Model name: model_name=EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.61492508649826
cohesive_energy=3.540501757109522
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 4.9999999997e-06 eV

========================================
theta = 0.0
========================================

Energy: 0.013694488446078233
Energy: 0.014420859990212307
Energy: 0.8033543482097979
Energy: 0.014420859989585066
Energy: 0.014420859989585066
Energy: 0.773172398455559
Energy: 0.014420859989585066
Energy: 0.773172398455559
Energy: 0.8033543482097979
Energy: 0.014420859989585066
Energy: 0.013694488446078233
Energy: 0.014420859989585066
Energy: 0.014420859989585066
Energy: 0.773172398455559
Energy: 0.014420859989585066
Energy: 0.773172398455559

minimum gb energy = 0.013694488446078233 eV
minimum distance =  2.46837891065082 Angstroms
sigma value = 1


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

Energy: 0.9344524686735233
Energy: 0.9248930720776792
Energy: 0.8776362434028685
Energy: 0.9248930720776792
Energy: 0.880607185679598
Energy: 0.9263592176923289
Energy: 0.8717063845177276
Energy: 0.9263592176923289
Energy: 0.8215191167000312
Energy: 0.913683466897338
Energy: 0.8699115045752501
Energy: 0.913683466897338
Energy: 0.8628641162786989
Energy: 0.9355054122950038
Energy: 0.8546963392236815
Energy: 0.9355054122957644
Energy: 0.8653753280344918
Energy: 0.9263479851251272
Energy: 0.8712425956568075
Energy: 0.9263479851243666
Energy: 0.8350911393832106
Energy: 0.9116817058723379
Energy: 0.8282258031458616
Energy: 0.9116817058723379
Energy: 0.8836314808905044
Energy: 0.9133579335016205
Energy: 0.8361802813627394
Energy: 0.9133579335023813
Energy: 0.7872946723769456
Energy: 0.9261533856651815
Energy: 0.8265157001293975
Energy: 0.9261533856659421
Energy: 0.8559656244804178
Energy: 0.884052311282313
Energy: 0.8752449212786465
Energy: 0.8840523112830737
Energy: 0.8236442453216465
Energy: 0.913233616914752
Energy: 0.7814571108226672
Energy: 0.9132336169139912
Energy: 0.8695068059161035
Energy: 0.9161689450070795
Energy: 0.8561161972097925
Energy: 0.9161689450078402
Energy: 0.8629166057394846
Energy: 0.925922975468104
Energy: 0.8332914930140812
Energy: 0.9259229754673431
Energy: 0.8694594777628909
Energy: 0.9130891109938865
Energy: 0.8839068001453162
Energy: 0.9130891109938865
Energy: 0.8749563389399428
Energy: 0.9210748755794484
Energy: 0.8476309976072877
Energy: 0.9210748755794484
Energy: 0.8706129077243333
Energy: 0.926322681524005
Energy: 0.8695619499698668
Energy: 0.9263226815247657
Energy: 0.8767090448904679
Energy: 0.9247895478095575
Energy: 0.8696381267444471
Energy: 0.9247895478095575
Energy: 0.8696187747577895
Energy: 0.9136243208911197
Energy: 0.8069570177164194
Energy: 0.9136243208918803
Energy: 0.8718355257597977
Energy: 0.914248699240514
Energy: 0.8812962973327508
Energy: 0.9142486992397534
Energy: 0.8400633549954439
Energy: 0.9254983133253134
Energy: 0.8329424835557643
Energy: 0.9254983133253134
Energy: 0.871280314476531
Energy: 0.8723531383325377
Energy: 0.8590623912157053
Energy: 0.8723531383325377
Energy: 0.8252107709186158
Energy: 0.9134761916752401
Energy: 0.8022327228137521
Energy: 0.9134761916744792
Energy: 0.8550794129339367
Energy: 0.9249078532677435
Energy: 0.870869513510155
Energy: 0.9249078532669827
Energy: 0.8702111997188077
Energy: 0.9263928829339031
Energy: 0.8257405622136812
Energy: 0.9263928829331424
Energy: 0.8528919813706687
Energy: 0.9147147839863028
Energy: 0.8349938565665779
Energy: 0.9147147839870634
Energy: 0.8362341612776159
Energy: 0.9084837955863317
Energy: 0.8835338621202807
Energy: 0.9084837955870925
Energy: 0.8677466885647763
Energy: 0.925999450982881
Energy: 0.825508487589222
Energy: 0.9259994509836417
Energy: 0.8690870572027696
Energy: 0.920706092350159
Energy: 0.8557365364787526
Energy: 0.9207060923493984
Energy: 0.8237477256903248
Energy: 0.9131664327804748
Energy: 0.869722413449703
Energy: 0.9131664327804748
Energy: 0.8799176761824213
Energy: 0.9240729078714477
Energy: 0.869438422733228
Energy: 0.9240729078722084
Energy: 0.8831387096935214
Energy: 0.9252729235464816
Energy: 0.8660429082850436
Energy: 0.9252729235472422
Energy: 0.8782742914251227
Energy: 0.9197562015289177
Energy: 0.8693513091397027
Energy: 0.9197562015281568
Energy: 0.854321780793632
Energy: 0.9141261318389083
Energy: 0.8747537510848488
Energy: 0.9141261318373868
Energy: 0.8651143088344874
Energy: 0.9345828887598261
Energy: 0.8552635177279778
Energy: 0.9345828887598261

minimum gb energy = 0.7814571108226672 eV
minimum distance =  2.29366104401362 Angstroms
sigma value = 1


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

Energy: 0.9989691555944487
Energy: 0.9891791001581667
Energy: 0.9288436158618751
Energy: 0.9891791001607688
Energy: 0.9076029535011387
Energy: 0.9658104454364859
Energy: 0.9110769469233306
Energy: 0.9658104454416505
Energy: 0.8645756948183358
Energy: 0.9887279507678339
Energy: 0.9123670744547504
Energy: 0.9887279507721706
Energy: 0.8826144443835012
Energy: 0.9368213019844116
Energy: 0.8748270961249558
Energy: 0.9368213019870136
Energy: 0.8827429975835349
Energy: 0.9715509336999885
Energy: 0.9190871763420919
Energy: 0.9715509336973864
Energy: 0.9270840440209912
Energy: 0.9730246165222025
Energy: 0.8865818162305645
Energy: 0.9730246165204678
Energy: 0.907176666536998
Energy: 0.9407243504882487
Energy: 0.8707238820839913
Energy: 0.940724350489116
Energy: 0.8166609300870281
Energy: 0.9887454762419206
Energy: 0.8623188267244664
Energy: 0.9887454762401859
Energy: 0.8813636197983934
Energy: 0.9251563318111856
Energy: 0.911075409073737
Energy: 0.9251563318103184
Energy: 0.8730183411210618
Energy: 0.989715350239504
Energy: 0.85465820967358
Energy: 0.9897153502403713
Energy: 0.9070381440034002
Energy: 0.9503451749407802
Energy: 0.911024082930474
Energy: 0.9503451749416476
Energy: 0.8511185533318125
Energy: 0.9799607463341405
Energy: 0.9126857421650251
Energy: 0.9799607463315385
Energy: 0.9259021557672326
Energy: 0.9708581348582205
Energy: 0.8966128689818053
Energy: 0.9708581348634244
Energy: 0.9254949735377974
Energy: 0.970850601406783
Energy: 0.8926557921935302
Energy: 0.9708506014111198
Energy: 0.8509458236830196
Energy: 0.9798535187256081
Energy: 0.9103760424894638
Energy: 0.9798535187212715
Energy: 0.9071530835473305
Energy: 0.9503058550732101
Energy: 0.9109521547210078
Energy: 0.9503058550688734
Energy: 0.8729657138396189
Energy: 0.9900600257374893
Energy: 0.835519159252376
Energy: 0.9900600257374893
Energy: 0.8839355977649931
Energy: 0.9252688004782476
Energy: 0.9110745835015086
Energy: 0.9252688004739109
Energy: 0.8166961691458346
Energy: 0.989430997712406
Energy: 0.8621680780270894
Energy: 0.9894309977158754
Energy: 0.9071469169685323
Energy: 0.9407489677553488
Energy: 0.874823252629305
Energy: 0.9407489677527467
Energy: 0.9267461226153597
Energy: 0.9728338044043912
Energy: 0.8617558844386667
Energy: 0.9728338044035238
Energy: 0.8827376863378866
Energy: 0.9715575181383611
Energy: 0.88814057372292
Energy: 0.971557518135759
Energy: 0.8828365181186962
Energy: 0.936939806448959
Energy: 0.8707263281484812
Energy: 0.9369398064498262
Energy: 0.8643785617036385
Energy: 0.9887210315582509
Energy: 0.9104024503926982
Energy: 0.9887210315599855
Energy: 0.9076680261028044
Energy: 0.9658098342705824
Energy: 0.9112013350585576
Energy: 0.9658098342653784
Energy: 0.9989691555953158
Energy: 0.9891791001581667
Energy: 0.9113603473142216
Energy: 0.9891791001607688
Energy: 0.9076029535028735
Energy: 0.9658104454364859
Energy: 0.9110769469224634
Energy: 0.9658104454416505
Energy: 0.8645756948183358
Energy: 0.9887279507678339
Energy: 0.9059110917876262
Energy: 0.9887279507721706
Energy: 0.8826144443835012
Energy: 0.9368213019844116
Energy: 0.8683124716454285
Energy: 0.9368213019870136

minimum gb energy = 0.8166609300870281 eV
minimum distance =  2.28347337693988 Angstroms
sigma value = 25


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

Energy: 0.9549437252212133
Energy: 1.037264183193319
Energy: 0.9372211557350141
Energy: 1.037264183193319
Energy: 0.969218810956481
Energy: 1.0030382846858772
Energy: 0.9338326165777009
Energy: 1.0030382846858772
Energy: 0.9225100251003602
Energy: 1.0650353498054215
Energy: 0.9349994609491818
Energy: 1.0650353498044132
Energy: 0.9326808472220282
Energy: 1.0095688179312692
Energy: 0.9083701487812255
Energy: 1.0095688179312692
Energy: 0.9100300887642212
Energy: 1.0374745568221448
Energy: 0.8758938388350569
Energy: 1.0374745568221448
Energy: 0.986724992370661
Energy: 1.065438654175001
Energy: 0.9078126824504552
Energy: 1.0654386541760092
Energy: 0.9350123562991652
Energy: 0.9369755241950503
Energy: 0.9312070429206446
Energy: 0.9369755241950503
Energy: 1.0203382938229664
Energy: 1.0377770855577295
Energy: 0.8710100557095168
Energy: 1.0377770855577295
Energy: 0.9316064403319637
Energy: 0.9988558374587192
Energy: 0.9352332968499323
Energy: 0.9988558374587192
Energy: 0.9336361406417502
Energy: 1.0654584207664315
Energy: 0.8985302896513444
Energy: 1.0654584207674398
Energy: 0.9209898189180399
Energy: 1.037079888821662
Energy: 0.9345207450716938
Energy: 1.0370798888206536
Energy: 0.9096385290328082
Energy: 1.0371515543378886
Energy: 0.934772348971244
Energy: 1.0371515543368806
Energy: 0.9347820977127881
Energy: 1.0103344315991074
Energy: 0.8980462052364684
Energy: 1.0103344315991074
Energy: 0.932064727492096
Energy: 0.9338652186325492
Energy: 0.968770948709752
Energy: 0.9338652186325492
Energy: 0.8769081709988562
Energy: 1.0376869029783697
Energy: 0.8691103348592328
Energy: 1.0376869029773612
Energy: 0.9345116395646024
Energy: 0.939287598920651
Energy: 0.9083917886240117
Energy: 0.9392875989216593
Energy: 0.8559078856316236
Energy: 1.064947232581489
Energy: 0.855554337869398
Energy: 1.0649472325804805
Energy: 0.9084109423657206
Energy: 1.0118929717018295
Energy: 0.9329215490792442
Energy: 1.0118929717018295
Energy: 0.8967941376037597
Energy: 1.0089223946883181
Energy: 0.9101415906238088
Energy: 1.0089223946883181
Energy: 0.9098008102005892
Energy: 1.0651968822304143
Energy: 0.937584885747878
Energy: 1.0651968822304143
Energy: 0.945581152848516
Energy: 0.9937810280396387
Energy: 0.9353686380078985
Energy: 0.9937810280396387
Energy: 0.9548654829820163
Energy: 1.0373382650605445
Energy: 0.9790720872888881
Energy: 1.0373382650605445
Energy: 0.9366434240213314
Energy: 1.004431209476917
Energy: 0.934277761286152
Energy: 1.0044312094779253
Energy: 0.8999289664782338
Energy: 1.0654997467334686
Energy: 0.9338112634247174
Energy: 1.0654997467334686
Energy: 0.9348885877358268
Energy: 0.9443438506555715
Energy: 0.9073871021108281
Energy: 0.9443438506616211

minimum gb energy = 0.855554337869398 eV
minimum distance =  2.28741287654134 Angstroms
sigma value = 9


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

Energy: 1.076049669975793
Energy: 1.0835942957081075
Energy: 1.0720972316447237
Energy: 1.0835942957081075
Energy: 0.9742244137334776
Energy: 1.0668765659110266
Energy: 0.9828596900533599
Energy: 1.0668765659110266
Energy: 0.9032477085776376
Energy: 1.0061948784690786
Energy: 0.9829452798809388
Energy: 1.0061948784666732
Energy: 1.0064162994953163
Energy: 1.0872110312006646
Energy: 0.9229713059194004
Energy: 1.087211031199462
Energy: 1.033674217673694
Energy: 1.066995146425682
Energy: 0.9991101761139072
Energy: 1.066995146424479
Energy: 0.9255728157775955
Energy: 1.0063915377497517
Energy: 0.9609476895185596
Energy: 1.0063915377509545
Energy: 1.0028881799179516
Energy: 0.9229537522663841
Energy: 0.9240463614273191
Energy: 0.9229537522663841
Energy: 0.9457191788829349
Energy: 1.0060961372535164
Energy: 0.9511193956678946
Energy: 1.0060961372523134
Energy: 1.0022140598829932
Energy: 1.0671665848827037
Energy: 0.9542654927854695
Energy: 1.0671665848827037
Energy: 1.0078115394759095
Energy: 1.083379852452702
Energy: 0.922819813097259
Energy: 1.0833798524514995
Energy: 0.9329933118272741
Energy: 1.0750027768641572
Energy: 1.0145697434030214
Energy: 1.0750027768629546
Energy: 1.0044678376085092
Energy: 1.0324489662637282
Energy: 0.9228954332284259
Energy: 1.0324489662649312
Energy: 0.926015373196569
Energy: 1.0108335161022493
Energy: 0.9461345028482593
Energy: 1.0108335161034523
Energy: 0.970586674742249
Energy: 0.9942839688482996
Energy: 0.9958761649709879
Energy: 0.9942839688470969
Energy: 0.9260869836886411
Energy: 1.0111752004529913
Energy: 0.9672330725383237
Energy: 1.0111752004529913
Energy: 1.0050133066931832
Energy: 1.0109781815338377
Energy: 0.9226599855592467
Energy: 1.0109781815326349
Energy: 1.0089137080557566
Energy: 1.0659567139769088
Energy: 0.9831366703423392
Energy: 1.0659567139745032
Energy: 0.9981835272245972
Energy: 1.0837711520181061
Energy: 0.9229862620293094
Energy: 1.0837711520181061
Energy: 1.0015721018219312
Energy: 1.0577747697337099
Energy: 0.9837320964182699
Energy: 1.0577747697349127
Energy: 0.9874516079753354
Energy: 1.0061714474545655
Energy: 0.9508643082087119
Energy: 1.0061714474545655
Energy: 1.0024906546609869
Energy: 1.0316438540208739
Energy: 0.9239317253450694
Energy: 1.0316438540232795

minimum gb energy = 0.9032477085776376 eV
minimum distance =  2.28314055597303 Angstroms
sigma value = 25


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

Energy: 0.9585125896537343
Energy: 1.108591037560275
Energy: 1.1042963652470128
Energy: 1.108591037560275
Energy: 0.9430492461138481
Energy: 1.0808952478382274
Energy: 0.9319764130977549
Energy: 1.080895247839715
Energy: 0.9326431274748277
Energy: 1.0945535456067803
Energy: 0.9317200929374031
Energy: 1.094553545667733
Energy: 0.958571108041071
Energy: 1.0761405913079027
Energy: 1.06026898498602
Energy: 1.0761405913064153
Energy: 1.0573864275530904
Energy: 0.9436786445866953
Energy: 0.9820741942116911
Energy: 0.9436786445881827
Energy: 0.9356347072153567
Energy: 1.1606336351469457
Energy: 0.9343950191176855
Energy: 1.160633635145492
Energy: 0.9322476214210361
Energy: 1.0763689555863518
Energy: 0.9320997653850288
Energy: 1.0763689555878393
Energy: 1.0483804717384273
Energy: 0.9333800874566083
Energy: 0.9573066484452424
Energy: 0.9333800874566083
Energy: 0.931913689457083
Energy: 1.0781786370662017
Energy: 0.9453280895625367
Energy: 1.0781786370676891
Energy: 1.0921391239265894
Energy: 1.0940148725799144
Energy: 0.9341937066307903
Energy: 1.0940148725784267
Energy: 0.9919391771478684
Energy: 1.076962154010026
Energy: 1.1712857013698237
Energy: 1.0769621540085386
Energy: 0.9324514403569935
Energy: 0.9690059402242814
Energy: 1.0903751603546932
Energy: 0.9690059402242814
Energy: 1.0479638658513966
Energy: 1.0943682248552384
Energy: 0.9320401030685183
Energy: 1.0943682248522635
Energy: 0.9319167920018142
Energy: 1.0787601822014732
Energy: 0.9572276458766051
Energy: 1.0787601821999857
Energy: 0.9681329661214448
Energy: 1.0691386252807034
Energy: 1.0485633946663915
Energy: 1.0691386252821906
Energy: 0.9427636927777104
Energy: 1.0378749468239574
Energy: 0.9353979495108
Energy: 1.0378749468239574
Energy: 0.9322595737755887
Energy: 1.0156021074736092
Energy: 1.089952515476865
Energy: 1.0156021074736092

minimum gb energy = 0.9317200929374031 eV
minimum distance =  2.34965412993119 Angstroms
sigma value = 17


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

Energy: 1.0622662244887393
Energy: 1.0614764990357688
Energy: 1.2070404684661855
Energy: 1.0614764990349264
Energy: 1.0958169587245004
Energy: 1.0234231192125256
Energy: 0.9596608527179259
Energy: 1.023423119213368
Energy: 1.0764892457412252
Energy: 1.0577186840800135
Energy: 0.9593744463847105
Energy: 1.057718684080856
Energy: 0.9618074559976653
Energy: 1.0609983118469852
Energy: 1.0339711642591687
Energy: 1.0609983118461428
Energy: 1.1039742250693128
Energy: 1.1249964693465992
Energy: 0.9601439010366261
Energy: 1.1249964693465992
Energy: 0.9716153295292299
Energy: 0.9953644060422895
Energy: 1.0734763340056228
Energy: 0.9953644060422895
Energy: 0.9644305706918497
Energy: 1.0680869898160672
Energy: 0.9600133568013799
Energy: 1.0680869898152248
Energy: 1.0714540471396452
Energy: 1.0609470215216528
Energy: 0.9688824726560372
Energy: 1.060947021522495
Energy: 0.9745331374293731
Energy: 1.1063671494775027
Energy: 1.105821229553735
Energy: 1.1063671494783451
Energy: 1.1740734215241444
Energy: 1.0331168955095114
Energy: 0.9599121250478222
Energy: 1.033116895508669
Energy: 0.9645527964281809
Energy: 1.0575984058924184
Energy: 1.0800552915762585
Energy: 1.057598405889891
Energy: 0.9693160057863609
Energy: 1.0648250089227986
Energy: 0.9691602304453122
Energy: 1.0648250089219562
Energy: 1.0930650957139987
Energy: 1.0589012011917411
Energy: 1.0585824919100726
Energy: 1.0589012011917411
Energy: 0.9595257307290165
Energy: 1.176943516847737
Energy: 1.0868332670427188
Energy: 1.176943516847737
Energy: 1.0457293715607505
Energy: 1.0693065745189774
Energy: 0.9740209730958747
Energy: 1.069306574518135
Energy: 1.0778365817513937
Energy: 1.060710028130112
Energy: 1.0715031460691797
Energy: 1.060710028130112
Energy: 0.9603809372285427
Energy: 1.0563937297081638
Energy: 1.1820662062687355
Energy: 1.0563937297081638
Energy: 1.0685450850394285
Energy: 1.0568545615213598
Energy: 0.9716195626861404
Energy: 1.0568545615222023
Energy: 0.9830810873824616
Energy: 1.07293919524091
Energy: 1.0239694396208017
Energy: 1.07293919524091
Energy: 0.9597399407489318
Energy: 1.0611192090641184
Energy: 0.9620315045503537
Energy: 1.0611192090658035
Energy: 1.0166892004279255
Energy: 1.0579326888966951
Energy: 1.0762689385813164
Energy: 1.0579326888966951
Energy: 0.9599761305922572
Energy: 1.1274446290073823
Energy: 1.1766371934625355
Energy: 1.1274446290082247
Energy: 1.094332919576906
Energy: 1.0615744953941162
Energy: 0.9599068683367272
Energy: 1.0615744953949589
Energy: 0.9686459408424107
Energy: 1.069563239415059
Energy: 1.0887438295091014
Energy: 1.0695632394159014
Energy: 0.9684465239634162
Energy: 1.0572586728482742
Energy: 1.0878987577389292
Energy: 1.0572586728491167
Energy: 1.098191726879108
Energy: 1.060943769159677
Energy: 0.9611119025922907
Energy: 1.060943769159677
Energy: 0.960098087432455
Energy: 1.10587711876443
Energy: 1.200257182230572
Energy: 1.105877118766115
Energy: 1.0742121101514386
Energy: 0.9949012786725377
Energy: 1.0773290370912043
Energy: 0.9949012786725377
Energy: 1.1439221818839156
Energy: 1.102157092286432
Energy: 0.9643071681905018
Energy: 1.1021570922889594
Energy: 0.968685676971298
Energy: 1.1052961237269332
Energy: 1.0698776652954347
Energy: 1.1052961237277754

minimum gb energy = 0.9593744463847105 eV
minimum distance =  2.26796760683253 Angstroms
sigma value = 53


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

Energy: 0.9210417110270211
Energy: 0.9203640291758113
Energy: 1.221462922873899
Energy: 0.9203640291738718
Energy: 1.1021687593151075
Energy: 0.9954998643062142
Energy: 1.0229846913348153
Energy: 0.9954998643081536
Energy: 0.9219279093465393
Energy: 0.9198171437968856
Energy: 1.0082794253539296
Energy: 0.9198171437949461
Energy: 0.9216913926954425
Energy: 0.9199284905203858
Energy: 1.0932707883505264
Energy: 0.9199284905223252
Energy: 1.1021765298253063
Energy: 0.9955007332455273
Energy: 1.0261312820598807
Energy: 0.9955007332494062
Energy: 0.9210417110270211
Energy: 0.9203640291758113
Energy: 1.2214629020148187
Energy: 0.9203640291758113
Energy: 1.1021687593151075
Energy: 0.9954998643062142
Energy: 1.0815311387934927
Energy: 0.9954998643100931
Energy: 0.9219279093465393
Energy: 0.919817143798825
Energy: 1.083340494827043
Energy: 0.919817143798825
Energy: 0.9216913926954425
Energy: 0.9199284905203858
Energy: 1.093270788352466
Energy: 0.9199284905223252
Energy: 1.1021765298253063
Energy: 0.9955007332455273
Energy: 1.0838001431071431
Energy: 0.9955007332494062
Energy: 0.9210417110270211
Energy: 0.9203640291758113
Energy: 1.2214628552757651
Energy: 0.9203640291738718
Energy: 1.1021687593151075
Energy: 0.9954998643062142
Energy: 1.0815311387934927
Energy: 0.9954998643081536
Energy: 0.9219279093445999
Energy: 0.919817143798825
Energy: 1.083340494827043
Energy: 0.9198171437968856

minimum gb energy = 0.9198171437949461 eV
minimum distance =  2.32751350171425 Angstroms
sigma value = 9


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

Energy: 1.0171453754889048
Energy: 1.1516456755940638
Energy: 1.279333563355819
Energy: 1.1516456755962172
Energy: 1.1364210897045115
Energy: 1.0545714934329946
Energy: 1.013638083318668
Energy: 1.0545714934322767
Energy: 0.9959500526130535
Energy: 1.006128238714638
Energy: 1.013148074447663
Energy: 1.0061282387153556
Energy: 1.1034551554413756
Energy: 1.1779489456093382
Energy: 1.013561926709598
Energy: 1.1779489456086203
Energy: 1.12429387559945
Energy: 1.058436920704858
Energy: 1.010528757907906
Energy: 1.0584369207055757
Energy: 1.006500621511052
Energy: 1.0057207255424703
Energy: 1.109301357806367
Energy: 1.0057207255431884
Energy: 1.28500630849973
Energy: 1.0545026342877373
Energy: 1.0115618178914465
Energy: 1.0545026342863018
Energy: 1.0021467394710748
Energy: 1.2191063806075335
Energy: 1.113903501894131
Energy: 1.2191063806068156
Energy: 0.9985283847072818
Energy: 1.183547090695449
Energy: 1.0124384112087497
Energy: 1.1835470906932954
Energy: 0.9979964055939476
Energy: 1.0519483806644208
Energy: 1.0106322644575108
Energy: 1.0519483806644208
Energy: 1.0032108964614517
Energy: 1.0700288492050298
Energy: 1.269115501136164
Energy: 1.0700288492007557
Energy: 1.1296765453707953
Energy: 1.1435214737366541
Energy: 1.0028762995186205
Energy: 1.1435214737352184
Energy: 0.9980238248440189
Energy: 1.0805848383892647
Energy: 1.1968757234167726
Energy: 1.0805848383899823
Energy: 1.1072354781652247
Energy: 1.1141739224155698
Energy: 1.0204005831120755
Energy: 1.1141739224026492
Energy: 1.005911165290778
Energy: 1.1274159558586438
Energy: 1.1121247838332116
Energy: 1.127415955857926
Energy: 1.0014971107095936
Energy: 1.1837110171630938
Energy: 1.106195338816064
Energy: 1.1837110171630938
Energy: 1.0641169738248908
Energy: 1.1270858897253495
Energy: 1.0054794351962695
Energy: 1.1270858897239138
Energy: 1.0061904533603152
Energy: 1.0549203533552676
Energy: 1.1228123775996248
Energy: 1.0549203533559854
Energy: 1.1225811524592668
Energy: 1.0800419134626127
Energy: 1.0078101247343887
Energy: 1.0800419134626127
Energy: 1.0042900678650764
Energy: 1.06237174882007
Energy: 1.0731366966260432
Energy: 1.06237174882007
Energy: 1.108368083585826
Energy: 1.1721070125611344
Energy: 1.1050045736536889
Energy: 1.1721070125604165
Energy: 1.0775300197188558
Energy: 1.1148631585983542
Energy: 0.9974273548690729
Energy: 1.114863158599072
Energy: 1.0122947264702236
Energy: 1.1331066727224146
Energy: 0.9978703884573124
Energy: 1.1331066727224146
Energy: 1.2877192899588792
Energy: 1.0733721856299931
Energy: 1.0012947398821896
Energy: 1.0733721856307108
Energy: 1.0118370969807045
Energy: 1.1567688966665624
Energy: 1.2145572313952213
Energy: 1.156768896667998
Energy: 1.0612440663977518
Energy: 1.0060956356844997
Energy: 0.9965619152675937
Energy: 1.006095635683782
Energy: 1.0695758511153808
Energy: 1.1305080857178473
Energy: 1.10269791331936
Energy: 1.1305080857192833
Energy: 1.0244371615480345
Energy: 1.1725988193043728
Energy: 1.1032442736496895
Energy: 1.1725988193000658
Energy: 1.058884217346665
Energy: 1.0058142371061243
Energy: 0.9959198222027398
Energy: 1.0058142371054066
Energy: 1.0134968570810408
Energy: 1.1558376038429554
Energy: 1.2164205948751277
Energy: 1.1558376038422375
Energy: 1.219071489980201
Energy: 1.0724211806115798
Energy: 1.00077544297339
Energy: 1.0724211806122976
Energy: 1.0140723055877172
Energy: 1.0559713584942594
Energy: 0.9968726553618643
Energy: 1.0559713584942594
Energy: 1.014146213971206
Energy: 1.1188620201759931
Energy: 0.9964731238383074
Energy: 1.1188620201752755
Energy: 1.1122389963208552
Energy: 1.1745005011851484
Energy: 1.103229745606584
Energy: 1.1745005011865841
Energy: 1.0083618699344188
Energy: 1.1562959814910743
Energy: 1.284229903379551
Energy: 1.1562959814910743

minimum gb energy = 0.9959198222027398 eV
minimum distance =  2.28416422468471 Angstroms
sigma value = 73


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

Energy: 1.0873099796473564
Energy: 1.0830689030752052
Energy: 1.2074064994515856
Energy: 1.0830689030752052
Energy: 1.0786419287456706
Energy: 1.0951543740275052
Energy: 1.0151739313858508
Energy: 1.0951543740263663
Energy: 1.0102464233209987
Energy: 1.0135082186236075
Energy: 1.0122891054997158
Energy: 1.0135082186258852
Energy: 0.997797281169659
Energy: 1.0201343223299408
Energy: 1.0236756227541453
Energy: 1.0201343223322186
Energy: 1.0552283339854838
Energy: 1.0914245590059015
Energy: 1.0541099710841564
Energy: 1.0914245590047627
Energy: 1.0208548203672132
Energy: 1.015210194040998
Energy: 1.1777666577330543
Energy: 1.015210194040998
Energy: 1.272146788147644
Energy: 1.1486458122034422
Energy: 1.0132930498618795
Energy: 1.1486458122011647
Energy: 1.0040231312286447
Energy: 1.0109704252791807
Energy: 1.1909153338736622
Energy: 1.0109704252791807
Energy: 1.2336115292484247
Energy: 1.012042275633396
Energy: 1.0142794417818077
Energy: 1.0120422756345349
Energy: 1.011041301560456
Energy: 1.0812907915517376
Energy: 1.0113016490165359
Energy: 1.0812907915528764
Energy: 1.0070200908517946
Energy: 1.0118894094001727
Energy: 1.179477234594269
Energy: 1.0118894094001727
Energy: 1.130540617588757
Energy: 1.0202457851147386
Energy: 0.9981472740283822
Energy: 1.0202457851147386
Energy: 1.0221961250337601
Energy: 1.0771854144050224
Energy: 1.1888687892076748
Energy: 1.0771854144038835
Energy: 1.2133058441901097
Energy: 1.1411086987812937
Energy: 1.0208474965807812
Energy: 1.1411086987812937
Energy: 1.0031106707252953
Energy: 1.1632915756982043
Energy: 1.1816608074389006
Energy: 1.1632915756970654
Energy: 1.1801572824399198
Energy: 1.0114248963923604
Energy: 1.004148038152021
Energy: 1.0114248963934995
Energy: 1.0772705089637926
Energy: 1.0773245575409176
Energy: 1.0101615359834166
Energy: 1.0773245575397787
Energy: 1.0783722580608655
Energy: 1.0206320466357677
Energy: 1.0102439086066117
Energy: 1.0206320466357677
Energy: 1.1222437663431655
Energy: 1.0116912757719394
Energy: 1.0029538710309351
Energy: 1.0116912757708005
Energy: 1.015104035127898
Energy: 1.1001959674544675
Energy: 1.2225715200534388
Energy: 1.100195967456745
Energy: 1.203652938287305
Energy: 1.0110548482890143
Energy: 1.0218123901196525
Energy: 1.0110548482901531
Energy: 1.0234913414090876
Energy: 1.0914990734744106
Energy: 1.133730315388679
Energy: 1.0914990734732717

minimum gb energy = 0.997797281169659 eV
minimum distance =  2.28852047891644 Angstroms
sigma value = 7


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

Energy: 1.0408309265247846
Energy: 1.039272765811594
Energy: 1.2787714688600522
Energy: 1.0392727658123992
Energy: 1.2459099731331504
Energy: 1.075893462087751
Energy: 1.0177601406316459
Energy: 1.0758934620829192
Energy: 1.0113133285960842
Energy: 1.0392118956212624
Energy: 1.0348824549224722
Energy: 1.0392118956220675
Energy: 1.0346288280999907
Energy: 1.0978629404138174
Energy: 1.017390910557096
Energy: 1.0978629404114013
Energy: 1.0118066924660267
Energy: 1.0792243102907642
Energy: 1.0319042256889976
Energy: 1.0792243102915695
Energy: 1.0095537226969271
Energy: 1.0399722835323093
Energy: 1.2130256914184867
Energy: 1.03997228353392
Energy: 1.1359440202556594
Energy: 1.123147316808611
Energy: 1.032493815153835
Energy: 1.1231473168126378
Energy: 1.0095757945883237
Energy: 1.0396114769047833
Energy: 1.2449550561117877
Energy: 1.0396114769039781
Energy: 1.141849689107133
Energy: 1.0866434174944237
Energy: 1.0190259890267859
Energy: 1.086643417495229
Energy: 1.0101893062114797
Energy: 1.1019412713024488
Energy: 1.121868663487111
Energy: 1.10194127130567
Energy: 1.0361085272244415
Energy: 1.042299884730438
Energy: 1.0355072322182846
Energy: 1.04229988473527
Energy: 1.0451444009313868
Energy: 1.079459859432515
Energy: 1.0361411414069746
Energy: 1.0794598594333202
Energy: 1.0417980443552228
Energy: 1.0395905444139577
Energy: 1.03675414254313
Energy: 1.0395905444123472
Energy: 1.0346978674047946
Energy: 1.034455835989896
Energy: 1.0354411059740425
Energy: 1.0344558359939229
Energy: 1.0087421432255237
Energy: 1.182968310633801
Energy: 1.1435683507352252
Energy: 1.1829683106329958
Energy: 1.2981239011476622
Energy: 1.0342446553493938
Energy: 1.020774292192538
Energy: 1.034244655346978
Energy: 1.0085432597177302
Energy: 1.0791348195372135
Energy: 1.0685691277378588
Energy: 1.079134819533187
Energy: 1.0270814777905364
Energy: 1.1755222870577846
Energy: 1.0359220879830777
Energy: 1.1755222870650324
Energy: 1.0089118143019022
Energy: 1.0394654781713595
Energy: 1.036266409311192
Energy: 1.0394654781713595
Energy: 1.0099336954804718
Energy: 1.0808608219555687
Energy: 1.0362579639325424
Energy: 1.080860821951542
Energy: 1.0362946341779082
Energy: 1.1787107553501028
Energy: 1.018853636300097
Energy: 1.1787107553533243
Energy: 1.0097192540396798
Energy: 1.0391694877003057
Energy: 1.1246869211376047
Energy: 1.039169487703527
Energy: 1.2268223650277883
Energy: 1.0868959390717905
Energy: 1.0266768050814286
Energy: 1.086895939075012
Energy: 1.0405527975127427
Energy: 1.0397750563581325
Energy: 1.2124560388947894
Energy: 1.0397750563557169
Energy: 1.0435142353986715
Energy: 1.0811505135652588
Energy: 1.0268110116600009
Energy: 1.0811505135668695
Energy: 1.034759273078862
Energy: 1.0388326681864795
Energy: 1.0349688503113772
Energy: 1.038832668185674
Energy: 1.0119905474175461
Energy: 1.0997533325896653
Energy: 1.026996776340055
Energy: 1.0997533325944973
Energy: 1.034494934597687
Energy: 1.0787476725385958
Energy: 1.0174587625465399
Energy: 1.0787476725450384
Energy: 1.0108729014720712
Energy: 1.040013061862473
Energy: 1.1197939968768094
Energy: 1.040013061867305
Energy: 1.048964142444525
Energy: 1.0339666073196636
Energy: 1.0177248961475305
Energy: 1.0339666073244955
Energy: 1.0107183627180292
Energy: 1.0401759536304584
Energy: 1.189989942410534
Energy: 1.0401759536312636

minimum gb energy = 1.0085432597177302 eV
minimum distance =  2.28299190302378 Angstroms
sigma value = 29


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

Energy: 0.9981157486501545
Energy: 0.9869123259198881
Energy: 1.302849055000011
Energy: 0.9869123259198881
Energy: 0.9664334449687819
Energy: 1.0004237934881235
Energy: 0.9839668102907079
Energy: 1.0004237934881235
Energy: 0.9704154569733615
Energy: 1.05394027602036
Energy: 1.0832667589287022
Energy: 1.0539402760198302
Energy: 0.9992794374697287
Energy: 0.9669282580537285
Energy: 0.9859121565366404
Energy: 0.966928258053448
Energy: 0.9985279271619082
Energy: 1.027738750176446
Energy: 0.9687079920024616
Energy: 1.0277387501761652
Energy: 0.9860530967438057
Energy: 1.0485731191642702
Energy: 0.9856155225050803
Energy: 1.0485731191642702
Energy: 0.9846563463410032
Energy: 1.0277488643167776
Energy: 0.9986070974284555
Energy: 1.0277488643173387
Energy: 0.9834509301827375
Energy: 0.9669208201088234
Energy: 0.999130132242843
Energy: 0.966920820108013
Energy: 1.0830243126458896
Energy: 1.0540818292942535
Energy: 0.9731668460602181
Energy: 1.054081829293973

minimum gb energy = 0.9664334449687819 eV
minimum distance =  2.32448208977173 Angstroms
sigma value = 5


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

Energy: 0.9768990154367553
Energy: 0.9744223943526804
Energy: 1.1243341300565126
Energy: 0.9744223943473554
Energy: 1.0973379158077718
Energy: 1.0195618922880172
Energy: 0.9251128660624673
Energy: 1.0195618922902994
Energy: 0.9348300250752197
Energy: 0.9717615607951895
Energy: 1.1062441514930816
Energy: 0.9717615607921467
Energy: 0.9377803159272672
Energy: 1.011553126569659
Energy: 0.9535574348479766
Energy: 1.0115531265681375
Energy: 0.9440399805602653
Energy: 1.0198797333044054
Energy: 1.122303017557805
Energy: 1.0198797333013625
Energy: 0.9619063796640345
Energy: 0.9819858336879265
Energy: 0.9405590577192101
Energy: 0.9819858336947728
Energy: 0.948292583601252
Energy: 1.0243290540790413
Energy: 0.9401057139831215
Energy: 1.0243290540782803
Energy: 0.9450888199819006
Energy: 0.9837245402652408
Energy: 0.9368887124190827
Energy: 0.9837245402652408
Energy: 0.9617059419378071
Energy: 1.0145099694791824
Energy: 0.9490109625658321
Energy: 1.0145099694791824
Energy: 0.9581681567792909
Energy: 1.012638823839773
Energy: 0.9379454430352657
Energy: 1.0126388238405337
Energy: 0.9287253722377365
Energy: 0.9832906103370525
Energy: 0.9362639437085227
Energy: 0.9832906103362918
Energy: 0.935319131607727
Energy: 0.9830218906977586
Energy: 1.0757746978207297
Energy: 0.9830218906977586
Energy: 0.9738273931448909
Energy: 0.9801264554597349
Energy: 0.9792657180650842
Energy: 0.9801264554582482
Energy: 0.9429003473420636
Energy: 0.9807386621286928
Energy: 0.9790095705818906
Energy: 0.9807386621279321
Energy: 1.195188519532698
Energy: 1.0133484231016348
Energy: 0.9364510345413398
Energy: 1.013348423100113
Energy: 0.9561330272356153
Energy: 0.9638403601003536
Energy: 1.1037408967334228
Energy: 0.9638403600957893
Energy: 1.134769377973829
Energy: 1.020571913315623
Energy: 0.9252920490136383
Energy: 1.0205719133186657
Energy: 0.9495786795079785
Energy: 0.9805746323079614
Energy: 1.0272337149806245
Energy: 0.98057463230644
Energy: 0.9550344673579647
Energy: 1.0248007617449821
Energy: 0.9422948063793144
Energy: 1.0248007617434607
Energy: 0.9320871311106717
Energy: 1.0150630508628211
Energy: 0.9803548454202826
Energy: 1.0150630508643423
Energy: 0.9237725742630575
Energy: 0.9819965854659942
Energy: 0.9554132025599685
Energy: 0.9819965854682763
Energy: 0.9494016206190268
Energy: 1.0153879617239328
Energy: 0.9599566576749278
Energy: 1.0153879617224113
Energy: 0.9283563105147782
Energy: 0.9831840298630286
Energy: 0.9250428836684653
Energy: 0.9831840298622679
Energy: 1.073375174991533
Energy: 0.9783081559770744
Energy: 0.9322801696724563
Energy: 0.9783081559839207
Energy: 1.0692966359239673
Energy: 0.9621522409953469
Energy: 0.9259203430340088
Energy: 0.9621522409961077
Energy: 0.9674382196298076
Energy: 0.9810316423730969
Energy: 0.9429623436401966
Energy: 0.9810316423723362
Energy: 0.9307335096493068
Energy: 1.004759622597712
Energy: 1.0403601369872457
Energy: 1.0047596225961908
Energy: 0.9695480389613792
Energy: 1.000357419354339
Energy: 0.9548622580075437
Energy: 1.000357419354339
Energy: 0.9356380703356855
Energy: 1.018529468930986
Energy: 1.0259251241689866
Energy: 1.0185294689294648
Energy: 1.117511643555352
Energy: 0.979893903606159
Energy: 0.9483819983692399
Energy: 0.9798939036023554
Energy: 0.9335275670288278
Energy: 0.9674064958175672
Energy: 1.0312278542915665
Energy: 0.9674064958137636
Energy: 1.1230907130397996
Energy: 0.9977995812751305
Energy: 0.9345152400586505
Energy: 0.9977995812736089
Energy: 0.953533202227574
Energy: 0.9831029720030493
Energy: 0.9268409354009608
Energy: 0.9831029720045708

minimum gb energy = 0.9237725742630575 eV
minimum distance =  2.2828342774567 Angstroms
sigma value = 1


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

Energy: 0.9359390939687458
Energy: 0.9348009178290287
Energy: 1.079213363990423
Energy: 0.9348009178300806
Energy: 0.9265372688181249
Energy: 0.9480736554228715
Energy: 0.887110160036813
Energy: 0.9480736554239234
Energy: 0.8749142436593988
Energy: 0.9348480597477212
Energy: 1.2253815685536604
Energy: 0.9348480597508766
Energy: 0.9029797088494798
Energy: 0.9864375007124977
Energy: 0.8867900103994506
Energy: 0.9864375007114459
Energy: 0.8765114193418936
Energy: 1.0197612280191248
Energy: 1.0836448054747652
Energy: 1.0197612280191248
Energy: 0.8750825613202105
Energy: 0.9384758722775456
Energy: 0.8867921102011809
Energy: 0.9384758722775456
Energy: 0.8766596543915246
Energy: 1.019407096048793
Energy: 0.9030433288365128
Energy: 1.019407096048793
Energy: 0.8762015545435945
Energy: 0.9382003229451337
Energy: 0.9240886324919947
Energy: 0.9382003229440818
Energy: 0.9341958021264742
Energy: 0.9277704485248
Energy: 0.9477596842453591
Energy: 0.9277704485248
Energy: 0.9343137920997711
Energy: 0.92778885203537
Energy: 0.9241780985158367
Energy: 0.9277888520343182
Energy: 0.8769387560834937
Energy: 0.938179494655198
Energy: 0.9490235946486965
Energy: 0.938179494655198
Energy: 0.8760122669962775
Energy: 1.019313186946907
Energy: 0.9101091969118125
Energy: 1.0193131869458552
Energy: 0.8758675229026601
Energy: 0.9385670480243826
Energy: 0.8867682031141951
Energy: 0.9385670480212274
Energy: 0.8765269893341094
Energy: 1.0197597751984653
Energy: 0.9353045570599295
Energy: 1.0197597751995173
Energy: 0.9029829563876836
Energy: 0.9864093961447418
Energy: 0.886760371919049
Energy: 0.9864093961447418
Energy: 0.8749173267427781
Energy: 0.9348398607675135
Energy: 0.9676293884896333
Energy: 0.9348398607664615
Energy: 0.9267031468777679
Energy: 0.9480714463648439
Energy: 0.8870554945629798
Energy: 0.9480714463669476
Energy: 0.9359390939687458
Energy: 0.9348009178290287
Energy: 1.0924277000196774
Energy: 0.9348009178311325
Energy: 0.9265372688191768
Energy: 0.9480736554218196
Energy: 0.887110160036813
Energy: 0.9480736554249752
Energy: 0.8749142436604507
Energy: 0.9348480597477212
Energy: 1.2253815685536604
Energy: 0.9348480597508766
Energy: 0.9029797088505315
Energy: 0.9864375007124977
Energy: 0.8867900103994506
Energy: 0.9864375007114459
Energy: 0.8765114193429453
Energy: 1.0197612280201764
Energy: 1.0836448054810761
Energy: 1.0197612280191248
Energy: 0.8750825613212623
Energy: 0.9384758722775456
Energy: 0.8867921102011809
Energy: 0.9384758722775456
Energy: 0.8766596543915246
Energy: 1.019407096048793
Energy: 0.903043328835461
Energy: 1.019407096048793

minimum gb energy = 0.8749142436593988 eV
minimum distance =  2.30079561417196 Angstroms
sigma value = 17


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

Energy: 0.9232899734902273
Energy: 0.9216528667126012
Energy: 1.0704183702243684
Energy: 0.9216528667139012
Energy: 1.0424312713590678
Energy: 0.9077924597972234
Energy: 0.8886844302666688
Energy: 0.9077924597972234
Energy: 0.8846349503074001
Energy: 0.9109451971605856
Energy: 1.107970178444713
Energy: 0.9109451971618857
Energy: 0.9210490912736264
Energy: 0.8823220289697419
Energy: 0.8797332239385757
Energy: 0.8823220289671416
Energy: 0.8777354557706436
Energy: 0.9771045857236876
Energy: 0.9044184345352173
Energy: 0.9771045857236876
Energy: 0.8743060241750911
Energy: 0.891963936985041
Energy: 0.8965431125056275
Energy: 0.8919639370682537
Energy: 0.8899160016575419
Energy: 0.9615888051306999
Energy: 0.9137078879533297
Energy: 0.9615888051333004
Energy: 0.8754997394152325
Energy: 0.9512800846775354
Energy: 0.8796781760860398
Energy: 0.9512800846762353
Energy: 0.9249270295941672
Energy: 1.073338356943266
Energy: 0.9165124049574674
Energy: 1.0733383569419659
Energy: 0.9219795176526124
Energy: 0.9475702549422046
Energy: 0.8875514297949426
Energy: 0.9475702549441548
Energy: 0.8847572237840767
Energy: 0.9261257621233406
Energy: 0.8845766387333435
Energy: 0.9261257621239908
Energy: 0.8880334673117052
Energy: 0.9530623917725554
Energy: 0.878799458365113
Energy: 0.9530623917732055
Energy: 0.8726114934347662
Energy: 0.9399014249693194
Energy: 0.8877285184536845
Energy: 0.9399014249654188
Energy: 0.8843661561246287
Energy: 0.9758614463457554
Energy: 0.9407123257923466
Energy: 0.9758614463444552
Energy: 0.8733435139603482
Energy: 0.8857492732572275
Energy: 0.9296897456876735
Energy: 0.8857492732819314
Energy: 0.8845431053903969
Energy: 0.9123825574559928
Energy: 0.8973166730744092
Energy: 0.9123825574572931
Energy: 0.9025980492381519
Energy: 0.885543014293736
Energy: 0.8875769950390723
Energy: 0.8855430143028374
Energy: 0.8805225325620377
Energy: 0.9223920825968208
Energy: 0.8900516788359724
Energy: 0.9223920825948705
Energy: 1.0287608914280213
Energy: 0.955415018336744
Energy: 0.8864149511891227
Energy: 0.9554150183386942
Energy: 0.8934995371074408
Energy: 0.9107803825011614
Energy: 0.9313564750173144
Energy: 0.9107803825018116
Energy: 0.8846576024828035
Energy: 0.9001598054808752
Energy: 0.8829139108915273
Energy: 0.9001598054620222
Energy: 0.8811609295324487
Energy: 0.9236002279453691
Energy: 1.0373393824117716
Energy: 0.9236002279466692
Energy: 0.9080232321025469
Energy: 0.8897955398093332
Energy: 0.8947725454107968
Energy: 0.8897955398073829
Energy: 0.884964654780241
Energy: 0.9632764397545177
Energy: 1.0436028589408624
Energy: 0.9632764397545177
Energy: 0.9072516646706732
Energy: 0.9228229175877954
Energy: 0.881835097084199
Energy: 0.9228229175871453
Energy: 0.879917254474228
Energy: 0.9779494077222408
Energy: 0.9018179060376927
Energy: 0.977949407722891
Energy: 1.0349557806783667
Energy: 0.9393929071354014
Energy: 0.8855353977268273
Energy: 0.9393929071360515
Energy: 0.9333286285837067
Energy: 1.0564826677009682
Energy: 0.8731265697891353
Energy: 1.0564826676951173
Energy: 0.9366786804458155
Energy: 0.9757369398656186
Energy: 0.8788646832943944
Energy: 0.9757369398669189
Energy: 0.87974160579687
Energy: 0.9389608087858592
Energy: 0.9241558612572156
Energy: 0.9389608087858592
Energy: 0.887813735194263
Energy: 0.9756763303531584
Energy: 0.8911292040943397
Energy: 0.9756763303531584
Energy: 0.8729637050887109
Energy: 1.053475649803762
Energy: 0.8817383429976343
Energy: 1.053475649803762
Energy: 0.8858908016306475
Energy: 0.947318234537806
Energy: 1.0613858808051109
Energy: 0.9473182345397563
Energy: 0.9244426376733322
Energy: 1.0724231856236859
Energy: 0.8947169353351926
Energy: 1.0724231856223858
Energy: 0.8816776821967289
Energy: 0.9235626755530167
Energy: 0.9130091489615577
Energy: 0.9235626755523666
Energy: 0.9434307382104523
Energy: 0.9629013573252992
Energy: 0.8881204203181949
Energy: 0.9629013573252992
Energy: 0.8948151775106442
Energy: 0.8917654252553088
Energy: 0.8767366898741085
Energy: 0.89176542526376
Energy: 0.8983218776470059
Energy: 0.9785103550549162
Energy: 0.8812574412781193
Energy: 0.9785103550562164

minimum gb energy = 0.8726114934347662 eV
minimum distance =  2.28912113600462 Angstroms
sigma value = 89


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

Energy: 1.011092822224684
Energy: 0.8367358091810602
Energy: 0.8414571455985128
Energy: 0.8367358092235464
Energy: 0.9840182744321613
Energy: 0.8370120016684441
Energy: 0.83263070845103
Energy: 0.8370120016701451
Energy: 0.8432259721764699
Energy: 0.9570300637436003
Energy: 1.1831011437232057
Energy: 0.9570300637436003
Energy: 0.8562506188590078
Energy: 0.8716806058050007
Energy: 0.8434798838259799
Energy: 0.8716806058050007
Energy: 0.82231161150366
Energy: 0.8915512733216511
Energy: 0.8543584897107829
Energy: 0.8915512733233522
Energy: 0.8140025213694245
Energy: 0.8137703053800694
Energy: 0.8168564913336555
Energy: 0.8137703053800694
Energy: 0.8330501308129349
Energy: 0.957206391756535
Energy: 0.8131694405633438
Energy: 0.957206391754834
Energy: 0.823478774869118
Energy: 0.9564266673753499
Energy: 0.8433193025094672
Energy: 0.9564266673770507
Energy: 0.84111062364234
Energy: 0.8916095392071147
Energy: 0.8757080467883287
Energy: 0.8916095392071147
Energy: 0.8717246717409424
Energy: 1.0243235282814105
Energy: 0.8142467470075069
Energy: 1.0243235282848124
Energy: 1.0118818091241089
Energy: 0.8407091444700204
Energy: 0.8215711179086665
Energy: 0.8407091444700204
Energy: 1.0109813065484803
Energy: 0.9587398885839803
Energy: 0.8314202394913262
Energy: 0.9587398885839803
Energy: 0.8438255576979755
Energy: 0.8152502992420764
Energy: 0.8077116715453374
Energy: 0.8152502992420764
Energy: 0.8368457397596936
Energy: 0.8897611032825906
Energy: 0.8390295532510142
Energy: 0.8897611032825906
Energy: 0.8189816726355121
Energy: 0.8152077686750182
Energy: 0.838995577629025
Energy: 0.8152077686767192

minimum gb energy = 0.8077116715453374 eV
minimum distance =  2.31228570787244 Angstroms
sigma value = 13


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

Energy: 0.8048954768432701
Energy: 0.7733288883540005
Energy: 0.9881518139738316
Energy: 0.7733288883575652
Energy: 0.9472944797481544
Energy: 0.7926112643103409
Energy: 0.7680359214637705
Energy: 0.7926112643181834
Energy: 0.7748052059513502
Energy: 0.7736422158734727
Energy: 1.145416195585274
Energy: 0.7736422158776856
Energy: 0.7786880122072833
Energy: 0.7926109527978568
Energy: 0.7638346056517049
Energy: 0.7926109527971439
Energy: 0.7835355333658098
Energy: 0.8328573220724398
Energy: 0.7791177244691676
Energy: 0.8328573220745786
Energy: 0.7754433211569394
Energy: 0.7935743711059144
Energy: 0.7858319777109888
Energy: 0.7935743711044887
Energy: 0.7832885545068881
Energy: 0.8337771612020006
Energy: 0.8029881282708425
Energy: 0.8337771612055654
Energy: 0.7684805968523305
Energy: 0.7928573519606318
Energy: 0.785864860589796
Energy: 0.7928573519570671
Energy: 0.7835720553212604
Energy: 0.8338251054257575
Energy: 0.9194424158686954
Energy: 0.8338251054165541
Energy: 0.9314880486243796
Energy: 0.8497496041183722
Energy: 0.7641657106206796
Energy: 0.8497496041126685
Energy: 0.783595864764318
Energy: 0.8511358122864481
Energy: 0.7670455930625343
Energy: 0.8511358122914388
Energy: 1.0415918297257813
Energy: 0.8499900671440536
Energy: 0.7632297816997778
Energy: 0.8499900671426278
Energy: 0.8133121667137673
Energy: 0.7884876963498145
Energy: 0.7684985054445098
Energy: 0.7884876963526662
Energy: 1.0818434807395976
Energy: 0.8502917907481927
Energy: 0.7634677035243239
Energy: 0.8502917907474797
Energy: 0.7794128151585987
Energy: 0.7736343590502353
Energy: 0.7684332180170893
Energy: 0.7736343590595036
Energy: 0.7955086485167534
Energy: 0.8508423810178455
Energy: 0.7671592417631715
Energy: 0.8508423810221232
Energy: 0.7867414925693413
Energy: 0.8288623240151128
Energy: 0.7677403023159745
Energy: 0.8288623240158257
Energy: 0.7807184392380088
Energy: 0.8314495370668348
Energy: 0.7941379810510542
Energy: 0.8314495370711126
Energy: 0.7867502990079734
Energy: 0.788893000274862
Energy: 0.7946241272584952
Energy: 0.788893000274149
Energy: 0.7866956325249473
Energy: 0.788854350681405
Energy: 0.794020498631983
Energy: 0.7888543506806922
Energy: 0.7808984158870612
Energy: 0.8312526769746602
Energy: 0.7937463818629243
Energy: 0.8312526769825027
Energy: 0.7870344845365693
Energy: 0.8288463731461707
Energy: 0.767767871112784
Energy: 0.8288463731440318
Energy: 0.7949291446548858
Energy: 0.8505056299725369
Energy: 0.7673895700736317
Energy: 0.8505056299732499
Energy: 0.7813237487819898
Energy: 0.7738043171527624
Energy: 0.768993190311034
Energy: 0.7738043171520496
Energy: 1.0819753517032604
Energy: 0.8502905391204512
Energy: 0.7634645849174292
Energy: 0.850290539124016
Energy: 0.8131678476921217
Energy: 0.7884061647389133
Energy: 0.7670696155313436
Energy: 0.7884061647367745
Energy: 1.0418387012348875
Energy: 0.849785624932112
Energy: 0.7632786404075543
Energy: 0.8497856249349639
Energy: 0.7834669066528617
Energy: 0.8511230588211105
Energy: 0.7665397933909499
Energy: 0.8511230588239624
Energy: 0.9313966930417263
Energy: 0.8498578243077217
Energy: 0.7641686721921359
Energy: 0.8498578243070088
Energy: 0.78339368581117
Energy: 0.8338754006999323
Energy: 0.9254818400729636
Energy: 0.8338754006970804
Energy: 0.7640505311240718
Energy: 0.7927955788454968
Energy: 0.785888237685409
Energy: 0.7927955788419321
Energy: 0.7833884339906029
Energy: 0.8339894366959252
Energy: 1.0414483618120578
Energy: 0.8339894366924252
Energy: 0.7755960385926156
Energy: 0.793231204384607
Energy: 0.7857890684167504
Energy: 0.7932312043881719
Energy: 0.7835299183104293
Energy: 0.8329180807687547
Energy: 1.0493194974719298
Energy: 0.8329180807680416
Energy: 0.7788852015202199
Energy: 0.7927899542322947
Energy: 0.7639729032352949
Energy: 0.7927899542337205

minimum gb energy = 0.7632297816997778 eV
minimum distance =  2.32591053434212 Angstroms
sigma value = 37


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

Energy: 0.8734015566359361
Energy: 0.7588678136985019
Energy: 0.9278925095779699
Energy: 0.7588678136985019
Energy: 0.8515294045087738
Energy: 0.7357760904043209
Energy: 0.7066282167066983
Energy: 0.7357760904055476
Energy: 0.7301078892505012
Energy: 0.8317036004784077
Energy: 1.000206747395642
Energy: 0.8317036004771811
Energy: 0.820458267893625
Energy: 0.7359938703017304
Energy: 0.7142425864640074
Energy: 0.7359938703005038
Energy: 0.711859522982691
Energy: 0.7355754574740805
Energy: 0.7348625513590042
Energy: 0.7355754574753071
Energy: 0.7095033548148764
Energy: 0.7356060726683312
Energy: 0.8318648739444178
Energy: 0.7356060726707845
Energy: 0.7222572287993376
Energy: 0.779809409196028
Energy: 1.064636881874863
Energy: 0.7798094091972546
Energy: 0.6953754158795152
Energy: 0.7365126745302291
Energy: 0.7392462106726108
Energy: 0.7365126745302291
Energy: 0.7070299330324545
Energy: 0.7367926731318429
Energy: 0.9456608567741952
Energy: 0.7367926731330695
Energy: 1.0013999792476325
Energy: 0.820256443228067
Energy: 0.831855093889421
Energy: 0.8202564432292936
Energy: 0.7255770442323586
Energy: 0.7979540549984651
Energy: 0.8230818716979521
Energy: 0.7979540549984651
Energy: 1.003569820725019
Energy: 0.7359866048217617
Energy: 0.7142906434027846
Energy: 0.7359866048205351
Energy: 0.8340522045852983
Energy: 0.7356444807003558
Energy: 0.7007845942738213
Energy: 0.7356444807003558
Energy: 1.0651362685697734
Energy: 0.7712685641416338
Energy: 0.7010617671735723
Energy: 0.7712685641416338
Energy: 0.8728144009593262
Energy: 0.7717041057440815
Energy: 0.6972634285829733
Energy: 0.7717041057453081
Energy: 0.8731582315161036
Energy: 0.7361538551097295
Energy: 0.7063875271117622
Energy: 0.7361538551109562
Energy: 0.8341720429550777
Energy: 0.8212463877472387
Energy: 0.6974686769515273
Energy: 0.8212463877484653
Energy: 0.8208704551901812
Energy: 0.8814192061379498
Energy: 0.711541647127559
Energy: 0.8814192061354965
Energy: 0.7118086248371763
Energy: 0.7374651540705155
Energy: 0.7083780668176274
Energy: 0.7374651540705155
Energy: 0.7082136871459528
Energy: 0.7363964095105454
Energy: 0.831314371231459
Energy: 0.7363964095105454

minimum gb energy = 0.6953754158795152 eV
minimum distance =  2.33250898240089 Angstroms
sigma value = 25


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

Energy: 0.7804321276918803
Energy: 0.6513032587876517
Energy: 0.871271512984966
Energy: 0.651303258791483
Energy: 0.9152195123085155
Energy: 0.6543717267642559
Energy: 0.6415668934926314
Energy: 0.6543717267575512
Energy: 0.7391351082351139
Energy: 0.6482826609092417
Energy: 0.8605021159268615
Energy: 0.6482826609092417
Energy: 0.7394480845731938
Energy: 0.6684783144060523
Energy: 0.6430816309045008
Energy: 0.668478314352458
Energy: 0.6518116592855404
Energy: 0.6547319346742202
Energy: 0.640101616250662
Energy: 0.6547319346742202
Energy: 0.7150625512867669
Energy: 0.648658543293789
Energy: 0.6517585414169634
Energy: 0.648658543293789
Energy: 0.6414379712072302
Energy: 0.6361908750456271
Energy: 0.7399986977403991
Energy: 0.6361908750475427
Energy: 0.6218175570823351
Energy: 0.6764813235572109
Energy: 0.7401186402095344
Energy: 0.6764813235572109
Energy: 0.6409387640562086
Energy: 0.659466267641064
Energy: 0.9360750294721215
Energy: 0.659466267641064
Energy: 0.6152619117576212
Energy: 0.6420339742080405
Energy: 0.6781889899614572
Energy: 0.6420339742109142
Energy: 0.6416642733710691
Energy: 0.6361716298613087
Energy: 1.0162105884193384
Energy: 0.6361716298622664
Energy: 0.866077161417522
Energy: 0.7478418392524008
Energy: 0.7400649302079374
Energy: 0.7478418392533585
Energy: 0.6444280617673029
Energy: 0.6688277590533165
Energy: 0.9150772917509599
Energy: 0.6688277590552321
Energy: 0.864636735180698
Energy: 0.7027826655061603
Energy: 0.65130085824812
Energy: 0.7027826655061603
Energy: 0.6541393680961224
Energy: 0.636359197166748
Energy: 0.7255566959881932
Energy: 0.636359197166748
Energy: 0.9449821507032713
Energy: 0.7457723846528737
Energy: 0.6445095017987544
Energy: 0.7457723846528737
Energy: 0.7433113814439581
Energy: 0.6767789270171882
Energy: 0.7124047150168349
Energy: 0.6767789270162304
Energy: 0.9463531656381361
Energy: 0.6545470160993511
Energy: 0.6421525596857316
Energy: 0.6545470161012231
Energy: 0.7845824356527563
Energy: 0.6482156119875063
Energy: 0.6259359362444928
Energy: 0.6482156119846763
Energy: 1.0929031199050507
Energy: 0.7461606850114024
Energy: 0.6447490976075657
Energy: 0.7461606850123602
Energy: 0.7432361774597461
Energy: 0.7427468951680991
Energy: 0.6168935394992461
Energy: 0.7427468951661834
Energy: 0.7397161737844448
Energy: 0.6686576266137891
Energy: 0.6470747044659327
Energy: 0.6686576266118734
Energy: 0.6539926424687184
Energy: 0.702942493864577
Energy: 0.8642363942664368
Energy: 0.7029424938674504
Energy: 0.7198591029044286
Energy: 0.7462089804769388
Energy: 0.6502526994712107
Energy: 0.74620898048077
Energy: 0.6396829059457179
Energy: 0.7446214597773507
Energy: 0.9556388853704387
Energy: 0.7446214597773507
Energy: 0.6221763942183998
Energy: 0.6773740827883236
Energy: 0.7447653173130754
Energy: 0.6773740827892814

minimum gb energy = 0.6152619117576212 eV
minimum distance =  2.33755770641455 Angstroms
sigma value = 41


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

Energy: 0.8973508034905919
Energy: 0.5926647142134965
Energy: 0.8272522218551459
Energy: 0.5926647142127113
Energy: 0.90413133144719
Energy: 0.5790992163428738
Energy: 0.5714294117673423
Energy: 0.579099216343659
Energy: 0.591356920766125
Energy: 0.5690703934952936
Energy: 0.5557636500918295
Energy: 0.5690703934968642
Energy: 0.742012284225875
Energy: 0.5795494416353917
Energy: 0.5713853254432605
Energy: 0.5795494416353917
Energy: 0.567765860219622
Energy: 0.6084332568149912
Energy: 0.5742152753911387
Energy: 0.6084332568149912
Energy: 0.5777408372970873
Energy: 0.5797876671535414
Energy: 0.571361396123251
Energy: 0.5797876671707811
Energy: 0.570689196660798
Energy: 0.5793886571471588
Energy: 0.5773123505971142
Energy: 0.5793886571471588
Energy: 0.5567655316624609
Energy: 0.5919974386814653
Energy: 0.5687522935101836
Energy: 0.5919974386830358
Energy: 0.5735787384514132
Energy: 0.5925737204764702
Energy: 0.7414997414472763
Energy: 0.5925737204772554
Energy: 0.5551021931224399
Energy: 0.5694428584226798
Energy: 0.5922339273017533
Energy: 0.5694428584242504
Energy: 0.5707215070904952
Energy: 0.579201412834125
Energy: 1.0286879485036826
Energy: 0.5792014128356956
Energy: 0.5567279811326682
Energy: 0.592914232547611
Energy: 0.8975504588943656
Energy: 0.592914232548396
Energy: 0.573471106952129
Energy: 0.5947614890165235
Energy: 1.0271597425154184
Energy: 0.5947614890180939
Energy: 0.768913649974183
Energy: 0.6488535983559378
Energy: 0.5924426374233118
Energy: 0.6488535983551525
Energy: 0.570694420943433
Energy: 0.5792265356268808
Energy: 0.8932028281991353
Energy: 0.579226535627666
Energy: 0.7716965508456372
Energy: 0.5936350113675124
Energy: 0.5686421694657574
Energy: 0.5936350113682975
Energy: 0.5734744694803401
Energy: 0.5927122604945764
Energy: 0.7306154663197767
Energy: 0.5927122604937912
Energy: 0.7567763840550124
Energy: 0.6490654602489352
Energy: 0.5713210022635004
Energy: 0.6490654602481499
Energy: 0.5708021274515133
Energy: 0.5918574554577856
Energy: 0.5566946349618755
Energy: 0.5918574554562152
Energy: 0.759023912708359
Energy: 0.5934105888897336
Energy: 0.5763701041512911
Energy: 0.5934105888944452
Energy: 0.5945069847585055
Energy: 0.5929137810098815
Energy: 0.5694321661429188
Energy: 0.5929137810090961
Energy: 1.0260358652686994
Energy: 0.661729522255833
Energy: 0.5715102746298467
Energy: 0.661729522255833
Energy: 0.8982750291560506
Energy: 0.5918362407399368
Energy: 0.5568554498762011
Energy: 0.5918362407391514
Energy: 0.9104157600071658
Energy: 0.593019729454304
Energy: 0.5766752012930333
Energy: 0.5930197294613713
Energy: 0.5945234315766144
Energy: 0.6501328868864138
Energy: 0.5552046680584354
Energy: 0.6501328868879843
Energy: 0.8926508157408268
Energy: 0.607231835084522
Energy: 0.571520437375473
Energy: 0.6072318350758843
Energy: 0.5707174416112462
Energy: 0.5921547404896008
Energy: 0.7695813008846422
Energy: 0.5921547404880304
Energy: 0.572505452933023
Energy: 0.5920312887966136
Energy: 0.5766874338333021
Energy: 0.592031288798184
Energy: 0.5735306373302888
Energy: 0.6503390831816376
Energy: 0.7617020653124646
Energy: 0.6503390831816376
Energy: 0.565354269534827
Energy: 0.626781577530103
Energy: 0.5739363804367448
Energy: 0.6267815775316735
Energy: 0.5755207164102883
Energy: 0.5922335689331598
Energy: 0.7663223218751961
Energy: 0.5922335689331598
Energy: 0.5564600302304195
Energy: 0.5923412909933559
Energy: 0.5978661701295966
Energy: 0.5923412909933559

minimum gb energy = 0.5551021931224399 eV
minimum distance =  2.32997149089311 Angstroms
sigma value = 15


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

Energy: 0.8091008071053655
Energy: 0.5359805531919911
Energy: 0.7908741907756613
Energy: 0.5359805531973129
Energy: 0.9262886506982042
Energy: 0.5331466958554423
Energy: 0.5346755452224361
Energy: 0.5331466958614292
Energy: 0.5540467606161693
Energy: 0.5331260078086745
Energy: 1.048001899314501
Energy: 0.5331260078093397
Energy: 0.8101911520900612
Energy: 0.5344110090684049
Energy: 0.5346054037979235
Energy: 0.5344110090704005
Energy: 0.5323673586678438
Energy: 0.5372556985936825
Energy: 0.7992541860752198
Energy: 0.5372556985923521
Energy: 0.8060944803572223
Energy: 0.5337566186051084
Energy: 0.5346536228059648
Energy: 0.5337566186044431
Energy: 0.5342266520940515
Energy: 0.5450554611774825
Energy: 0.5288109350440229
Energy: 0.5450554611688951
Energy: 0.6662819798781636
Energy: 0.5434492796838916
Energy: 0.5346700088047904
Energy: 0.5434492796852219
Energy: 0.5360540470644619
Energy: 0.5451937457293793
Energy: 0.668729205803929
Energy: 0.5451937457300445
Energy: 0.5264856291064502
Energy: 0.5333252300597479
Energy: 0.5329142548117837
Energy: 0.5333252300564217
Energy: 0.5341542164192333
Energy: 0.5335556449565491
Energy: 0.8101178014093636
Energy: 0.5335556449538882
Energy: 0.5102062157139341
Energy: 0.5333370996299054
Energy: 0.5543613157605235
Energy: 0.533337099625914
Energy: 0.5361011875600223
Energy: 0.545193042935302
Energy: 1.033681559256261
Energy: 0.5451930429299803
Energy: 0.5283193295497589
Energy: 0.5363063899437616
Energy: 0.8094816613109136
Energy: 0.5363063899437616
Energy: 0.5342637698744332
Energy: 0.5336730055805788
Energy: 1.0364767023459955
Energy: 0.5336730055819093
Energy: 0.6951616127046252
Energy: 0.5334586705075156
Energy: 0.5547221381633158
Energy: 0.533458670499533
Energy: 0.5361066644568772
Energy: 0.5438761718042099
Energy: 0.9762131294411291
Energy: 0.5438761718042099
Energy: 0.6997484317292307
Energy: 0.5813261183002048
Energy: 0.5329043515172419
Energy: 0.5813261183413878
Energy: 0.5342862987252673
Energy: 0.532919454787562
Energy: 0.8029877710946334
Energy: 0.5329194547795794
Energy: 0.6896696795877442
Energy: 0.5338598096989602
Energy: 0.5346587305771818
Energy: 0.5338598097022863
Energy: 0.5360587357427947
Energy: 0.5544868391671078
Energy: 0.732273575394536
Energy: 0.5544868391644469
Energy: 0.6977846303041991
Energy: 0.5440185943415038
Energy: 0.5381306980801625
Energy: 0.5440185943441647
Energy: 0.5343009010251571
Energy: 0.5329303955493463
Energy: 0.5235013262892922
Energy: 0.532930395548681
Energy: 0.9540044268087281
Energy: 0.5343566343978875
Energy: 0.5347553084058951
Energy: 0.5343566343998831
Energy: 0.5559057224678123
Energy: 0.5540579817904739
Energy: 0.525191153780494
Energy: 0.5540579817991219
Energy: 0.9316771087016416
Energy: 0.5432393091990003
Energy: 0.5378644487479031
Energy: 0.5432393092016613
Energy: 0.8105110159810617
Energy: 0.5332080946048808
Energy: 0.5243218931809344
Energy: 0.5332080946042156
Energy: 1.034004965388764
Energy: 0.5349542776426729
Energy: 0.5348020856857033
Energy: 0.5349542776433382
Energy: 0.5557698202170804
Energy: 0.6026971815548101
Energy: 0.5245965063399375
Energy: 0.6026971814989921
Energy: 0.8148417593757242
Energy: 0.5437580079151396
Energy: 0.5382685258505822
Energy: 0.5437580079118135
Energy: 0.5341712321294801
Energy: 0.5809106305645246
Energy: 0.6968023820687117
Energy: 0.580910630565855
Energy: 0.8031766187936271
Energy: 0.5325923437378769
Energy: 0.5346975503823296
Energy: 0.5325923437405377
Energy: 0.5360745162541092
Energy: 0.6074735127088154
Energy: 0.6848497080243092
Energy: 0.6074735127054893
Energy: 0.5314723220590154
Energy: 0.553966625212584
Energy: 0.5380513276405375
Energy: 0.5539666252178453
Energy: 0.5296626522947909
Energy: 0.5809867731952466
Energy: 0.6962025836549315
Energy: 0.5809867731679725
Energy: 0.524939406787144
Energy: 0.5326427648355064
Energy: 0.5366139662534304
Energy: 0.5326427648388325
Energy: 0.5359316623441285
Energy: 0.6085881073767901
Energy: 0.9511531229537765
Energy: 0.6085881073807814

minimum gb energy = 0.5102062157139341 eV
minimum distance =  2.32896156054547 Angstroms
sigma value = 85


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

Energy: 0.7569370509477196
Energy: 0.5205185936377066
Energy: 0.735978698424615
Energy: 0.5205185936365527
Energy: 0.9418699552638025
Energy: 0.5174081558602469
Energy: 0.48948719201624424
Energy: 0.517408155859093
Energy: 0.727208165403575
Energy: 0.5171581218100714
Energy: 0.4564258775826297
Energy: 0.5171581218106482
Energy: 0.9160550956397484
Energy: 0.5172794810187717
Energy: 0.48926410146697663
Energy: 0.5172794810193487
Energy: 0.5164264407599212
Energy: 0.4879316434428531
Energy: 0.4567160997125589
Energy: 0.4879316434428531
Energy: 0.8102199236948958
Energy: 0.517735801646447
Energy: 0.4893980883929918
Energy: 0.5177358016452931
Energy: 0.48698941117584504
Energy: 0.534613797521614
Energy: 0.4892395920540539
Energy: 0.534613797521037
Energy: 0.7039039184598931
Energy: 0.5166559812871898
Energy: 0.4894431191748025
Energy: 0.5166559812877667
Energy: 0.48890897482399376
Energy: 0.5020301809041634
Energy: 0.6120849751262143
Energy: 0.5020301809041634
Energy: 0.5799954071982169
Energy: 0.5341581624537437
Energy: 0.487536929442326
Energy: 0.5341581624531667
Energy: 0.4907497073440408
Energy: 0.5173261864697714
Energy: 0.7358334280423336
Energy: 0.5173261864715022
Energy: 0.4560573973507026
Energy: 0.5166830494918784
Energy: 0.5169449445429463
Energy: 0.5166830494930322
Energy: 0.488961670372156
Energy: 0.500952243914675
Energy: 0.8383896557588546
Energy: 0.5009522439158289
Energy: 0.4569468457583878
Energy: 0.5173146165596427
Energy: 0.7275593374578502
Energy: 0.5173146165596427
Energy: 0.49098347308513945
Energy: 0.5172542200669501
Energy: 1.019252229803715
Energy: 0.5172542200698348
Energy: 0.456080615472972
Energy: 0.5205075579693258
Energy: 0.7573194818000143
Energy: 0.5205075579699029
Energy: 0.48904434166702004
Energy: 0.5010442707757204
Energy: 1.0192778786295429
Energy: 0.5010442707757204
Energy: 0.610072085562357
Energy: 0.5173355424333124
Energy: 0.7275240843428807
Energy: 0.5173355424333124
Energy: 0.49036660511624947
Energy: 0.5173581220013208
Energy: 0.915694396854396
Energy: 0.5173581220007439
Energy: 0.6079821415329542
Energy: 0.5205717327492402
Energy: 0.5168443350702038
Energy: 0.5205717327492402
Energy: 0.48904882695543733
Energy: 0.5010780708192453
Energy: 0.8101791691427694
Energy: 0.5010780708186683
Energy: 0.6034048335104258
Energy: 0.5174452276771618
Energy: 0.487521815286535
Energy: 0.5174452276771618
Energy: 0.4908571072001673
Energy: 0.5164967307617405
Energy: 0.7036364703139599
Energy: 0.5164967307611636
Energy: 0.615062921821819
Energy: 0.5362552724957422
Energy: 0.4893767628693182
Energy: 0.5362552724945884
Energy: 0.4888864480549482
Energy: 0.516513304994667
Energy: 0.579656220661736
Energy: 0.5165133049952438
Energy: 0.844054601306353
Energy: 0.517344659215242
Energy: 0.491258500276286
Energy: 0.517344659215242
Energy: 0.5186510843053472
Energy: 0.516440839222041
Energy: 0.4560918287744338
Energy: 0.5164408392237719
Energy: 0.854133900549318
Energy: 0.5362167946550178
Energy: 0.48937559760318305
Energy: 0.5362167946532869
Energy: 0.728675185128231
Energy: 0.5178480006426244
Energy: 0.455200829164758
Energy: 0.5178480006414705
Energy: 1.0192508708263603
Energy: 0.5173181191035877
Energy: 0.49126737729357267
Energy: 0.5173181192218095
Energy: 0.7586529965725203
Energy: 0.5164449125134616
Energy: 0.4562163444343832
Energy: 0.5164449125140386
Energy: 0.9343294617687626
Energy: 0.5339858897794401
Energy: 0.48949135277559047
Energy: 0.5339858897823248
Energy: 0.7286458907453255
Energy: 0.5178770196922794
Energy: 0.45740172345219016
Energy: 0.5178770196905486
Energy: 0.9155119930919575
Energy: 0.517305540682456
Energy: 0.4912014474473248
Energy: 0.517305540682456
Energy: 0.5183643303059356
Energy: 0.5163669965323741
Energy: 0.607920922324207
Energy: 0.5163669965294893
Energy: 0.7179285571183244
Energy: 0.534000387412316
Energy: 0.48950543275528585
Energy: 0.534000387411739
Energy: 0.48899824526675645
Energy: 0.5177597833289209
Energy: 0.6037200413580563
Energy: 0.5177597833271901
Energy: 0.7034980652633308
Energy: 0.5163651373778552
Energy: 0.4913445759812709
Energy: 0.5163651373778552
Energy: 0.4907033460861111
Energy: 0.516398143823633
Energy: 0.6133302194614423
Energy: 0.5163981438259407
Energy: 0.466462791769117
Energy: 0.5521622575841838
Energy: 0.4908501299878136
Energy: 0.5521622575824531
Energy: 0.49167809686891367
Energy: 0.5175404868324655
Energy: 0.8439539356575113
Energy: 0.5175404868295806
Energy: 0.4561138874972333
Energy: 0.5163256557457423
Energy: 0.5205958342802711
Energy: 0.5163256557457423
Energy: 0.4907291184940284
Energy: 0.5165491641754031
Energy: 0.8543921108467495
Energy: 0.5165491641754031

minimum gb energy = 0.455200829164758 eV
minimum distance =  2.34287890043958 Angstroms
sigma value = 113


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

Energy: 0.01548803034868663
Energy: 0.016378582395091837
Energy: 1.510684028423504
Energy: 0.016378582394672946
Energy: 0.6443558757495236
Energy: 0.2515187368512175
Energy: 0.2515170311690957
Energy: 0.25151873685035514
Energy: 0.01548803034868663
Energy: 0.016378582395535364
Energy: 0.6448621659350827
Energy: 0.016378582394672946
Energy: 0.6443558757495236
Energy: 0.25151873685166104
Energy: 0.2515170310967022
Energy: 0.2515187368507987
Energy: 0.01548803034868663
Energy: 0.016378582395091837
Energy: 0.6448621659350827
Energy: 0.016378582394672946
Energy: 0.6443558757495236
Energy: 0.25151873685166104
Energy: 0.25151703073042253
Energy: 0.2515187368507987

minimum gb energy = 0.01548803034868663 eV
minimum distance =  2.54309297135637 Angstroms
sigma value = 1