1.0482079781184228
Energy: 0.9497197741327352
Energy: 0.9552954613365989
Energy: 1.092373347105926
Energy: 0.9653487926651804
Energy: 1.0537393914659194
Energy: 0.9155814886509399
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minimum gb energy = 0.8939858139228721 eV
minimum distance =  2.12713416923071 Angstroms
sigma value = 105


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

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Energy: 0.9379362051817789
Energy: 1.0125380506216597
Energy: 1.0712772973717537
Energy: 0.9264350469893653
Energy: 1.0078927791997847
Energy: 1.0698574216807761
Energy: 1.0081736482391772
Energy: 1.0685088380977883
Energy: 0.948637389463759
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Energy: 1.0693452788206328
Energy: 1.032325627739778
Energy: 1.0353208877975628
Energy: 1.0627527104487275
Energy: 1.0122605571686878
Energy: 1.030496101021412
Energy: 1.0319784107690462
Energy: 1.0358069311521787
Energy: 1.0626123022724403
Energy: 1.0124853095347661
Energy: 1.030463689590512
Energy: 0.9756210079298596
Energy: 0.9754135727512879
Energy: 1.0101729927077596
Energy: 1.0555774575518095
Energy: 1.0342877568171713
Energy: 0.9756805431220016
Energy: 0.9448489675164676
Energy: 1.0011820758465313
Energy: 1.056400131726674
Energy: 1.0346364388558305
Energy: 0.9973473067855821
Energy: 1.0645175578870947
Energy: 0.9657645480512398
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Energy: 1.0042805357137734
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Energy: 0.9606237363036992
Energy: 0.9575127124013469
Energy: 1.0173824561331326
Energy: 0.9940126440121445
Energy: 0.9756726660700733
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Energy: 0.9460715870718054
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Energy: 0.9095876445916751
Energy: 0.9757777135009472
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Energy: 0.9700091285020019
Energy: 1.0694034074616574
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Energy: 0.9685738841559477
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Energy: 1.0355880697165958
Energy: 0.9823208716932011
Energy: 0.9758811672613196
Energy: 0.9767868362448971
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Energy: 0.9822179129718807
Energy: 0.9749501594471702
Energy: 0.9756022102778881
Energy: 0.9253897459760418
Energy: 1.076275610465911
Energy: 0.9969807069713837
Energy: 1.023499448166818
Energy: 1.01490883398537
Energy: 0.9863870089773439
Energy: 1.0502028367624119
Energy: 1.069329372395075
Energy: 1.007261433032073
Energy: 1.0340704900714615
Energy: 1.0001516884566255
Energy: 1.0652584594441965
Energy: 1.0693170094834084
Energy: 1.0723556275177326
Energy: 1.0294804667093207
Energy: 1.1407442024310392
Energy: 1.0117121760573875
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Energy: 1.0595612892887538
Energy: 1.0291879598580929
Energy: 1.0296499652283375
Energy: 1.0224879557573205
Energy: 1.069521573850033
Energy: 0.9479596218114104
Energy: 0.9476096183258288
Energy: 0.9970028761518724
Energy: 1.028708777430779
Energy: 1.0406021918964388
Energy: 0.9506880954168239
Energy: 0.9490531689987538
Energy: 1.017569637274143
Energy: 1.0046626820332814
Energy: 1.0576597490048743
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Energy: 0.9369609474386233
Energy: 0.9546930529211812
Energy: 1.0576294577671064
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Energy: 0.9500463573222105
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Energy: 0.9512312315456559
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Energy: 0.9337220785352607
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Energy: 0.9947694892737542
Energy: 0.9507961693512283
Energy: 0.9419433812927175
Energy: 0.9439208634451572
Energy: 0.9686838022443875
Energy: 1.031905327145265
Energy: 1.0319061906637694
Energy: 1.0117294515573516
Energy: 1.0662101718938302
Energy: 0.9309785432237109
Energy: 1.052355074489818
Energy: 1.034299671262682
Energy: 1.0602578759504306
Energy: 1.0660014933993693
Energy: 0.946307958134148
Energy: 1.066585750458299
Energy: 1.032146241637804
Energy: 1.0668152128814707
Energy: 1.04392792547473
Energy: 1.0337814484735937
Energy: 1.0548181150551235
Energy: 1.0322005654673696
Energy: 1.053307437894007
Energy: 1.0389577806831616
Energy: 1.0337182824635804
Energy: 1.0532202819033247
Energy: 1.067126761528019
Energy: 0.9352385430951977
Energy: 0.9183421418162705
Energy: 1.0327588507771162
Energy: 0.9747677199246081
Energy: 0.9867890812848734
Energy: 0.9371663057811941
Energy: 0.9343898866231761
Energy: 1.056170165333259
Energy: 0.9529635378179058
Energy: 0.951690861943493
Energy: 0.9356202888051286
Energy: 0.9417149075737064
Energy: 0.9381995826585423
Energy: 1.041295936884133
Energy: 0.9521394880965046
Energy: 0.9368738810107372
Energy: 0.9437512022531773
Energy: 0.9369504781219704
Energy: 1.0411572078213065
Energy: 1.03178357205083
Energy: 0.9382733396794577
Energy: 0.9437902571750513
Energy: 0.9338745329486093
Energy: 1.0213241029965427
Energy: 1.0314549329113787
Energy: 0.9491341245114395
Energy: 0.9454969293417608
Energy: 0.9445709966223749
Energy: 1.0033864773113537
Energy: 1.0328709531912226
Energy: 1.1142077250957758
Energy: 1.0236879588845802
Energy: 1.0708101897762252
Energy: 0.9771961632556442
Energy: 1.0323510881176856
Energy: 1.1033023335404983
Energy: 1.0159224436322452
Energy: 1.0690781249795565
Energy: 0.9767588338113122
Energy: 1.0177018251184322
Energy: 1.0304608187635622
Energy: 1.0348186290872667
Energy: 0.9298864243223188
Energy: 1.0715888922244214
Energy: 0.9681937524521246
Energy: 1.0305992053213127
Energy: 1.034119480406853
Energy: 0.929332488451744
Energy: 1.0539045674218948
Energy: 0.9962067425278655
Energy: 1.0396930418147043
Energy: 0.9762236003590046
Energy: 0.9432425493511112
Energy: 1.0133970674971715
Energy: 0.9274924366299668
Energy: 1.0092088613553654
Energy: 0.976300300093504
Energy: 0.9769870961457737
Energy: 1.0025123864323395
Energy: 1.0639850868155076
Energy: 0.9919488675011877
Energy: 0.9755338944524566
Energy: 1.0265961651684103
Energy: 1.0048355699181937
Energy: 1.037507135833213
Energy: 0.9925966005714864
Energy: 0.9756691025767907
Energy: 0.9890106968400431
Energy: 1.0049423558869772
Energy: 1.031802050849394
Energy: 0.9768342295313026
Energy: 0.9743377694140198
Energy: 0.9760250006813012
Energy: 1.0346513378323152
Energy: 1.029949107286872
Energy: 0.9744025507000103
Energy: 0.9924303811725949
Energy: 0.9764871085693044
Energy: 1.032396450953366
Energy: 0.9740529115618397
Energy: 0.9900826704669058
Energy: 1.0648386296827759
Energy: 1.0015784795560536
Energy: 1.0697962409756916
Energy: 0.9773327649548005
Energy: 1.0170528578430822
Energy: 1.002740407748991
Energy: 1.044522864859024
Energy: 1.0698410540467937
Energy: 1.0760571069502314
Energy: 0.9981709106658608
Energy: 0.9772532585991848
Energy: 0.9770031176674144
Energy: 1.0770209722180084
Energy: 1.022936003068114
Energy: 0.9615127075267877
Energy: 0.9746083138795656
Energy: 0.9741417477329849
Energy: 1.0699918012081906
Energy: 1.0721910769450724
Energy: 0.9593047328903697
Energy: 1.0223312297022091
Energy: 1.0291103769688337
Energy: 0.976460055310682
Energy: 1.0593407552692982
Energy: 0.931003370123575
Energy: 1.009144829249375
Energy: 1.030703196218875
Energy: 0.9927920261653697
Energy: 1.0173326822547837
Energy: 1.069658480344122
Energy: 0.9915940691499636
Energy: 1.0043167567947997
Energy: 1.0635678666215174
Energy: 1.0419420555647958
Energy: 1.0696494955222446
Energy: 1.0305902473484734
Energy: 1.0039721678233153
Energy: 1.0440774262494628
Energy: 1.0090169186330218
Energy: 1.0656193663545155
Energy: 0.9287466811298374
Energy: 0.976051988225438
Energy: 0.9912718347488229
Energy: 0.9460442080858619
Energy: 1.0522085232215197
Energy: 0.9425916794526514
Energy: 0.9865305629199428
Energy: 1.0343476133551088
Energy: 1.0729253335711617
Energy: 0.9378908489922099
Energy: 0.9664085429497244
Energy: 0.952813323239207
Energy: 0.9532947658684262
Energy: 1.0567525148724999
Energy: 0.9224031731777079
Energy: 0.9571286094735056
Energy: 0.9437152761328697
Energy: 1.0409215907698672

minimum gb energy = 0.8992307210649324 eV
minimum distance =  2.25069586280979 Angstroms
sigma value = 165


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

Energy: 1.1891753999083041
Energy: 0.926112342430574
Energy: 0.9245516325965288
Energy: 0.9419236237479793
Energy: 0.8841963417161325
Energy: 1.122858503621149
Energy: 0.9179734670230394
Energy: 0.9307633432172637
Energy: 0.9572467238859903
Energy: 0.9140876084856021
Energy: 1.047317652733861
Energy: 0.9595302673907058
Energy: 0.942202048903943
Energy: 0.9421375207263848
Energy: 0.9295514341756358
Energy: 0.9544918562911355
Energy: 0.903037022933658
Energy: 0.955228049231415
Energy: 0.9594415312986093
Energy: 1.0003373414017633
Energy: 0.9724238687470595
Energy: 1.0234563256620532
Energy: 1.0300707283285897
Energy: 0.9825678587168134
Energy: 0.9754340679771929
Energy: 0.9767119589577171
Energy: 1.0350768142964268
Energy: 1.0182063289435686
Energy: 0.9909662302054607
Energy: 0.9754092934749281
Energy: 0.9770722114613967
Energy: 0.9416559416728073
Energy: 0.9760883714612382
Energy: 0.9761931602373249
Energy: 0.9117418745115112
Energy: 1.0089246378280492
Energy: 0.9633293980532489
Energy: 1.0141776255418709
Energy: 0.9296416990495204
Energy: 0.9588311696025839
Energy: 0.980917888780799
Energy: 0.9388919315300415
Energy: 0.9752129487221007
Energy: 0.9540538036140085
Energy: 0.8996678335126236
Energy: 0.970159505174075
Energy: 0.9391895681171657
Energy: 0.9684992151128791
Energy: 0.9567945960861949
Energy: 0.9495535653970777
Energy: 0.9760117408854538
Energy: 0.9047383177854655
Energy: 0.9880358141921917
Energy: 0.914856637169956
Energy: 0.977702206975904
Energy: 0.9758050082069427
Energy: 0.9046743865202178
Energy: 0.9659618133579019
Energy: 0.9136846743682293
Energy: 0.9744449342855973
Energy: 0.9802747226698584
Energy: 0.9715453943363448
Energy: 0.9821011177095542
Energy: 0.9622987242811695
Energy: 0.9638566784814725
Energy: 0.9732595793604405
Energy: 0.9699612497166014
Energy: 0.9826444298239492
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Energy: 0.9198872422281922
Energy: 0.9013497947801613
Energy: 0.9877819208308605
Energy: 0.9569769604060436
Energy: 1.066756593895782
Energy: 1.0249768589596195
Energy: 0.8892339293985991
Energy: 0.9836107417466698
Energy: 0.9592040598189732
Energy: 0.9701224794783937
Energy: 0.9827091304858605
Energy: 0.9844473732417477
Energy: 0.96118169324635
Energy: 0.9542536472873725
Energy: 0.9712960821240482
Energy: 0.9961601363570459
Energy: 0.9846154047865018
Energy: 0.9597826758225956
Energy: 0.9694495021305081
Energy: 0.968325815714284
Energy: 0.979330058411056
Energy: 1.0686271525798103
Energy: 0.974269411307615
Energy: 0.9703286062234945
Energy: 0.9955617692969888
Energy: 0.9724413704527847
Energy: 0.9317200321180472
Energy: 0.9806968622485359
Energy: 0.9684553856212132
Energy: 0.9953258227169232
Energy: 0.9716243284078975
Energy: 0.9849566351285789
Energy: 1.0100907831271597
Energy: 0.9793115076419308
Energy: 1.0016798827320446
Energy: 1.0871800442158683
Energy: 1.00150492708428
Energy: 0.9974663005504523
Energy: 1.0141258013838381
Energy: 1.0099905134536589
Energy: 1.1905655345837
Energy: 0.994280189512339
Energy: 0.9956026601982126
Energy: 0.9832414000459919
Energy: 0.9710920526763946
Energy: 0.9553853311822647
Energy: 1.00359940869338
Energy: 0.930347464216866
Energy: 0.9819342022430806
Energy: 0.975499394108942
Energy: 0.9789039463793817
Energy: 1.0244679800432621
Energy: 0.9388173407946079
Energy: 0.9019427886774347
Energy: 0.9525703882762155
Energy: 0.9822155067778493
Energy: 0.9049460032389498
Energy: 0.9734166481545053
Energy: 0.9645663802803394
Energy: 0.9566313084327873
Energy: 0.9309477257358095
Energy: 0.9016248398959487
Energy: 0.9038160065304447
Energy: 0.974884951399554
Energy: 0.9096217586635118
Energy: 0.9637180561875387
Energy: 0.9288869624355643
Energy: 0.902948217898328
Energy: 0.9678921614083165
Energy: 0.9129162661304755
Energy: 0.9467620284879701
Energy: 0.94933965324478
Energy: 0.9884985173651567
Energy: 0.972490743560166
Energy: 0.9253575635007885
Energy: 0.9977661048471825
Energy: 0.954475208615744
Energy: 0.9626560202471718
Energy: 0.9540940817908374
Energy: 0.9312170150545586
Energy: 0.9707860632963892

minimum gb energy = 0.8841963417161325 eV
minimum distance =  2.20037107191673 Angstroms
sigma value = 41


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

Energy: 0.7901318294482821
Energy: 0.8429891994261669
Energy: 0.8537218528610688
Energy: 0.8224190788720362
Energy: 0.8077627911035409
Energy: 0.7905114283012606
Energy: 0.8411167328777438
Energy: 0.8497669018221409
Energy: 0.8212036735496043
Energy: 0.7909947466114103
Energy: 0.8764034373194584
Energy: 0.8408535502838181
Energy: 0.7993047226378907
Energy: 0.799476346243831
Energy: 0.798266774941716
Energy: 0.8764298507458887
Energy: 0.8240131081520761
Energy: 0.799168993103389
Energy: 0.799992121586031
Energy: 0.7968981277602528
Energy: 0.8278435605959419
Energy: 0.8277447073195369
Energy: 0.906010480293656
Energy: 0.8622178164649152
Energy: 0.7924283597907147
Energy: 0.8271784271853062
Energy: 0.8292661948586947
Energy: 0.8318663087586599
Energy: 0.8659344554049765
Energy: 0.7925945483557759
Energy: 0.877079553570774
Energy: 0.8000055245722164
Energy: 0.8305188120755874
Energy: 0.8654431509156423
Energy: 0.9679843735355854
Energy: 0.8469903563518775
Energy: 0.7995099586978429
Energy: 0.8310008726853138
Energy: 0.864657722674487
Energy: 0.9690964688784448
Energy: 0.8674180129139726
Energy: 0.8288772561941768
Energy: 0.8301890963378886
Energy: 0.8552791814866364
Energy: 0.8700825641648657
Energy: 0.8670803081891829
Energy: 0.8289346794878547
Energy: 0.8291976314111862
Energy: 0.8574514050177972
Energy: 0.8687822135730721
Energy: 0.867697064619618
Energy: 0.9223851764164845
Energy: 0.8571143175773503
Energy: 0.8474745470838548
Energy: 0.791598172481063
Energy: 0.870600130007803
Energy: 0.9217347505206812
Energy: 0.829287526124687
Energy: 0.8472108450248425
Energy: 0.8825564092144207
Energy: 0.8646469038515098
Energy: 0.8662107886584445
Energy: 0.8559750865338653
Energy: 0.7905635527027306
Energy: 0.8686676026964283
Energy: 0.829011991517305
Energy: 0.8659216231582169
Energy: 0.828740400020479
Energy: 0.8849846270342808
Energy: 0.8678178125067905
Energy: 0.923199293913427
Energy: 0.8255594579850443
Energy: 0.8307611827702749
Energy: 0.7969595533010573
Energy: 0.8655196420147653
Energy: 1.0869729367538223
Energy: 0.8259517167791903
Energy: 0.8310120042311967
Energy: 0.7980219318882028
Energy: 0.8626857714301056
Energy: 0.9244662187416857
Energy: 0.8625943736078976
Energy: 0.9433370228413566
Energy: 0.804595285449654
Energy: 0.8248652393614097
Energy: 0.8665480319363537
Energy: 0.8004503399653452
Energy: 0.943814226395547
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Energy: 0.8259872431148343
Energy: 0.8004963023718807
Energy: 0.8004792793429074
Energy: 0.7991781433887826
Energy: 0.8242038959012072
Energy: 0.8763282686995542
Energy: 0.8001493137984146
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Energy: 0.7991510266221017
Energy: 0.8294403098459563
Energy: 0.868543796906983
Energy: 0.8684801368138865
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Energy: 0.8152063013216038
Energy: 0.8423516078137869
Energy: 0.8494955936268751
Energy: 0.7995617594670755
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Energy: 0.8151040284312742
Energy: 0.8424914004994114
Energy: 0.8960944343359525
Energy: 0.831299646960943
Energy: 0.799360266384699
Energy: 0.8775808003827131
Energy: 0.8012233044884848
Energy: 0.8757138080702468
Energy: 0.8232782464643186
Energy: 0.7993943395811461
Energy: 0.8762639266114671
Energy: 0.8002414080157297
Energy: 0.8750312189973594
Energy: 0.799865636807653
Energy: 0.8744862726070473
Energy: 0.826340555313565
Energy: 0.8516186130636852
Energy: 0.8505934678314557
Energy: 0.7998351074844046
Energy: 0.8757722503623401
Energy: 0.8243998994490547
Energy: 0.8783072934533432
Energy: 0.8267103928525505
Energy: 0.8151034779738024
Energy: 0.7996941919573382
Energy: 0.8008179589413613
Energy: 0.8754806719163626
Energy: 0.7915305135670634
Energy: 0.8152296493530108
Energy: 0.7997779211186018
Energy: 0.8165835499300239
Energy: 0.8458877079748456
Energy: 0.791327327747309
Energy: 0.8551674988991967
Energy: 0.7996176159075832
Energy: 0.801075900535004
Energy: 0.9978779548061321
Energy: 0.8277738664785776
Energy: 0.8226749851038456
Energy: 0.7996601466717523
Energy: 0.8008508521936647
Energy: 0.8693616569414965
Energy: 0.8282432157517331
Energy: 0.9226638121953831
Energy: 0.8276966681339875
Energy: 0.8598131873574666
Energy: 0.8470686794554657
Energy: 0.8281000786322513
Energy: 0.9227364345844834
Energy: 0.827493025687328
Energy: 0.7922312594555186
Energy: 0.8467440707904104
Energy: 0.8284689706879419
Energy: 0.8291819061139372
Energy: 0.8269545067048448
Energy: 0.7915156902936753
Energy: 0.7911580422512385
Energy: 0.8282427711074342
Energy: 0.8304493911371594
Energy: 0.8267163566041124
Energy: 0.791034795972481
Energy: 0.8566093143830629
Energy: 0.7975885878406435
Energy: 0.8300743975431661
Energy: 0.866914764415049
Energy: 0.9748771533714083
Energy: 0.8762204641772916
Energy: 0.8253642336773319
Energy: 0.8272392610834788
Energy: 0.865040258985174
Energy: 0.975690013984074
Energy: 0.8793922001470208
Energy: 0.894002991896901
Energy: 0.8801916769867925
Energy: 0.8252429022016267
Energy: 0.8486271870003471
Energy: 0.8629939509242152
Energy: 0.9618905176810884
Energy: 0.8719006692032976
Energy: 0.8573299742449112
Energy: 0.8494652427044908
Energy: 0.8625881059135413
Energy: 0.9182699028218458
Energy: 0.8567844054649248
Energy: 0.8272612040751095
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Energy: 0.8803299851972065
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Energy: 0.8662156755276313
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Energy: 0.8006603384162793
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Energy: 0.8648505062891344
Energy: 0.8266465103455862
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Energy: 0.8263449118343725
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Energy: 0.8695621699976911
Energy: 0.939756981471179
Energy: 0.8262853235534021
Energy: 0.8267935757210623
Energy: 0.863140839577236
Energy: 0.871378620187736
Energy: 0.9385004607767627
Energy: 0.8275652137240292
Energy: 0.8311009463081348
Energy: 0.8013400364478583
Energy: 0.801860720235175
Energy: 0.7993420217956867
Energy: 0.826571426452492
Energy: 1.0400435613820802
Energy: 0.8009922215053994
Energy: 0.8004306434911448
Energy: 0.8002276532928081
Energy: 0.867354279313814
Energy: 0.84959246831687
Energy: 0.8423992417161298
Energy: 0.8150718549297301
Energy: 0.8002109829565075
Energy: 0.8639804060597522
Energy: 0.8539581396497369
Energy: 0.8424422937774187
Energy: 0.8143289521977012
Energy: 0.7995370748527747
Energy: 0.8004534987120351
Energy: 0.8772204366415058
Energy: 0.8237440234425129
Energy: 0.8430802360171602
Energy: 0.7990237595387407
Energy: 0.8750106557575303
Energy: 0.8792759308373441
Energy: 0.8236115458992778
Energy: 0.8442938769628201
Energy: 0.8001004431890352
Energy: 0.7921983007980443
Energy: 0.7999206755262439
Energy: 0.8774386524878691
Energy: 0.8759125636759475
Energy: 0.8226399875303563
Energy: 1.0486896662286875
Energy: 0.7995918579189276
Energy: 0.8751373996241191
Energy: 0.7998849341284353
Energy: 0.8550323696318575

minimum gb energy = 0.7901318294482821 eV
minimum distance =  2.32303044243853 Angstroms
sigma value = 185


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

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Energy: 0.7959679500204473
Energy: 0.8064033996426159
Energy: 0.6627860167070723
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Energy: 0.4435126913238667
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Energy: 0.7048317392178155
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Energy: 0.4797647288812299
Energy: 0.4771722047436657
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Energy: 0.476677045693987
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Energy: 0.7411640795017845
Energy: 0.6307783204355347
Energy: 0.654470690043813
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Energy: 0.3729928644296262
Energy: 0.6542807120811591
Energy: 0.8284895242787665
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Energy: 0.4072957182028039
Energy: 0.6721198663641843
Energy: 0.8258923606436593
Energy: 0.6443221109722138
Energy: 0.5915118609340106
Energy: 0.4253912776248925
Energy: 0.6876073447143416
Energy: 0.8309286573117779
Energy: 0.7301717750858038
Energy: 0.689341933564591
Energy: 0.7464387745857224
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Energy: 0.7334888392839072
Energy: 0.6557311670693975
Energy: 0.4543408993132209
Energy: 0.7079270494619423
Energy: 0.6066100391680311
Energy: 0.7155948624951542
Energy: 0.7053199002527752
Energy: 0.5092437717755823
Energy: 0.7067759150638443
Energy: 0.6725931013862507
Energy: 0.7258886177840669
Energy: 0.45361146277582176
Energy: 0.4073339517660721
Energy: 0.7132960974265687
Energy: 0.8215957389947899
Energy: 0.7133206331797535
Energy: 0.4883263289821863
Energy: 0.4758784700881829
Energy: 0.8163170056991279
Energy: 0.793167346923256
Energy: 0.7971969712356421
Energy: 0.7075022741222807
Energy: 0.6074912264595752
Energy: 0.7166823270027634
Energy: 0.8173784209490332
Energy: 0.7038255279131237
Energy: 0.6816948270882717
Energy: 0.6481286487149408
Energy: 0.7867802019231585
Energy: 0.7889410269905573
Energy: 0.7577055043269112
Energy: 0.5975921007474349
Energy: 0.7295198131401874
Energy: 0.780750096210219
Energy: 0.7854763885153183
Energy: 0.6514484683916765
Energy: 0.4469254560147134
Energy: 0.6524916281518558
Energy: 0.7700777768618688
Energy: 0.8301228198726365
Energy: 0.5923587967573959

minimum gb energy = 0.37296701952028244 eV
minimum distance =  2.4026551978859 Angstroms
sigma value = 33


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

Energy: 0.751783787503285
Energy: 0.7445740867359893
Energy: 0.753245280553004
Energy: 0.7529649870031477
Energy: 0.7319412888545278
Energy: 0.7323697656019111
Energy: 0.7446111918954881
Energy: 0.7530506400150411
Energy: 0.7723980745868853
Energy: 0.7319762361417801
Energy: 0.7352401657479628
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Energy: 0.7528859855063825
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Energy: 0.7554906432928568
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Energy: 0.7451656392376306
Energy: 0.7363153507977596
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Energy: 0.7529039449472359
Energy: 0.7982775732980697
Energy: 0.731036884268495
Energy: 0.7654258547198891
Energy: 0.7530873340993626
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Energy: 0.7311519070448848
Energy: 0.8402050132009002
Energy: 0.7907514463826157
Energy: 0.7532103957614843
Energy: 0.7455197881389725
Energy: 0.7312691309448537
Energy: 0.7932947114433432
Energy: 0.7908062080663403
Energy: 0.7532125010672076
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Energy: 0.7316295168501838
Energy: 0.7450365861256109
Energy: 0.7490361051965236
Energy: 0.7983142367453108
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Energy: 0.7448673118444175
Energy: 0.7488714909855444
Energy: 0.7984208181733566
Energy: 0.7349760820450509
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Energy: 0.8433919179716056
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Energy: 0.7308280178057376
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Energy: 0.7468445379995029
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Energy: 0.7359069051693986
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Energy: 0.7323339254826735
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Energy: 0.7311041306653682
Energy: 0.7312137458389694
Energy: 0.7363768526404819
Energy: 0.7346801151605034
Energy: 0.7331743006525939
Energy: 0.7315805061671413
Energy: 0.7302117721006908
Energy: 0.7363236974830087
Energy: 0.8135058314418628
Energy: 0.7348403756289369
Energy: 0.7749769843284582
Energy: 0.7331138970429394
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Energy: 0.7321023854404561
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Energy: 0.731510201078114
Energy: 0.7354084653040797
Energy: 0.7449268552205494
Energy: 0.8408113783292022
Energy: 0.7528699580224562
Energy: 0.7306746867841228
Energy: 0.7355103108192804
Energy: 0.7448503176983746
Energy: 0.8408087929993898
Energy: 0.7326106357955121
Energy: 0.7319901898070615
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Energy: 0.7459447464725024
Energy: 0.7452600171600282
Energy: 0.7327083177805377
Energy: 0.7763223888592702
Energy: 0.7916369172032215
Energy: 0.7453337267720787
Energy: 0.745743140957734
Energy: 0.7436040195872854
Energy: 0.7350666178606469
Energy: 0.7974459145629278
Energy: 0.7826899452384753
Energy: 0.7451688687008426
Energy: 0.7348114024195939
Energy: 0.73487313847703
Energy: 0.7976694731787822
Energy: 0.7464422299876594
Energy: 0.7450471487665419
Energy: 0.7482190195960685
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Energy: 0.7531328927492567
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Energy: 0.7330328845853658
Energy: 0.7309355002739463
Energy: 0.7451969446080774
Energy: 0.7531112676815668
Energy: 0.7927718786139742
Energy: 0.7335107795048107

minimum gb energy = 0.730096442584504 eV
minimum distance =  2.35080373584659 Angstroms
sigma value = 219


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

Energy: 1.3389070051027887
Energy: 0.9569428227700724
Energy: 0.994538538135117
Energy: 0.956508198118579
Energy: 0.961380109132366
Energy: 0.9480167576042202
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Energy: 0.9594303060563767
Energy: 0.9441660484097484
Energy: 0.9410714717366646
Energy: 0.9427100791660409
Energy: 0.936834589848244
Energy: 0.9591894580390631
Energy: 0.9440383739303394
Energy: 0.9427935052476637
Energy: 0.9419951448031043
Energy: 0.9370036719036628
Energy: 1.0568383886063442
Energy: 0.9889695377537818
Energy: 0.9446478576113232
Energy: 0.9418278147027039
Energy: 0.9370933419207459
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Energy: 0.9888864413050636
Energy: 0.944816984609053
Energy: 0.9410723217552436
Energy: 0.9374169893078604
Energy: 0.9381182338548649
Energy: 0.9420526115243816
Energy: 0.9268666737153778
Energy: 0.9380245901732838
Energy: 0.9389486401121563
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Energy: 0.9501914680768065
Energy: 0.9270102343851179
Energy: 0.9383090161799912
Energy: 0.938765568519712
Energy: 0.9387662488413948
Energy: 0.9417466816122692
Energy: 0.9588270454527089
Energy: 0.9843448695503496
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Energy: 0.9386593299043864
Energy: 0.9418587536962573
Energy: 0.9591468335438926
Energy: 0.9839566750436344
Energy: 0.9384904422253286
Energy: 0.9188628227905238
Energy: 0.919239687645354
Energy: 0.9404012108465086
Energy: 1.0047463998448907
Energy: 0.939620845392081
Energy: 1.180170595752442
Energy: 0.918571009690306
Energy: 0.9400044208632375
Energy: 0.9846357566111771
Energy: 0.9387795068346716
Energy: 0.9387456564720494
Energy: 0.9491008155722268
Energy: 0.9441567281750238
Energy: 0.9420499854290753
Energy: 0.9388493625235356
Energy: 0.9385628329839775
Energy: 0.9493214799530557
Energy: 0.9441130397476444
Energy: 0.941737747357032
Energy: 0.9389794186616667
Energy: 0.9193711532246845
Energy: 0.940085502713953
Energy: 0.9439802729363372
Energy: 1.0056339436080113
Energy: 0.9398720508017704
Energy: 0.9200801733071637
Energy: 0.9401891127655939
Energy: 0.9437547428800404
Energy: 0.9694528034254987
Energy: 0.9385419629448897

minimum gb energy = 0.918571009690306 eV
minimum distance =  2.30714706452019 Angstroms
sigma value = 15


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

Energy: 1.5932388818064658
Energy: 1.0857545139458424
Energy: 1.1025734259715765
Energy: 1.0869522403005503
Energy: 1.0559617455024246
Energy: 1.0664794493407097
Energy: 1.0613617385372587
Energy: 1.1077587087921787
Energy: 1.0804656278338276
Energy: 1.0499077856129309
Energy: 1.1315271238617355
Energy: 1.0856345039914836
Energy: 1.0720996403054814
Energy: 1.074805247862258
Energy: 1.1137477997888774
Energy: 1.1190387581066203
Energy: 1.0854153917732237
Energy: 1.0804262812502354
Energy: 1.0779763676886203
Energy: 1.1211858708390379
Energy: 1.102071784453141
Energy: 1.0864530110340596
Energy: 1.0854561740363844
Energy: 1.068505750404366
Energy: 1.0792901619297781
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minimum gb energy = 1.0384342598631788 eV
minimum distance =  2.24506763640955 Angstroms
sigma value = 293


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

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Energy: 1.1270233911562908
Energy: 1.1244297842490232
Energy: 1.1305320993527117
Energy: 1.1204013508482096
Energy: 1.1142114214191068
Energy: 1.1561480669161672
Energy: 1.143689278378436
Energy: 1.142703860475426
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Energy: 1.1828119577506202
Energy: 1.1362272863723044
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Energy: 1.133980642975105
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Energy: 1.0904745777441835
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Energy: 1.090937287880562
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Energy: 1.1402125813494548
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Energy: 1.0714765057924407
Energy: 1.089793396480045
Energy: 1.0295433720866602
Energy: 1.0257452839723535
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Energy: 1.0871839172437998
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Energy: 1.1204740307556833
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Energy: 1.1198230754844787
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Energy: 1.1909796846681777
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Energy: 1.1138542219179122
Energy: 1.0328274041251129
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Energy: 1.0829007416341534
Energy: 1.0845170699508169
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Energy: 1.0666687320292512
Energy: 1.0816043017044037
Energy: 1.090355504361151
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Energy: 1.1615727003899416
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Energy: 1.1499676647814692
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Energy: 1.098867317803186
Energy: 1.0782450191673107
Energy: 1.1276918159459712
Energy: 1.149687194293268
Energy: 1.1495702922495863
Energy: 1.1010218989625133
Energy: 1.0785202192927312
Energy: 1.1274332870598531
Energy: 1.1117060870623288
Energy: 1.1184642542680148
Energy: 1.1652129849127517
Energy: 1.104398867267082
Energy: 1.1295968931597895
Energy: 1.1332606761278465
Energy: 1.1532736463232667
Energy: 1.1344102874492301
Energy: 1.1629897767489086
Energy: 1.158884061306459
Energy: 1.0865290093545998
Energy: 1.0847886368628117
Energy: 1.1264832457543945
Energy: 1.0448060435243487
Energy: 1.075012980690025
Energy: 1.085931145525711
Energy: 1.083631914535851
Energy: 1.1192773281141153
Energy: 1.0441612218943968
Energy: 1.0776893623116526
Energy: 1.0762408854351926
Energy: 1.0834484098583486
Energy: 1.1395296119222447
Energy: 1.1394576710562585
Energy: 1.0770148050891148
Energy: 1.0755752697549785
Energy: 1.083061675779234
Energy: 1.1476874590311381
Energy: 1.1345872886188593
Energy: 1.0955379169140504
Energy: 1.1254993277624332
Energy: 1.1210169053514845
Energy: 1.1092394172969964
Energy: 1.1314497954272327
Energy: 1.098298840416959
Energy: 1.1245136440616348
Energy: 1.117492287184257
Energy: 1.1090985123990473
Energy: 1.119476113371394
Energy: 1.129565075854478
Energy: 1.1237218584841606
Energy: 1.1305932574829924
Energy: 1.0790065137483094
Energy: 1.1496312724292144
Energy: 1.1270140989031794
Energy: 1.1240801232885
Energy: 1.1137743164664393
Energy: 1.1483151355319847
Energy: 1.156306057834271
Energy: 1.165018115798401
Energy: 1.1389060575126526
Energy: 1.1622011110936805
Energy: 1.1455243900546306
Energy: 1.1395166021501277
Energy: 1.1067277092550163
Energy: 1.1448619164358433
Energy: 1.1734978721738976
Energy: 1.1481319369261827
Energy: 1.1422078573927814
Energy: 1.0392032754768548
Energy: 1.0905023217117025
Energy: 1.1451083203074401
Energy: 1.0757631894212956
Energy: 1.144692054190781
Energy: 1.147945272137105
Energy: 1.058453146635774
Energy: 1.147655359079501
Energy: 1.0858017281171366
Energy: 1.145079594648675

minimum gb energy = 1.0257452839723535 eV
minimum distance =  2.23494818312798 Angstroms
sigma value = 293


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

Energy: 1.0183574555978143
Energy: 1.028849635623338
Energy: 1.1035265823470315
Energy: 1.0291262230910863
Energy: 1.016299109193849
Energy: 1.0192593816669173
Energy: 1.0287211833540204
Energy: 1.1040973707673276
Energy: 1.0285128708120153
Energy: 1.0165290156555222
Energy: 1.113154562001131
Energy: 1.0272488654249596
Energy: 1.0271272712054136
Energy: 1.0275484478636556
Energy: 1.0279866639479078
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Energy: 1.0262172951290915
Energy: 1.0168343209405055
Energy: 1.0281393893807764
Energy: 1.0282196537871986
Energy: 1.028635402064694
Energy: 1.029211217743859
Energy: 1.0252918013711667
Energy: 1.0257671238116006
Energy: 1.1143211719421129
Energy: 1.028724809169355
Energy: 1.0287776746894328
Energy: 1.0256227294103317
Energy: 1.1056639261669212
Energy: 1.1055696375833983
Energy: 1.1047992257683623
Energy: 1.0209737125022214
Energy: 1.0168936184927524
Energy: 1.027686399668211
Energy: 1.1055180114658882
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Energy: 1.02866940803566
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Energy: 1.0161424227977514
Energy: 1.1041149168438957
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Energy: 1.02841738651339
Energy: 1.1114640925509758
Energy: 1.1042908095137252
Energy: 1.0181066748347536
Energy: 1.0277052233805246
Energy: 1.0284263393847892
Energy: 1.1163079223518901
Energy: 1.028343292132405
Energy: 1.114096475532919
Energy: 1.0255104129733257
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Energy: 1.0165402867054694
Energy: 1.0287803321585471
Energy: 1.114972118899258
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Energy: 1.027213687527278
Energy: 1.0175734393853662
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Energy: 1.0272009706487983
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Energy: 1.0252925343156845
Energy: 1.0253000860325479
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Energy: 1.0280778970091518
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Energy: 1.0280678476769398
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Energy: 1.0303285814157859
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Energy: 1.0277009702282505
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Energy: 1.0168750108723574
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Energy: 1.01697514996406
Energy: 1.0275299682861723
Energy: 1.1056799041361012
Energy: 1.1043925544392266
Energy: 1.0204390163772503
Energy: 1.0166000029715245
Energy: 1.0284814056817118
Energy: 1.1056426375546085
Energy: 1.0285939403360813
Energy: 1.016965984616799
Energy: 1.019997713788109
Energy: 1.1094141299688767
Energy: 1.0276501897123655
Energy: 1.0280383939587718
Energy: 1.0168603804761507
Energy: 1.0208179968077373
Energy: 1.026969987875637
Energy: 1.0284880083810837
Energy: 1.0285842676493002
Energy: 1.1050000546307042
Energy: 1.0283071353036592
Energy: 1.0261660274775917
Energy: 1.0167636571775875
Energy: 1.0290604623437314
Energy: 1.104030069739034
Energy: 1.0284096535557574
Energy: 1.025225337088314
Energy: 1.0162354993331215
Energy: 1.1043164490550503
Energy: 1.019191605949026
Energy: 1.0280611463928442
Energy: 1.0283836578596497
Energy: 1.1114222792340618
Energy: 1.1041653270013914
Energy: 1.0181107019793807
Energy: 1.0279364581964439
Energy: 1.0284972023569152
Energy: 1.1110680858736846
Energy: 1.028406969931607
Energy: 1.113701767571787
Energy: 1.025860378951428
Energy: 1.020000219698274
Energy: 1.0167555572395552
Energy: 1.028842533089791
Energy: 1.1148577080536288
Energy: 1.0250574220650313
Energy: 1.0194232077688214
Energy: 1.016958492181973
Energy: 1.0263371979970428
Energy: 1.0171031546840557
Energy: 1.027394592653172
Energy: 1.01751182072477
Energy: 1.1129817699130853
Energy: 1.0267732117624364
Energy: 1.027627283682721
Energy: 1.0274419671514015
Energy: 1.0164421263511496
Energy: 1.02765874158905
Energy: 1.0254707350567065
Energy: 1.0254780923635383
Energy: 1.114825311349893
Energy: 1.028738917350654
Energy: 1.0294917144982638
Energy: 1.0252356596365793
Energy: 1.0252049705525734
Energy: 1.1161668238144549
Energy: 1.0291086110346912
Energy: 1.0298254159113192
Energy: 1.0219645201516112
Energy: 1.0279207582740284
Energy: 1.0292157444945174
Energy: 1.1045994075050478
Energy: 1.1139342650862871
Energy: 1.0211032679427925
Energy: 1.027923978595788
Energy: 1.0187754895129733
Energy: 1.1042834169991047
Energy: 1.1139306444632655

minimum gb energy = 1.0161424227977514 eV
minimum distance =  2.25313997385068 Angstroms
sigma value = 15


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

Energy: 1.0311616993853623
Energy: 1.1637972348352554
Energy: 1.1291483439989152
Energy: 1.1179753091952807
Energy: 1.1347648665001406
Energy: 1.0286304904974055
Energy: 1.1541714860882832
Energy: 1.1533165763856046
Energy: 1.070172173267323
Energy: 1.048063469643581
Energy: 1.0198327088912766
Energy: 1.0854160543364284
Energy: 1.0271160740301437
Energy: 1.0406996177846926
Energy: 1.1536754629581727
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Energy: 1.0233054875467036
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Energy: 1.0773638228095195
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Energy: 1.048658105618538
Energy: 1.1004120422097716
Energy: 1.0792759280901554
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Energy: 1.1239117468852173
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Energy: 1.089103407228625
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Energy: 1.0174348108049376
Energy: 1.0176751096151913
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Energy: 1.134855367172738
Energy: 1.101090662295222
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Energy: 1.1036035944875238
Energy: 1.1259362652896743
Energy: 1.0690914908388203
Energy: 1.0286438854928472
Energy: 1.0289199874698685
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Energy: 1.025476508001701
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Energy: 1.1392057658971646
Energy: 1.1129696411741916
Energy: 1.0399598073724352
Energy: 1.1395465492964314
Energy: 1.130144018660312
Energy: 1.0469716063609378
Energy: 1.1126693870684643
Energy: 1.1558573354556592
Energy: 1.1303829386430206
Energy: 1.1383241171746585
Energy: 1.1108083037719614
Energy: 1.0930953961850356
Energy: 1.1559137010008127
Energy: 1.1295024354042171
Energy: 1.140120749884946
Energy: 1.1101364399575706
Energy: 1.1150191454153244
Energy: 1.0277242612606439
Energy: 1.1127673399354394
Energy: 1.1390230638808603
Energy: 1.158069711376609
Energy: 1.1021499203644398
Energy: 1.02661052376954
Energy: 1.1273708781475114
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Energy: 1.1022815708571352
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Energy: 1.201090057153537
Energy: 1.0217345305199474
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Energy: 1.169819631430433
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Energy: 1.2015793746688659
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Energy: 1.0180052824236332
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Energy: 1.022168994871539
Energy: 1.0071976645062237
Energy: 1.0192311693316574
Energy: 1.0198464359248878
Energy: 1.1222489058510527
Energy: 1.021597878860541
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Energy: 1.0209109880992568
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Energy: 1.1193806576859193
Energy: 1.0925460309155306
Energy: 1.0222946482362203
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Energy: 1.0172268863850547
Energy: 1.1042831734592806
Energy: 1.2002915444825222
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Energy: 1.0237515632439511
Energy: 1.014240877888945
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Energy: 0.9878788556252202
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Energy: 1.1446663328414788
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Energy: 1.1170551981348598
Energy: 1.1589714346034938
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Energy: 1.1163648883993054
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Energy: 1.1188282905812397
Energy: 1.0723708454849084
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Energy: 1.0955651870556276
Energy: 1.1047134535478245
Energy: 1.10276450942132
Energy: 1.1297395097778247
Energy: 1.130507449074714
Energy: 1.1321445464944828
Energy: 1.211675536269463
Energy: 1.1208413581588796
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Energy: 1.1207436145410294
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Energy: 1.09909449920227
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Energy: 1.1299997630788987
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Energy: 1.1077904179300897
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Energy: 1.0311664335845634
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Energy: 1.150075397175088
Energy: 1.1043017201159009
Energy: 1.101735563126483
Energy: 1.0167073681780558
Energy: 1.2327114270257353
Energy: 1.1729262231548772
Energy: 1.0079541719287266
Energy: 1.0170210849196704
Energy: 1.1497748022242922
Energy: 1.218622456194819
Energy: 1.1431603486922308
Energy: 1.00888998087968
Energy: 1.0176911007888685
Energy: 1.1504595543856164
Energy: 1.258851357382201
Energy: 1.0178089288011858
Energy: 1.0089126856677022
Energy: 1.016237253049485
Energy: 1.1657702845402027
Energy: 1.2589735678482403
Energy: 1.016913886184904
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Energy: 1.0161573870828393
Energy: 1.1658624598414147
Energy: 1.2409779282850208
Energy: 1.0202332074874099
Energy: 1.0084840484017255
Energy: 1.0208280907579974
Energy: 1.0962726563394134
Energy: 1.1185850422639767
Energy: 1.0193888813929286
Energy: 1.0073813555858968
Energy: 1.02123856206428
Energy: 1.0972668685358127
Energy: 1.1239908767877842
Energy: 1.0791834993951686
Energy: 1.0914333564062855
Energy: 1.1341936167757822
Energy: 1.1109475158794493
Energy: 1.114051773492011
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Energy: 1.046176980557639
Energy: 1.1349681008382217
Energy: 1.1035372483777968
Energy: 1.0988047900907272
Energy: 1.0473927069400129
Energy: 1.2048229772635999
Energy: 1.0707278953233361
Energy: 1.0141499563186562
Energy: 1.0225996280783232
Energy: 1.048750421497622
Energy: 1.2206527058593641
Energy: 1.049250282378894
Energy: 1.0164558386285838
Energy: 1.023780420544012
Energy: 1.1612684868541976
Energy: 1.1144310193804654
Energy: 1.0147048296322796
Energy: 1.0179083617877764
Energy: 1.0192280417806405
Energy: 1.146760026223686
Energy: 1.093746862423155
Energy: 1.015096812303469
Energy: 1.0151446220097342
Energy: 1.0212731541527877
Energy: 1.1343280657877548
Energy: 1.1136438309483647
Energy: 1.0170006410383927
Energy: 1.0173313268905324
Energy: 1.1036312603239515
Energy: 1.1348229940863515
Energy: 1.1143743726128355
Energy: 1.0161519829877583
Energy: 1.0153494863392583
Energy: 1.1044989921064736
Energy: 1.1612782566327118
Energy: 1.0035747746961794
Energy: 1.008922529197001
Energy: 1.0296788858233643
Energy: 1.1038700744650154
Energy: 1.1640887089555105
Energy: 1.003435864715466
Energy: 1.0065506966585904
Energy: 1.0311944915572093
Energy: 1.1032300075185706
Energy: 1.022062407682072
Energy: 1.1050263137376097
Energy: 1.1288185554811154
Energy: 1.0093762453721482
Energy: 1.1048191606869153
Energy: 1.0227690307333253
Energy: 1.1066605064898576
Energy: 1.1448680450463176
Energy: 1.0181342160827105
Energy: 1.105373777502223
Energy: 1.0828458342890444
Energy: 1.082716622804279
Energy: 1.129966480711935
Energy: 1.0474165389671204
Energy: 1.111577726955241
Energy: 1.098675075337885
Energy: 1.0154269302678662
Energy: 1.130224540143811
Energy: 1.047029093419731
Energy: 1.1086287820932963
Energy: 1.1596733151139915
Energy: 1.1291848745088164
Energy: 1.1290907318967007
Energy: 1.110118240585411
Energy: 1.0651443018909343
Energy: 1.1605156180091105
Energy: 1.1293665652697913
Energy: 1.1310029997168205
Energy: 1.1096874037602205
Energy: 1.0744417247956377
Energy: 1.0951910130523634
Energy: 1.194888747870831
Energy: 1.1873647658769297
Energy: 1.1623643784143023
Energy: 1.1021891796050478
Energy: 1.085791121128585
Energy: 1.1892614897251361
Energy: 1.2136206934877491
Energy: 1.1607799036534718
Energy: 1.1378811908809996
Energy: 1.1865449659459608
Energy: 1.2001512917751478
Energy: 1.2037352277660227
Energy: 1.1602656517221415
Energy: 1.0227357780372959
Energy: 1.1596200840525492
Energy: 1.200538369270069
Energy: 1.2022392379342766
Energy: 1.1603196100142563
Energy: 1.0238061030295895
Energy: 1.017745977280845
Energy: 1.1356468784414713
Energy: 1.0208383579612548
Energy: 1.0064160461484162
Energy: 1.0205760840953297
Energy: 1.0194028456352664
Energy: 1.1599507580995385
Energy: 1.0210517073947551
Energy: 1.0068619013507165
Energy: 1.0220290255729096
Energy: 1.01617762175176
Energy: 1.104388485591865
Energy: 1.1482768881512817
Energy: 1.0077365731934542
Energy: 1.018211671467005
Energy: 1.0781386135728068
Energy: 1.1107245863060216
Energy: 1.1035831187450285
Energy: 1.0076832016637751
Energy: 1.0195090309973238
Energy: 1.1193932294602076
Energy: 1.0974482479278085
Energy: 1.0184311325564979
Energy: 1.0180134885628924
Energy: 1.0879627485227246
Energy: 1.1145056760349488
Energy: 1.0961320328728614
Energy: 1.0160411532458944
Energy: 1.0165791206271568
Energy: 1.1069836528782333
Energy: 1.014043262311202
Energy: 1.0067318828850913
Energy: 1.0622866074491477
Energy: 1.200529184904428
Energy: 1.0463808691454326
Energy: 1.015470577075187
Energy: 1.0163466870716122
Energy: 1.126583117709348
Energy: 1.2011350641132015
Energy: 1.046899711139769
Energy: 1.0216155309753727
Energy: 1.006513605682817
Energy: 1.021052317812513
Energy: 1.1808733900001946
Energy: 1.0201546121009772
Energy: 1.020903513847871
Energy: 1.0129896616810596
Energy: 1.0222588176126324
Energy: 1.1359387987048375
Energy: 1.0172217395506782
Energy: 1.0194766573836556
Energy: 1.054345474051366
Energy: 1.1268819204623604
Energy: 1.1297836206198788
Energy: 1.1539788690018826
Energy: 1.023994984945232
Energy: 1.0365384421466106
Energy: 1.1264784798539162
Energy: 1.09967989480799
Energy: 1.1801515754780179
Energy: 1.0288400903791508
Energy: 1.1640790700392147
Energy: 1.101010210025946
Energy: 1.0926085521835895
Energy: 0.9921980814847186
Energy: 1.028923536210862
Energy: 1.1544105380430183
Energy: 1.3129910303147752
Energy: 1.123452604609806
Energy: 0.9967713761466364

minimum gb energy = 0.9878788556252202 eV
minimum distance =  2.20850564723636 Angstroms
sigma value = 437


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

Energy: 1.3078839875809536
Energy: 0.9442574854033874
Energy: 1.0752034726916904
Energy: 1.1696350480270796
Energy: 0.9327121592400621
Energy: 1.3086161453587053
Energy: 0.9392747213625604
Energy: 1.0765876495454518
Energy: 1.1706557132358657
Energy: 1.1158146618985634
Energy: 1.021278042877586
Energy: 1.1416461203744002
Energy: 1.0941400182761978
Energy: 1.093452976415924
Energy: 1.1511189018041394
Energy: 1.0228256361181958
Energy: 1.1420520780819337
Energy: 1.0928289487993017
Energy: 1.14763227922088
Energy: 1.0420486455858955
Energy: 1.0210087799749836
Energy: 1.0384176698842043
Energy: 1.0567114869002008
Energy: 0.988814961498431
Energy: 1.0128812125673803
Energy: 1.0189596295893484
Energy: 1.027121633952715
Energy: 1.0570428456003815
Energy: 0.9868231284251509
Energy: 1.0126160005246172
Energy: 0.9863780293623529
Energy: 0.9831669760759151
Energy: 1.0713955019938437
Energy: 1.1181745943989856
Energy: 1.017410827843591
Energy: 0.984427785318107
Energy: 0.9883762261058904
Energy: 1.070978692392932
Energy: 1.0393474189439704
Energy: 1.0126304681865992
Energy: 1.115711782234264
Energy: 1.1584604333850301
Energy: 1.0510533327499543
Energy: 1.0172113773335958
Energy: 1.0028081131317697
Energy: 1.1168330681656793
Energy: 1.1548133505709322
Energy: 1.0497031308738867
Energy: 1.0173481098272958
Energy: 1.1893018025879025
Energy: 1.091501040726844
Energy: 0.982356957856846
Energy: 1.0168180709841201
Energy: 1.1189799322558152
Energy: 1.3113860195063565
Energy: 1.0924869575350515
Energy: 0.9823201607366943
Energy: 1.0347778022074772
Energy: 1.1201457369701562
Energy: 1.3113756817393052
Energy: 1.0255625560922224
Energy: 1.017538350745467
Energy: 1.01548822844013
Energy: 1.0221932339082225
Energy: 1.1421846780262361
Energy: 1.024563336542639
Energy: 1.0165149634166848
Energy: 1.0154609265658507
Energy: 1.0854782534794156
Energy: 1.1423117480297267
Energy: 1.0264940823732047
Energy: 1.0177449579557492
Energy: 0.981494838131161
Energy: 1.2082712197376348
Energy: 1.1444566133869203
Energy: 1.0273889227329642
Energy: 1.0168614690102677
Energy: 0.9820595264678892
Energy: 1.207581125736934
Energy: 1.1431935919335532
Energy: 0.98608124914048
Energy: 1.0590188885200642
Energy: 1.1543603680487522
Energy: 1.0572073340827142
Energy: 0.9862213857789262
Energy: 0.9846578392783826
Energy: 1.0574582605502507
Energy: 1.1539366093486705
Energy: 1.0575454239280713
Energy: 0.9845899028623901
Energy: 1.0348136161904886
Energy: 1.0625099183312992
Energy: 0.9419718315332819
Energy: 1.1281747741337185
Energy: 1.1535642424382815
Energy: 1.1190233182951101
Energy: 1.0649300149105327
Energy: 0.981643340641892
Energy: 1.1262659551973162
Energy: 1.1538108728467367
Energy: 0.9383164888883855
Energy: 0.9375362068704003
Energy: 1.1540485520425405
Energy: 1.0204674546634656
Energy: 0.9427778296529972
Energy: 0.9368060441606558
Energy: 0.9434842312977064
Energy: 1.1531261301858033
Energy: 1.0207065706840859
Energy: 0.9834839901447467
Energy: 0.9534674161811151
Energy: 0.9397620847170808
Energy: 0.940938781497582
Energy: 1.1919057973453648
Energy: 0.9410448458884342
Energy: 0.9389447719651712
Energy: 0.9367899448754974
Energy: 0.9377049610228809
Energy: 1.1518985906005024
Energy: 0.9403214699553281
Energy: 0.9401938270161297
Energy: 0.9815186040820085
Energy: 1.1502247379897745
Energy: 1.147946940063257
Energy: 1.1510383578958088
Energy: 0.9386185900171081
Energy: 0.9815728545919956
Energy: 1.151755631927546
Energy: 1.14641968293137
Energy: 1.1530764158026345
Energy: 1.0916799759691505
Energy: 1.032336040719406
Energy: 1.1677111052598264
Energy: 0.9402284183971858
Energy: 0.9367606465261343
Energy: 1.102826469094125
Energy: 1.0337405789097243
Energy: 1.1021800857341686
Energy: 0.9397912264671656
Energy: 1.057139277820475

minimum gb energy = 0.9327121592400621 eV
minimum distance =  2.21109335782965 Angstroms
sigma value = 33