Model name: model_name=EAM_Dynamo_MishinFarkasMehl_1999_Ni__MO_400591584784_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5199994325637833
cohesive_energy=4.4503499761477565
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[6.53213822388336e-20, 1.42254058979592e-19, 2.41100346414222e-19, 3.3853671841093195e-19, 4.1388868768458594e-19, 4.67882040250386e-19, 5.07933251747118e-19, 5.40064904141988e-19, 5.66620981850538e-19, 5.88830354351046e-19, 6.075726166155779e-19, 6.2375940714888e-19, 6.38198222974488e-19, 6.51454632444204e-19, 6.63626368332702e-19, 6.7456442821302e-19, 6.841294227179999e-19, 6.92273286548622e-19, 6.990280632375659e-19, 7.043985593147339e-19, 7.083815704268579e-19, 7.11044387992566e-19, 7.1251678831921205e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.110331727561279e-19, 7.084152161361718e-19, 7.04440215907218e-19, 6.987060257341319e-19, 6.90715970860374e-19, 6.798436002220499e-19, 6.653086537984019e-19, 6.46321258508868e-19, 6.22179660987756e-19, 5.92335916826238e-19, 5.5644395587137e-19, 5.14446099764328e-19, 4.66276659263118e-19, 4.11680888282934e-19, 3.5014929465416396e-19, 2.81425530115368e-19, 2.11176493421004e-19, 1.515617439171516e-19, 1.238447290196052e-19, 1.8258565138727398e-19, 4.659225782270039e-19, 1.3311364128262197e-18]
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: -3.09700299259974e-11 eV

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

Energy: 0.018102003500846522
Energy: 0.16317842761226273
Energy: 1.0359057526990296
Energy: 0.019133320623582088
Energy: 0.16317842761288753
Energy: 5.265134079862834
Energy: 0.01913332062295731
Energy: 5.265134086431044
Energy: 1.035905752688041
Energy: 0.01913332062295731
Energy: 0.018102003500846522
Energy: 0.16317842761226273
Energy: 0.019133320623582088
Energy: 5.26513408406277
Energy: 0.16317842761288753
Energy: 5.265134086327588

minimum gb energy = 0.018102003500846522 eV
minimum distance =  1.67768726458967 Angstroms
sigma value = 1


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

Energy: 2.223125625881941
Energy: 1.405321481348878
Energy: 1.4075214363709334
Energy: 1.310346011424733
Energy: 1.3547135119098568
Energy: 1.4412694087780802
Energy: 1.3386002385570013
Energy: 1.4412694087780802
Energy: 1.407433084257514
Energy: 1.4054077490850998
Energy: 2.378286187394635
Energy: 1.4054077490842976
Energy: 1.3427330124700663
Energy: 1.5143007709405423
Energy: 1.338304566007059
Energy: 1.5143007709405423
Energy: 1.9960901023142215
Energy: 1.3378871656209763
Energy: 1.3408995997127087
Energy: 1.3378871656225808
Energy: 1.4314079317136637
Energy: 1.4246965655042947
Energy: 1.337609268622785
Energy: 1.4246965655067017
Energy: 1.5710546346217014
Energy: 1.4482299381575456
Energy: 2.1134493232015377
Energy: 1.448229938161557
Energy: 1.41705919482363
Energy: 1.4145642741650055
Energy: 1.4671200155795974
Energy: 1.4145642741642033
Energy: 1.7573839022380038
Energy: 1.6313589756791966
Energy: 1.6241599295188702
Energy: 1.6313589756808013
Energy: 1.4550519345078128
Energy: 1.5616988829593843
Energy: 1.4461294625194685
Energy: 1.5616988829617913
Energy: 1.9438528788783147
Energy: 1.6306557180167642
Energy: 1.8689066866029018
Energy: 1.630655718015962
Energy: 1.4581165548882309
Energy: 1.6271043791436028
Energy: 1.4722833084099165
Energy: 1.6271043791452071
Energy: 1.568315788190523
Energy: 1.4464231418892224
Energy: 1.451626595853195
Energy: 1.4464231418948383
Energy: 1.4323546447244695
Energy: 1.4487074787774739
Energy: 1.4144764406877366
Energy: 1.4487074787822876
Energy: 1.451630401614427
Energy: 1.3373320742548234
Energy: 1.3380965282632546
Energy: 1.3373320742548234
Energy: 1.3922150603590104
Energy: 1.3375346481514065
Energy: 1.3379213724624757
Energy: 1.337534648152209
Energy: 1.4054463267325454
Energy: 1.4051324647767698
Energy: 2.501816842661047
Energy: 1.4051324647759678
Energy: 1.3377227901887199
Energy: 1.3420133129211433
Energy: 1.3691677225942556
Energy: 1.342013312920341
Energy: 2.3714552079119655
Energy: 1.4050079863844505
Energy: 1.4079966024486033
Energy: 1.4050079863844505
Energy: 1.4316854732506057
Energy: 1.342078125269755
Energy: 1.3408100426118448
Energy: 1.3420781252673486
Energy: 1.3369854929316116
Energy: 1.342264657509777
Energy: 1.4139467152421377
Energy: 1.3422646575105792
Energy: 1.337568842717624
Energy: 1.3373994230957875
Energy: 1.4317696672675646
Energy: 1.3373994230933808
Energy: 1.4529914036703897
Energy: 1.4473639042802549
Energy: 1.4141909388296767
Energy: 1.447363904265011
Energy: 1.4674798306118373
Energy: 1.4491022493229953
Energy: 1.4159164921589464
Energy: 1.4491022493229953
Energy: 1.4497028287199225
Energy: 1.6309452119920091
Energy: 1.7586443463807842
Energy: 1.6309452119920091
Energy: 1.448133132629419
Energy: 1.630827417149917
Energy: 1.4581963304288212
Energy: 1.630827417149917
Energy: 1.9032134925689435
Energy: 1.6317686081001632
Energy: 1.4472512467681211
Energy: 1.6317686081009655
Energy: 1.4686676049704852
Energy: 1.6271156236707724
Energy: 1.4502035050927269
Energy: 1.6271156236715747
Energy: 1.4539861951951263
Energy: 1.445526126069039
Energy: 1.5686791842946164
Energy: 1.4455261260706436
Energy: 1.4515755404259612
Energy: 1.4486925670096227
Energy: 1.4328559069921638
Energy: 1.4486925670096227
Energy: 1.3365109418446703
Energy: 1.3366554906948682
Energy: 1.3661943112216588
Energy: 1.3366554906956705
Energy: 1.337298507507833
Energy: 1.3368959509087264
Energy: 1.4777966659688304
Energy: 1.3368959509087264
Energy: 2.4611788365857397
Energy: 1.4050906375591534
Energy: 1.4072134483682275
Energy: 1.405090637557549

minimum gb energy = 1.310346011424733 eV
minimum distance =  2.26632182256194 Angstroms
sigma value = 1


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

Energy: 2.5038420508521226
Energy: 1.478420966715002
Energy: 1.480308953295777
Energy: 1.372817801720021
Energy: 1.4310473939718054
Energy: 1.5139293426038263
Energy: 1.4085966040775566
Energy: 1.5139293426029117
Energy: 1.4790087227202893
Energy: 1.4782131333200834
Energy: 2.3381551327855727
Energy: 1.4782131333228277
Energy: 1.4136953888384234
Energy: 1.5957335223958766
Energy: 1.4094067582243384
Energy: 1.5957335223346298
Energy: 1.5507587869284107
Energy: 1.4086734746323777
Energy: 1.4085112772991286
Energy: 1.4086734746305485
Energy: 1.5198799469694437
Energy: 1.40904583516653
Energy: 1.4096739266925564
Energy: 1.40904583516653
Energy: 1.6991032798386045
Energy: 1.5986796577938907
Energy: 2.0405112371657945
Energy: 1.59867965779572
Energy: 1.5032941586046855
Energy: 1.526235672803654
Energy: 1.5559571299978907
Energy: 1.5262356728054831
Energy: 2.033241268291544
Energy: 1.7235843276355944
Energy: 1.9102331101187207
Energy: 1.7235843276355944
Energy: 1.553778934022166
Energy: 1.6840028815804073
Energy: 1.5356312706082371
Energy: 1.684002881581322
Energy: 1.5366705271875718
Energy: 1.6000448083244818
Energy: 1.6820764343349073
Energy: 1.60004480832997
Energy: 1.500585694133663
Energy: 1.599169800087578
Energy: 1.5206149279765275
Energy: 1.5991698000866632
Energy: 1.4107415243450032
Energy: 1.4078457957357107
Energy: 2.1587214462839976
Energy: 1.4078457957366253
Energy: 1.4079763496980522
Energy: 1.4078315745980379
Energy: 1.4646545502920325
Energy: 1.4078315746081003
Energy: 2.482063652693711
Energy: 1.4797555184212383
Energy: 1.4794942814629528
Energy: 1.4797555184248974
Energy: 1.4496626863440094
Energy: 1.4146893515756478
Energy: 1.4093405248159423
Energy: 1.414689351581136
Energy: 1.4782633856746243
Energy: 1.4785404621915614
Energy: 1.5078555969741188
Energy: 1.478540462192476
Energy: 1.4141984473738416
Energy: 1.415167851521642
Energy: 1.5198671629056548
Energy: 1.415167851518898
Energy: 1.550758334993093
Energy: 1.4157125104783987
Energy: 1.4093831524084692
Energy: 1.4157125104829724
Energy: 1.5205236357156018
Energy: 1.4094855311845071
Energy: 1.409833569018912
Energy: 1.4094855311863368
Energy: 1.6865081414059107
Energy: 1.5984681701099321
Energy: 2.046077334528821
Energy: 1.5984681701108467
Energy: 1.5012747084388394
Energy: 1.5984249728772886
Energy: 1.551811797246279
Energy: 1.5984249728754591
Energy: 2.0517943471897433
Energy: 1.7246839224381207
Energy: 1.523503094723074
Energy: 1.7246839224426944
Energy: 1.5535354367081906
Energy: 1.7248714009035437
Energy: 1.5349647981531207
Energy: 1.724871400899885
Energy: 1.536260563596972
Energy: 1.5992257234755531
Energy: 1.5513689010186786
Energy: 1.5992257234773828
Energy: 1.536721949318557
Energy: 1.6011581049703814
Energy: 1.5192777551094379
Energy: 1.6011581049703814
Energy: 1.4090859436018441
Energy: 1.4077223181712222
Energy: 1.449651229086624
Energy: 1.4077223181620746
Energy: 1.408276243839882
Energy: 1.407933717242115
Energy: 1.559575676246385
Energy: 1.4079337172457738
Energy: 1.559812366921381
Energy: 1.478865647313009
Energy: 1.4809451874993338
Energy: 1.4788656473075208

minimum gb energy = 1.372817801720021 eV
minimum distance =  2.26493358506939 Angstroms
sigma value = 25


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

Energy: 2.218896297483723
Energy: 1.5597676223759065
Energy: 1.5590975712422803
Energy: 1.4398205855028765
Energy: 1.5230752262866398
Energy: 1.5927131982168268
Energy: 1.4896817658958343
Energy: 1.5927131982168268
Energy: 1.5591797860496357
Energy: 1.5594223765964637
Energy: 2.023421246089224
Energy: 1.5594223765975272
Energy: 1.502020172611438
Energy: 1.5920919210521438
Energy: 1.4899758813584003
Energy: 1.5920919210521438
Energy: 1.6566308438288986
Energy: 1.4910882700043022
Energy: 1.4907586831492257
Energy: 1.4910882700053658
Energy: 1.6256824714085358
Energy: 1.4917286678091648
Energy: 1.4905503009786119
Energy: 1.4917286678091648
Energy: 1.8302204494520409
Energy: 1.7163465796483373
Energy: 1.6876681928585842
Energy: 1.7163465796494006
Energy: 1.594294817335483
Energy: 1.7217552478098253
Energy: 1.6566813023259161
Energy: 1.7217552478108886
Energy: 1.8317719516517614
Energy: 1.716755306472863
Energy: 2.1059430887578245
Energy: 1.7167553064707364
Energy: 1.6264141749823227
Energy: 1.7175321224498097
Energy: 1.6058737906476688
Energy: 1.7175321224498097
Energy: 2.4136798410564393
Energy: 1.4909750424281987
Energy: 1.4921185465133098
Energy: 1.4909750424292623
Energy: 1.5432230667938924
Energy: 1.489932832743271
Energy: 1.4901127709181257
Energy: 1.4899328327453978
Energy: 1.558022547590635
Energy: 1.5588996663839136
Energy: 1.6552491919445205
Energy: 1.558899666384977
Energy: 1.4905867062667542
Energy: 1.5007214835015463
Energy: 1.5483045651061362
Energy: 1.5007214834994196
Energy: 1.4898997868840713
Energy: 1.5580876280620464
Energy: 1.5588235077410368
Energy: 1.5580876280577929
Energy: 1.6242084400197878
Energy: 1.5016510151928686
Energy: 1.5019028166323025
Energy: 1.5016510151939317
Energy: 1.4899148032834157
Energy: 1.5004641182180862
Energy: 1.6566308554252411
Energy: 1.5004641182170229
Energy: 1.4903916576350784
Energy: 1.4908044842640218
Energy: 1.6254184703552825
Energy: 1.4908044842650852
Energy: 1.6878048724250572
Energy: 1.7164491755748976
Energy: 1.6271371452159402
Energy: 1.7164491755759612
Energy: 1.6572713942067177
Energy: 1.7177071196643234
Energy: 1.6247191045244205
Energy: 1.71770711966326
Energy: 1.6528309006738544
Energy: 1.716577005941118
Energy: 1.8339225166502915
Energy: 1.7165770059421812
Energy: 1.652726058810979
Energy: 1.716358863817422
Energy: 1.6260196667485136
Energy: 1.716358863816359
Energy: 1.492823884471008
Energy: 1.4901504664966436
Energy: 1.6524285450413152
Energy: 1.4901504664966436
Energy: 1.4901929128708387
Energy: 1.4898534688714256
Energy: 1.6525651160265347
Energy: 1.4898534688703622
Energy: 1.5450667035854724
Energy: 1.559136885095618
Energy: 1.5586928418376642
Energy: 1.5591368850966814

minimum gb energy = 1.4398205855028765 eV
minimum distance =  2.26363734977402 Angstroms
sigma value = 9


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

Energy: 2.530649501009239
Energy: 1.6705200094461015
Energy: 1.6706968158806874
Energy: 1.587861955843974
Energy: 1.6323362903143022
Energy: 1.7081324096554547
Energy: 1.6414001285722082
Energy: 1.7081324096554547
Energy: 1.675084254997478
Energy: 1.674543863536352
Energy: 2.7905870236981274
Energy: 1.674543863536352
Energy: 1.6249783267438158
Energy: 1.7079996896118355
Energy: 1.6415512018180556
Energy: 1.7079996896105667
Energy: 1.6924770590306628
Energy: 1.6206031303547221
Energy: 1.7108629504429018
Energy: 1.620603130352185
Energy: 1.621758790758911
Energy: 1.6265595511897921
Energy: 1.6221608017087312
Energy: 1.6265595511872553
Energy: 1.7137281470087733
Energy: 1.8464957303762632
Energy: 2.1756302019624525
Energy: 1.8464957303788
Energy: 1.7188845722944746
Energy: 1.804591499469723
Energy: 1.7585173837742825
Energy: 1.8045914994722598
Energy: 1.7087249226940964
Energy: 1.710670472815342
Energy: 1.8003791408441725
Energy: 1.710670472815342
Energy: 1.6890602606335932
Energy: 1.7119667374787473
Energy: 1.5505795400955258
Energy: 1.7119667374787473
Energy: 2.367048135590297
Energy: 1.4935307820488397
Energy: 1.5209607153062126
Energy: 1.4935307820501083
Energy: 1.6885652825639297
Energy: 1.493541813868952
Energy: 1.5196899273069564
Energy: 1.493541813868952
Energy: 1.759627459830266
Energy: 1.7582219998798367
Energy: 1.7474226297670772
Energy: 1.758221999878568
Energy: 1.6919059851314355
Energy: 1.6918338667551809
Energy: 1.7030177428647082
Energy: 1.6918338667551809
Energy: 2.2085718690592575
Energy: 1.6376066705043968
Energy: 1.6284983022659363
Energy: 1.6376066705031282
Energy: 1.6323765976255984
Energy: 1.6165613458001213
Energy: 1.6118454120735557
Energy: 1.6165613458026584
Energy: 1.6551132493309098
Energy: 1.8530112110479544
Energy: 2.164183422694487
Energy: 1.853011211068251
Energy: 1.6567446379172772
Energy: 1.8675068065080038
Energy: 1.7691387140202524
Energy: 1.867506806510541
Energy: 1.6177088169388996
Energy: 1.6199213999692414
Energy: 1.7571234105214062
Energy: 1.6199213999692414
Energy: 1.6322972342587256
Energy: 1.619424956020696
Energy: 1.7387901353329134
Energy: 1.6194249560232328
Energy: 1.5791768821166223
Energy: 1.670529422289941
Energy: 1.6706830877130747
Energy: 1.670529422289941

minimum gb energy = 1.4935307820488397 eV
minimum distance =  2.24720974343221 Angstroms
sigma value = 25


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

Energy: 1.8566865746428363
Energy: 1.7384767938154828
Energy: 1.7380815750694356
Energy: 1.5752148384767406
Energy: 1.608413200318129
Energy: 1.6933871299021614
Energy: 1.6095204525471072
Energy: 1.693387129900593
Energy: 1.7378437515500427
Energy: 1.7386434458415625
Energy: 2.62932972022227
Energy: 1.7386434458399935
Energy: 1.5623024993976702
Energy: 1.6931823104996497
Energy: 1.607002490744806
Energy: 1.6931823104996497
Energy: 1.7070477274985385
Energy: 1.8307902704774621
Energy: 1.9981066619074275
Energy: 1.8307902704774621
Energy: 1.5621159733004937
Energy: 1.963242385613454
Energy: 1.9667052755051848
Energy: 1.963242385613454
Energy: 2.363381805902097
Energy: 1.7160092433490586
Energy: 1.9613994993795214
Energy: 1.7160092433474898
Energy: 1.554624664378065
Energy: 1.6957473543999915
Energy: 1.6089710743958587
Energy: 1.6957473543999915
Energy: 1.7368098964126533
Energy: 1.7379791246244314
Energy: 2.6619753748081636
Energy: 1.7379791246244314
Energy: 1.6059753712905152
Energy: 1.7398241070294476
Energy: 1.5534890315371184
Energy: 1.7398241070294476
Energy: 2.5281159371337996
Energy: 1.738407668383353
Energy: 1.741353020019832
Energy: 1.7384076683849217
Energy: 1.7351152328908466
Energy: 1.7412272710501324
Energy: 1.740829540011412
Energy: 1.7412272710485635
Energy: 1.9726588242540886
Energy: 1.829372784133923
Energy: 1.707130508475577
Energy: 1.829372784133923
Energy: 1.9759856638907385
Energy: 1.9629194220803403
Energy: 1.5648718417091014
Energy: 1.9629194220803403
Energy: 1.9592829915026135
Energy: 1.7182597919376337
Energy: 1.5541763836667255
Energy: 1.718259791936065
Energy: 1.6047825922040713
Energy: 1.6953234833872013
Energy: 1.5553040141900802
Energy: 1.695323483398183
Energy: 1.5542987420301257
Energy: 1.738732662699678
Energy: 1.7388664497739692
Energy: 1.738732662699678

minimum gb energy = 1.5534890315371184 eV
minimum distance =  2.26678825273371 Angstroms
sigma value = 17


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

Energy: 2.6645469214650586
Energy: 1.891876701064249
Energy: 1.8924193794593938
Energy: 1.7908828953471427
Energy: 1.6473527694245966
Energy: 1.7222067348543975
Energy: 2.171470699166073
Energy: 1.722206734853509
Energy: 1.6923131157013611
Energy: 1.6926530432867872
Energy: 2.7663361367119097
Energy: 1.6926530432885643
Energy: 1.8827459678731386
Energy: 1.8837187244571691
Energy: 1.7186677373415098
Energy: 1.8837187244553923
Energy: 2.1903742235425328
Energy: 1.8625721944726104
Energy: 2.0544378788962754
Energy: 1.8625721944734985
Energy: 1.6921776987724086
Energy: 1.8295402247886623
Energy: 1.8830991472493992
Energy: 1.8295402247904393
Energy: 1.7876834065614553
Energy: 1.6918651754684888
Energy: 1.69402908182748
Energy: 1.6918651754667118
Energy: 2.750084099499228
Energy: 1.6906041355761519
Energy: 1.692818364608944
Energy: 1.6906041355752635
Energy: 1.8940589853202388
Energy: 1.8914855341861645
Energy: 1.9236026042911523
Energy: 1.8914855341870531
Energy: 1.9297433933704493
Energy: 1.8966160091076538
Energy: 1.9362469431241187
Energy: 1.8966160091058768
Energy: 2.170168463481766
Energy: 2.0398382789175917
Energy: 1.8244085561696255
Energy: 2.0398382789193685
Energy: 2.467968924260575
Energy: 1.8204903362813898
Energy: 1.8321877770566262
Energy: 1.8204903362813898
Energy: 2.177278382358699
Energy: 1.6826604544258965
Energy: 1.8223367521331575
Energy: 1.6826604544241195
Energy: 1.7851330091375286
Energy: 2.0296654663652585
Energy: 1.6290774059118565
Energy: 2.0296654663075473
Energy: 1.8937522720771023
Energy: 1.8939709201692807
Energy: 2.4538785226999296
Energy: 1.8939709201692807
Energy: 1.8943641796880895
Energy: 1.8923999399224785
Energy: 2.071075366833552
Energy: 1.89239993992159
Energy: 1.9335124270864072
Energy: 1.6908990196140483
Energy: 1.6945143558915123
Energy: 1.6908990196149367
Energy: 2.3189200298649078
Energy: 1.691190214727156
Energy: 1.6918450403562315
Energy: 1.6911902147280446
Energy: 1.8839224804153105
Energy: 2.2335328115583124
Energy: 2.1223675665387667
Energy: 2.2335318312303376
Energy: 2.0425592380571658
Energy: 1.8649099074945896
Energy: 2.1203722423625586
Energy: 1.8649099074945896
Energy: 1.8849405364666487
Energy: 1.7197739272084596
Energy: 2.4122189777712126
Energy: 1.7197739272084596
Energy: 1.6918437958971233
Energy: 1.6939422792696484
Energy: 2.2909718688230223
Energy: 1.6939422792714254
Energy: 2.0024213150280983
Energy: 1.958982624033053
Energy: 1.83863991886012
Energy: 1.9589826240303876
Energy: 2.3980226880517006
Energy: 1.8913633162403007
Energy: 1.8937250532079983
Energy: 1.891363316239412
Energy: 1.633568167260229
Energy: 1.983619383410147
Energy: 2.5187223603944497
Energy: 1.9836193834128124
Energy: 1.8244595837064457
Energy: 1.684351818799979
Energy: 1.986296489652188
Energy: 1.684351818799979
Energy: 1.6277837405340638
Energy: 1.6392901997665235
Energy: 1.843374127920606
Energy: 1.6392901997647464
Energy: 1.8240577930496655
Energy: 1.6850466308059413
Energy: 2.6352799492741656
Energy: 1.6850466308068297
Energy: 1.6328055958368417
Energy: 1.9814305369926946
Energy: 2.166209080139416
Energy: 1.9814305369935827
Energy: 2.06962129766144
Energy: 1.8911289287107786
Energy: 1.8943618747595252
Energy: 1.8911289287116673

minimum gb energy = 1.6277837405340638 eV
minimum distance =  2.25198783644795 Angstroms
sigma value = 53


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

Energy: 2.8242888892277604
Energy: 1.78074711931535
Energy: 1.7820337593425704
Energy: 1.558554079800789
Energy: 1.7847236471725918
Energy: 2.5488476739681043
Energy: 2.1731890476706988
Energy: 2.5488476734815193
Energy: 1.7781016759261146
Energy: 1.7793067392427628
Energy: 1.8901771535407592
Energy: 1.7793067393143538
Energy: 1.7847775487812763
Energy: 1.6524934106848814
Energy: 1.7805232178265105
Energy: 1.652493410682836
Energy: 2.2373560336331466
Energy: 1.651060489123473
Energy: 1.5293563969507031
Energy: 1.6510604891255183
Energy: 1.785206973260864
Energy: 1.6527944866470963
Energy: 1.5319587939879316
Energy: 1.6527944866389144
Energy: 2.7834217650703907
Energy: 1.7767612577600658
Energy: 1.7758562499499766
Energy: 1.7767612577621112
Energy: 2.7787544106751563
Energy: 1.7781875908162772
Energy: 2.178472257143352
Energy: 1.7781875908387772
Energy: 1.7832833028631736
Energy: 1.7859734320677942
Energy: 1.8183493864287035
Energy: 1.78597343206984
Energy: 1.7839203786347424
Energy: 1.7851863353840016
Energy: 2.1725120202074244
Energy: 1.7851863353819564
Energy: 2.16645314917666
Energy: 2.2040561261369853
Energy: 1.5596700671684882
Energy: 2.2040561261349403
Energy: 2.175235503804976
Energy: 1.6569847660607013
Energy: 1.5295089456308884
Energy: 1.6569847660607013
Energy: 2.780349696364137
Energy: 1.7797258055409741
Energy: 2.172386839996799
Energy: 1.7797258055368834

minimum gb energy = 1.5293563969507031 eV
minimum distance =  2.28071523495803 Angstroms
sigma value = 9


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

Energy: 2.520487638363959
Energy: 1.990206252450908
Energy: 1.9991494563682866
Energy: 1.9312850007875164
Energy: 1.6957388678055167
Energy: 1.6703736296230467
Energy: 2.5001360547999507
Energy: 1.6703736296245606
Energy: 1.6715233540085541
Energy: 1.6735543983430048
Energy: 2.4707186565968824
Energy: 1.6735543983475474
Energy: 1.6863137230504788
Energy: 1.6736429385861908
Energy: 2.142697745173738
Energy: 1.6736429385854334
Energy: 1.6730304022686573
Energy: 1.6697534169737454
Energy: 2.7151766318569686
Energy: 1.669753416970717
Energy: 1.6702060046482536
Energy: 1.6705097643425755
Energy: 2.662698619838132
Energy: 1.6705097643357618
Energy: 1.9103405828567104
Energy: 2.010539587895867
Energy: 1.997317952597468
Energy: 2.0105395878966243
Energy: 1.911810494838156
Energy: 1.9768444820147828
Energy: 1.9775979018152623
Energy: 1.9768444820200821
Energy: 1.7764063726150239
Energy: 1.9492571982911793
Energy: 2.0618440152504522
Energy: 1.9492571982881512
Energy: 1.7725062902568782
Energy: 1.8700649878032867
Energy: 2.3604809523527805
Energy: 1.8700648957075205
Energy: 1.8307919281349767
Energy: 1.770235047729918
Energy: 1.8027937857800744
Energy: 1.7702350477306752
Energy: 1.7899828139316842
Energy: 1.831100946250679
Energy: 2.6702247408484996
Energy: 1.8311009462567354
Energy: 2.561056974014781
Energy: 1.7985288655017742
Energy: 1.8030631985317271
Energy: 1.7985288655055596
Energy: 2.8391347647110674
Energy: 1.7999883306575355
Energy: 1.8069449532845685
Energy: 1.799988330660564
Energy: 1.9105656051939321
Energy: 2.1086548098521845
Energy: 1.9925968158491725
Energy: 2.1086548098468856
Energy: 2.2177512267523367
Energy: 1.857433218592759
Energy: 2.0025903423783933
Energy: 1.8574332204127197
Energy: 2.317092034206712
Energy: 1.9673567981585838
Energy: 1.6747058793648706
Energy: 1.967356798163126
Energy: 1.895931821110507
Energy: 1.87624725807017
Energy: 2.3676239469949936
Energy: 1.8762472580618421
Energy: 2.677136659593377
Energy: 1.8441501824410533
Energy: 1.691047515561662
Energy: 1.8441501824357538
Energy: 2.4798960129583647
Energy: 1.7303799795200892
Energy: 1.7855305888752293
Energy: 1.7303799795253885
Energy: 1.8887383948203282
Energy: 1.9193396352346639
Energy: 1.7832755714470458
Energy: 1.9193396352354208
Energy: 2.646755524048942
Energy: 1.70550381403177
Energy: 1.7078601007337615
Energy: 1.7055038140363123
Energy: 2.6836219748729913
Energy: 1.7071737947797734
Energy: 1.7268668596377899
Energy: 1.7071737947835588
Energy: 2.0062591268686196
Energy: 1.987189031694687
Energy: 1.912884402265395
Energy: 1.9871890316984722
Energy: 1.9856754508375312
Energy: 1.9850035012242273
Energy: 1.9125488080192128
Energy: 1.9850035012083291
Energy: 1.9975553939196136
Energy: 1.9627193223907375
Energy: 1.834640828362632
Energy: 1.9627193393268887
Energy: 2.3596766888073883
Energy: 1.8656546098099245
Energy: 1.7714518017868068
Energy: 1.865654609683565
Energy: 1.80241425303765
Energy: 1.7630916258567428
Energy: 1.7631691279096522
Energy: 1.7630916258658276
Energy: 2.724368661858247
Energy: 1.7797520476397979
Energy: 1.781286595790042
Energy: 1.7797520476450974
Energy: 1.786921177339325
Energy: 1.7618664297820348
Energy: 1.9116685383790037
Energy: 1.7618664297827917
Energy: 1.7701496609584302
Energy: 1.7645071616128307
Energy: 2.291411738023802
Energy: 1.7645071616105594
Energy: 1.7824588425543249
Energy: 2.0240485692117636
Energy: 2.0392375789675956
Energy: 2.024048569211007
Energy: 1.7746695649844393
Energy: 1.802347928344613
Energy: 2.2159233392308804
Energy: 1.802347928344613
Energy: 1.7637218092698796
Energy: 2.3078419140396904
Energy: 2.15781381168942
Energy: 2.3078419128296415
Energy: 2.423629137508197
Energy: 1.9833725100205273
Energy: 1.9926106515845996
Energy: 1.9833725100099284

minimum gb energy = 1.669753416970717 eV
minimum distance =  2.2495859671618 Angstroms
sigma value = 73


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

Energy: 2.618711529498331
Energy: 1.916329627710595
Energy: 1.9168531657103345
Energy: 1.7911923359851334
Energy: 1.704515850433155
Energy: 2.1116271708986107
Energy: 1.9722320650717262
Energy: 2.1116271708986107
Energy: 1.7044790998733796
Energy: 1.7017378719054916
Energy: 2.221141279887427
Energy: 1.7017378718562453
Energy: 1.70728202492871
Energy: 1.7072558184900695
Energy: 1.9832009514379396
Energy: 1.7072558184900695
Energy: 1.7045956991455635
Energy: 1.7054211744230183
Energy: 2.560479694300557
Energy: 1.7054211744230183
Energy: 1.8125237377096393
Energy: 2.181347049813047
Energy: 2.497325936075465
Energy: 2.181347049810645
Energy: 1.7954243930448082
Energy: 1.9496280768116814
Energy: 1.98382249320155
Energy: 1.9496280768128826
Energy: 1.7957421562008653
Energy: 1.9412538703334863
Energy: 1.9440881647892305
Energy: 1.9412538703334863
Energy: 1.77141664508025
Energy: 2.2213457253900493
Energy: 2.2072554440380157
Energy: 2.2213457143301545
Energy: 1.7756391865948176
Energy: 2.0304412375912992
Energy: 2.2229424982746298
Energy: 2.0304412375912992
Energy: 1.7715695834125256
Energy: 1.6770093243166304
Energy: 1.67479625652073
Energy: 1.6770093243178317
Energy: 1.7652347450541113
Energy: 1.7658827961741197
Energy: 2.3747672389316974
Energy: 1.7658827961741197
Energy: 2.2113498110261687
Energy: 1.679730898273753
Energy: 1.677418696866051
Energy: 1.679730898273753
Energy: 2.2075459049945305
Energy: 1.789498492231192
Energy: 1.8631808381113855
Energy: 1.789498492231192
Energy: 1.9785480588003854
Energy: 1.861836180146219
Energy: 1.8552645669757548
Energy: 1.8618361805340204
Energy: 2.5213447263935587
Energy: 1.7589413724151584
Energy: 1.7583812287712577
Energy: 1.7589413724139569
Energy: 2.3952431627226893
Energy: 2.30814492579515
Energy: 1.7843500854261234
Energy: 2.3081449257975524
Energy: 1.920328968013934
Energy: 1.921003592869812
Energy: 2.880391729044214
Energy: 1.9210035928686107
Energy: 2.069450920561319
Energy: 1.8984638505590934
Energy: 1.7867150559181397
Energy: 1.8984638505590934
Energy: 2.1519283161566736
Energy: 2.071522986756574
Energy: 2.0660366373663717
Energy: 2.071522986756574
Energy: 2.064045132563722
Energy: 2.02402792088632
Energy: 1.8678091758993371
Energy: 2.075513473354778
Energy: 2.5111471322436905
Energy: 1.8864556195183841
Energy: 1.8873840801569264
Energy: 1.8864556195159818

minimum gb energy = 1.67479625652073 eV
minimum distance =  2.24354695419637 Angstroms
sigma value = 7


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

Energy: 3.146264800782513
Energy: 1.9194831750237629
Energy: 1.9192278269999772
Energy: 1.7257923540880102
Energy: 1.7022977650310362
Energy: 2.0548342723209276
Energy: 2.0758894250351636
Energy: 2.0437214524970564
Energy: 1.7000938535854888
Energy: 1.7000484705134362
Energy: 1.9678532761438479
Energy: 1.7000484705091896
Energy: 1.6973201744475255
Energy: 1.6978960487633914
Energy: 2.035525440148819
Energy: 1.6978960487727341
Energy: 1.7173459887694602
Energy: 1.7131471473957849
Energy: 2.2027851362064896
Energy: 1.7131471473923878
Energy: 1.7021010289380465
Energy: 1.7138506602556438
Energy: 2.2049233961821875
Energy: 1.7138506602547947
Energy: 2.800261520939107
Energy: 1.7125142234631734
Energy: 1.7067938075161075
Energy: 1.7125142234631734
Energy: 2.3575817683619515
Energy: 1.7117617311573134
Energy: 1.7100142551533728
Energy: 1.7117617311556148
Energy: 2.082568391985559
Energy: 1.6972023376546648
Energy: 1.697078364502408
Energy: 1.6972023376589114
Energy: 2.2107210863623736
Energy: 2.0716193016284246
Energy: 1.7039966839473788
Energy: 2.0716188099700257
Energy: 1.8687143668334383
Energy: 1.8686920186748024
Energy: 1.6942875121249121
Energy: 1.8686920186781997
Energy: 1.8804556294301538
Energy: 1.8820676311008235
Energy: 2.3776518303498277
Energy: 1.8820676310974263
Energy: 2.132359526310754
Energy: 2.1127684327045793
Energy: 1.8753199099900173
Energy: 2.1127684327003324
Energy: 2.118045413823781
Energy: 1.8018482462765117
Energy: 1.7113502531842317
Energy: 1.8018482462705663
Energy: 1.7147246435324346
Energy: 1.8649788068248438
Energy: 1.7187944065042031
Energy: 1.86497880707277
Energy: 2.8690977168744776
Energy: 1.8806315989895541
Energy: 1.8780812130555764
Energy: 1.8806315989827593
Energy: 1.702960723146702
Energy: 1.8693593967417017
Energy: 2.0394339263125665
Energy: 1.8693593967459485
Energy: 1.704278142713744
Energy: 2.0850020209784557
Energy: 2.114086722591624
Energy: 2.085002020971661
Energy: 1.8448749555553223
Energy: 1.6988563973768092
Energy: 2.368794135164552
Energy: 1.6988563973776585
Energy: 1.7154584145325595
Energy: 1.7107516357293864
Energy: 2.9038155338455955
Energy: 1.7107516357319343
Energy: 1.7067922354831295
Energy: 1.713110109433707
Energy: 2.2057423764375037
Energy: 1.7131101094269126
Energy: 2.4224888247207432
Energy: 1.7131964953106924
Energy: 1.7006576933649222
Energy: 1.7131964953106924
Energy: 2.3640381010243616
Energy: 1.713895987159533
Energy: 1.7131225421786207
Energy: 1.7138959871569848
Energy: 2.0314523219121665
Energy: 1.69701627178977
Energy: 1.6981654265947388
Energy: 1.6970162717906194
Energy: 2.205375727266106
Energy: 2.033598281343425
Energy: 1.7017260589602856
Energy: 2.033598281343425
Energy: 2.226839881682797
Energy: 2.041336034838799
Energy: 1.7159032014058673
Energy: 2.041336034871074
Energy: 1.91916918985181
Energy: 1.9191172557829599
Energy: 2.5343222039270943
Energy: 1.9191172557880558
Energy: 1.9702839974464759
Energy: 2.064341516316941
Energy: 1.714677079388062
Energy: 2.0643415163194887
Energy: 2.1074841207812898
Energy: 1.8032737344470602
Energy: 1.968773513926393
Energy: 1.8032737344453615
Energy: 1.987960438220072
Energy: 2.1028950240787077
Energy: 1.7112771988916409
Energy: 2.1028950241941384
Energy: 2.5626222038781843
Energy: 1.8744860415214977
Energy: 1.875468583862797
Energy: 1.8744860415155524

minimum gb energy = 1.6942875121249121 eV
minimum distance =  2.25348785533513 Angstroms
sigma value = 29


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

Energy: 1.5906871939924279
Energy: 1.7645946086264837
Energy: 1.6546790663522948
Energy: 1.5925910128864236
Energy: 1.6357490007029092
Energy: 1.7573473880726371
Energy: 1.6348174461474543
Energy: 1.7573473880737878
Energy: 1.6493120276962825
Energy: 1.7738380686258108
Energy: 1.589804729419624
Energy: 1.7738380686263697
Energy: 1.6191746385628183
Energy: 1.6220935090312
Energy: 1.679668652976769
Energy: 1.622093509030904
Energy: 1.623178141967954
Energy: 1.6399460483454695
Energy: 1.597617843401731
Energy: 1.6399460483524055
Energy: 1.6492736074811942
Energy: 1.7397928291547942
Energy: 1.6004122954355118
Energy: 1.7397928291553526
Energy: 1.5908190708201497
Energy: 1.773730680374687
Energy: 1.6807365071524285
Energy: 1.7737306804033184
Energy: 1.6323904302334948
Energy: 1.6409151290910964
Energy: 1.6157823584004287
Energy: 1.6409151290919513
Energy: 1.6001063004495817
Energy: 1.627875112689956
Energy: 1.631952380957324
Energy: 1.6278751126896605

minimum gb energy = 1.589804729419624 eV
minimum distance =  2.29081919006427 Angstroms
sigma value = 5


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

Energy: 2.306711596004257
Energy: 1.6177867996284023
Energy: 1.819642327426462
Energy: 1.5407108216062995
Energy: 1.7449060812268589
Energy: 2.0966119346819556
Energy: 1.9566466483185292
Energy: 2.0966119346795486
Energy: 1.9522670501091963
Energy: 1.6982217084087956
Energy: 2.0985656956336265
Energy: 1.6982217084079934
Energy: 1.6034819476764575
Energy: 2.189855855403429
Energy: 1.9864207503454088
Energy: 2.189855855401022
Energy: 1.9594778440505771
Energy: 1.6106056588925477
Energy: 1.9690609943489725
Energy: 1.6106056588909432
Energy: 1.6105773076534453
Energy: 1.5860380045211246
Energy: 1.968012948056508
Energy: 1.5860380045219271
Energy: 1.5680635147817767
Energy: 1.5664631308004722
Energy: 1.9889611096075848
Energy: 1.5664631307972632
Energy: 1.5802549441888354
Energy: 2.022497117293046
Energy: 2.2712775507528904
Energy: 2.0224971172898365
Energy: 1.6093411319734008
Energy: 2.256546950971877
Energy: 2.316406383825672
Energy: 2.256546950974284
Energy: 1.8596698264028297
Energy: 1.536051672373548
Energy: 1.5389677095393612
Energy: 1.5360516723751527
Energy: 1.702780428989228
Energy: 1.5341294284674474
Energy: 1.539071715463661
Energy: 1.5341294284666451
Energy: 2.256355831912805
Energy: 1.5394602242865039
Energy: 1.5550089093445145
Energy: 1.53946022429212
Energy: 2.2703648459520567
Energy: 1.5322564628833453
Energy: 1.9118875074136679
Energy: 1.532256462880136
Energy: 1.637178815794909
Energy: 2.5769279543529815
Energy: 2.083537212354693
Energy: 2.576927954996128
Energy: 1.571414984886517
Energy: 1.5678291868684726
Energy: 2.1082009412210625
Energy: 1.5678291868292331
Energy: 1.5766400969286396
Energy: 1.5721598494973776
Energy: 1.876262975834742
Energy: 1.5721598494973776
Energy: 1.61545944181502
Energy: 1.6167949526694427
Energy: 1.5997052828903255
Energy: 1.6167949526702448
Energy: 1.9552090608715793
Energy: 2.0544526949161557
Energy: 1.5761337843512648
Energy: 2.0544526949217716
Energy: 2.4646500798142768
Energy: 1.702260375757378
Energy: 1.8535406360262765
Energy: 1.702260375706031
Energy: 1.9911118366980523
Energy: 2.035141245054839
Energy: 1.5991836834210669
Energy: 2.03509186953097
Energy: 1.9646657068568172
Energy: 1.5993184906670868
Energy: 1.9862121375898012
Energy: 1.5993184906654823
Energy: 2.5153593688819935
Energy: 1.6108959734579515
Energy: 1.6164354236483618
Energy: 1.6108959734571493
Energy: 1.9917179561469307
Energy: 1.5668786741268972
Energy: 1.5687868630297634
Energy: 1.5668786741276994
Energy: 2.263838069851394
Energy: 1.976298023319657
Energy: 1.5761983394233785
Energy: 1.9762980233204592
Energy: 2.274716849178862
Energy: 2.015108002510315
Energy: 1.7028668686308168
Energy: 2.0151388151027754
Energy: 1.5366113828120445
Energy: 1.5368286859150735
Energy: 1.8598643343293868
Energy: 1.5368286859206897
Energy: 1.5369381468324308
Energy: 1.53392988296409
Energy: 1.6091374340383457
Energy: 1.5339298829648922
Energy: 1.5565761874214583
Energy: 1.536575529052383
Energy: 1.676745267416016
Energy: 1.5365755290539878
Energy: 1.5544801394353416
Energy: 1.5336341669291347
Energy: 2.26793919595278
Energy: 1.533634167841778
Energy: 1.9385482842670068
Energy: 2.0782500508757953
Energy: 1.6984947279196934
Energy: 2.078250050876597
Energy: 1.9502803751899322
Energy: 1.5697554459919978
Energy: 1.5756191470923582
Energy: 1.5697554459887886
Energy: 1.8890048566507895
Energy: 1.5710931848581942
Energy: 1.5723263493883042
Energy: 1.571093184857392
Energy: 1.6720522107093312
Energy: 1.613741753973508
Energy: 1.6204820758038583
Energy: 1.6137417539743102

minimum gb energy = 1.532256462880136 eV
minimum distance =  2.26105752433533 Angstroms
sigma value = 1


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

Energy: 2.5143636412204966
Energy: 1.547267517035569
Energy: 1.5548214640365288
Energy: 3.098868545697933
Energy: 1.7548651595765359
Energy: 2.032489781809901
Energy: 2.001455975252455
Energy: 2.0324882159290536
Energy: 1.86286856363934
Energy: 1.66220860780025
Energy: 1.994868580545959
Energy: 1.6622086077991411
Energy: 1.527599249434542
Energy: 2.0482123394120526
Energy: 2.0510827151430706
Energy: 2.04279040617116
Energy: 2.0326355056729053
Energy: 1.5119566212247597
Energy: 2.8217135006218563
Energy: 1.5119566212314155
Energy: 1.5406452554792194
Energy: 1.512533583156866
Energy: 2.7543962827189246
Energy: 1.512533583156866
Energy: 1.490944512370758
Energy: 1.493005260850171
Energy: 2.0590523320918614
Energy: 1.4930052608490614
Energy: 1.5018440091274623
Energy: 1.5025019041716587
Energy: 2.4699021850107643
Energy: 1.5025019041650534
Energy: 2.0112895826285384
Energy: 2.063881529050836
Energy: 2.4432345783491347
Energy: 2.063881513723771
Energy: 2.2245526171105725
Energy: 1.5032354942154051
Energy: 1.501463288643489
Energy: 1.5032354942142958
Energy: 2.222025805020972
Energy: 1.4936978983957294
Energy: 1.4917903222079891
Energy: 1.4936978984023852
Energy: 2.4372609842147255
Energy: 1.5122666245233651
Energy: 1.5375329692685444
Energy: 1.5122666245244745
Energy: 2.480649874355028
Energy: 1.4947652162104292
Energy: 1.5138323561326403
Energy: 1.4947652162126477
Energy: 2.015060026284095
Energy: 2.07161448937763
Energy: 1.997355102328129
Energy: 2.071614488704586
Energy: 1.5352829312057115
Energy: 1.6605371271805642
Energy: 1.994217501996975
Energy: 1.6605371271949851
Energy: 1.5286968232429443
Energy: 2.0920109754873373
Energy: 1.5410769842871834
Energy: 2.0920109754851186
Energy: 1.5764297778456882
Energy: 1.5767082857928356
Energy: 2.0601319070049127
Energy: 1.576708285726328
Energy: 1.502070108835164
Energy: 1.50401936142687
Energy: 2.0278310374852064
Energy: 1.5040193614301978
Energy: 1.493632918199346
Energy: 1.4968297618998065
Energy: 2.4406286419460153
Energy: 1.4968297619064626
Energy: 1.542418275394719
Energy: 2.056360463533216
Energy: 2.4792548936465466
Energy: 2.07484623102892
Energy: 2.018266168091413
Energy: 2.066490158464494
Energy: 2.0560971346108308
Energy: 2.066493571344719
Energy: 2.0105640126918365
Energy: 1.4975991674558307
Energy: 1.5003617330061734
Energy: 1.4975991674513935
Energy: 2.0300989520891197
Energy: 1.4944572338101147
Energy: 1.4937402003242126
Energy: 1.4944572338112243
Energy: 2.4598319552138044
Energy: 1.543852374472073
Energy: 1.4936444236319069
Energy: 1.5438523744731822

minimum gb energy = 1.490944512370758 eV
minimum distance =  2.26998621846681 Angstroms
sigma value = 17


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

Energy: 2.736555274626714
Energy: 1.5145067590125574
Energy: 1.774985975515044
Energy: 1.4583686867348824
Energy: 1.5208990649618717
Energy: 1.473194683558826
Energy: 1.796436606372221
Energy: 1.4731943384214023
Energy: 2.0907739071024416
Energy: 1.8633345825958147
Energy: 1.7896962736613244
Energy: 1.8633338284741152
Energy: 2.0911119443134805
Energy: 2.472807317853406
Energy: 1.8320468766582212
Energy: 2.472807317849978
Energy: 2.2333732499528227
Energy: 1.446837106337963
Energy: 2.258556369806154
Energy: 1.4468371063311067
Energy: 1.4715872123665186
Energy: 1.465407359221496
Energy: 2.3508511147040276
Energy: 1.465407359222182
Energy: 1.4474084186835912
Energy: 1.4457402250315456
Energy: 1.83206159930934
Energy: 1.4457402250315456
Energy: 1.4593314569609548
Energy: 1.4510360291271047
Energy: 2.6531729184488633
Energy: 1.4510360291284758
Energy: 2.3648432487815803
Energy: 1.8782529116214737
Energy: 2.070942817677035
Energy: 1.878252909108304
Energy: 1.9398000363327743
Energy: 2.3215928289518093
Energy: 1.8088281531402122
Energy: 2.321592828954552
Energy: 1.7074419453222789
Energy: 1.948770060563801
Energy: 1.4879946005349067
Energy: 1.9487700605987683
Energy: 2.346989729645475
Energy: 1.479389184222724
Energy: 1.8698293000467792
Energy: 1.479389184224781
Energy: 2.364054194914887
Energy: 1.5109678091650671
Energy: 1.5187835116670245
Energy: 1.5109678091664385
Energy: 2.2720342761246335
Energy: 1.4690068937736145
Energy: 1.471543878040905
Energy: 1.4690068937749858
Energy: 1.9201724823856516
Energy: 1.4755269488500284
Energy: 1.4850536021210685
Energy: 1.475526948850714
Energy: 2.6318462875379276
Energy: 1.4720766366803484
Energy: 2.2476632304870834
Energy: 1.4720766366844622
Energy: 1.5231919603849278
Energy: 1.4803485516576458
Energy: 2.3885428403261177
Energy: 1.4803483645694886
Energy: 1.4743512836697756
Energy: 1.4731841351836803
Energy: 2.3677716295546807
Energy: 1.4731841351816235
Energy: 1.4857423954825122
Energy: 1.474751863625386
Energy: 2.071611925986165
Energy: 1.4747518636226433
Energy: 1.516555018890265
Energy: 1.5271179975553424
Energy: 2.7542688575516916
Energy: 1.5271179975573992
Energy: 1.9342505430043369
Energy: 1.9562170194281503
Energy: 1.5341349926909325
Energy: 1.9562170194350066
Energy: 1.813055076249823
Energy: 1.794406678668927
Energy: 2.0813046235283337
Energy: 1.794406678668241
Energy: 1.8525118471087159
Energy: 2.4315081303274515
Energy: 2.0727850959453615
Energy: 2.4315081301170856
Energy: 2.268025075564399
Energy: 3.034958853194526
Energy: 1.7180932346863294
Energy: 3.034958853195212
Energy: 2.7697394407492477
Energy: 1.4638528707785214
Energy: 1.465953665506736
Energy: 1.4638528707771503
Energy: 1.8264868630772064
Energy: 1.4477500904427871
Energy: 1.451778827763738
Energy: 1.4477500904400447
Energy: 2.7512553965525317
Energy: 1.4546553354082177
Energy: 1.460678017394284
Energy: 1.4546553354102745
Energy: 2.073877783583635
Energy: 2.316249542434263
Energy: 2.3517198442192053
Energy: 2.3162495424390626
Energy: 1.8641010541449383
Energy: 1.9362125197773545
Energy: 1.8104517516280363
Energy: 1.9362125196162923
Energy: 1.4900497881237436
Energy: 1.9156187023935012
Energy: 2.262211553136877
Energy: 1.9156187026971134
Energy: 1.867292795276251
Energy: 1.4844732624162926
Energy: 2.801998043055012
Energy: 1.4844732624018944
Energy: 1.5142679636335656
Energy: 1.509086792933579
Energy: 2.3724331817923745
Energy: 1.5090867929287797
Energy: 1.4691689206747687
Energy: 1.4738556136901544
Energy: 1.791126905814005
Energy: 1.4738556136922114
Energy: 1.4821003065436265
Energy: 1.4759429654324405
Energy: 2.0836587882602773
Energy: 1.475942965422156
Energy: 2.34326279181587
Energy: 1.4719455133689758
Energy: 2.665365760389088
Energy: 1.4719455133710329
Energy: 2.4289880909522403
Energy: 1.477071255254665
Energy: 1.4958679795670111
Energy: 1.477071255237524
Energy: 2.3575397205855047
Energy: 1.4699172368960955
Energy: 1.4709120770495794
Energy: 1.469917236897467
Energy: 2.0691182381271642
Energy: 1.4775689030741666
Energy: 1.5293933046662551
Energy: 1.4775689030734809

minimum gb energy = 1.4457402250315456 eV
minimum distance =  2.24273671997957 Angstroms
sigma value = 89


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

Energy: 2.9892940541760966
Energy: 1.350040930101763
Energy: 1.3537999524935098
Energy: 1.389883732372227
Energy: 2.096503625396186
Energy: 1.4808153059688234
Energy: 2.122011196611061
Energy: 1.4808153059688234
Energy: 1.3303853810198298
Energy: 1.4823523329121748
Energy: 2.0934262276512436
Energy: 1.4823523329121748
Energy: 1.3316862379101326
Energy: 1.4853930975741887
Energy: 2.1095160975117655
Energy: 1.4853930978036958
Energy: 1.4286205517135784
Energy: 1.3427891189228072
Energy: 1.4223492732950533
Energy: 1.3427891189228072
Energy: 1.3506909260949924
Energy: 1.3470195239169636
Energy: 1.4223521066091884
Energy: 1.3470195239151694
Energy: 1.3389627596104017
Energy: 1.3387389529934977
Energy: 2.877645823839156
Energy: 1.3387389529934977
Energy: 1.348646699129384
Energy: 1.347344279430475
Energy: 2.871673118095611
Energy: 1.347344279430475
Energy: 2.0934939590523056
Energy: 1.3474998300185828
Energy: 2.8191961964283405
Energy: 1.3474998300185828
Energy: 2.0967293755609155
Energy: 1.4861155811460687
Energy: 2.1151460637271065
Energy: 1.4861155811442748
Energy: 2.154665824980708
Energy: 1.4895020973741724
Energy: 1.3260882602042448
Energy: 1.4895021215391075
Energy: 1.4228139417422623
Energy: 1.483829892813939
Energy: 2.1148796442197217
Energy: 1.483829892812145
Energy: 1.42226994136364
Energy: 1.3452540300013982
Energy: 1.3460402945560088
Energy: 1.3452540300031923
Energy: 2.129983968455171
Energy: 1.3377895857344022
Energy: 1.3370983637319516
Energy: 1.3377895857344022
Energy: 2.8370144865007765
Energy: 1.3431394357894244
Energy: 1.3440842562519053
Energy: 1.3431394357894244

minimum gb energy = 1.3260882602042448 eV
minimum distance =  2.27254027521983 Angstroms
sigma value = 13


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

Energy: 2.405998552341401
Energy: 1.2955381900043719
Energy: 1.6517329363377158
Energy: 1.2841088335495618
Energy: 2.2315301501869254
Energy: 1.266459493832432
Energy: 1.6449291209927022
Energy: 1.2664594944810676
Energy: 2.5457360585472304
Energy: 1.7263035218515197
Energy: 1.8131256777718108
Energy: 1.7263035218424962
Energy: 1.9219004946163285
Energy: 1.997436032819303
Energy: 1.545058880936486
Energy: 1.9974168685564
Energy: 2.056220613884348
Energy: 1.9926481089165455
Energy: 2.121502451675725
Energy: 1.992648108981211
Energy: 1.6085990381105362
Energy: 1.78518735204922
Energy: 2.1208832095074497
Energy: 1.7851873520762895
Energy: 1.6007170291960886
Energy: 1.7406351124584554
Energy: 1.5611367870463457
Energy: 1.7406351088155274
Energy: 1.288400931695896
Energy: 1.2674297299268835
Energy: 2.8349189570697018
Energy: 1.2674297299246278
Energy: 1.2801746438737596
Energy: 1.2678609225967692
Energy: 2.5046578196185063
Energy: 1.2678609226035364
Energy: 1.2674842208033505
Energy: 1.2635368691938975
Energy: 2.0621359696873793
Energy: 1.263536869199913
Energy: 1.2634146394283112
Energy: 1.2742119300374608
Energy: 2.646936315142082
Energy: 1.2742119300330177
Energy: 2.259964966597496
Energy: 1.262080937656995
Energy: 2.482449742818715
Energy: 1.2620809375968411
Energy: 2.198212599033717
Energy: 1.3404395222407939
Energy: 2.288437727489487
Energy: 1.340439520282924
Energy: 2.1661378425184625
Energy: 2.2781123573059245
Energy: 1.9310454219224313
Energy: 2.2781123513428367
Energy: 2.57083724816287
Energy: 1.2659018145923187
Energy: 2.139177808940776
Energy: 1.2659018145953265
Energy: 2.7208973673428978
Energy: 1.2657961993323603
Energy: 1.2708681125172523
Energy: 1.2657961993301048
Energy: 1.5528492988452904
Energy: 1.263658757028641
Energy: 1.2676775504343125
Energy: 1.2636587570248814
Energy: 2.380857028491815
Energy: 1.2666335120912828
Energy: 1.2742741474054666
Energy: 1.2666335120950425
Energy: 2.893482091601099
Energy: 1.2676152654270432
Energy: 1.6361542146303276
Energy: 1.2676152654345625
Energy: 2.606881146763174
Energy: 1.7173027303583297
Energy: 1.6015904820348474
Energy: 1.717302730365097
Energy: 1.924732464706989
Energy: 1.2714362489895676
Energy: 1.6612526018793465
Energy: 1.2714362487422537
Energy: 2.6014902712112855
Energy: 1.9818414933346946
Energy: 2.1202615047060736
Energy: 1.9818414735010277
Energy: 1.6377774775117933
Energy: 1.266319923851213
Energy: 2.2391511241281123
Energy: 1.2663199238587324
Energy: 1.2702390195650235
Energy: 1.8543300673583765
Energy: 1.8097653135633065
Energy: 1.8543300673576244
Energy: 1.6482266752439103
Energy: 1.2924105141252493
Energy: 2.508402982367188
Energy: 1.2924105141305127
Energy: 1.293970388074917
Energy: 1.29216407721831
Energy: 2.0893901041017298
Energy: 1.2921640772168062
Energy: 1.2622929248252486
Energy: 1.2613836193367807
Energy: 2.6130799624623107
Energy: 1.2613836193397887
Energy: 1.2852819520757048
Energy: 1.270402254261377
Energy: 2.6169915580487535
Energy: 1.2704022542500983
Energy: 2.2442856017677855
Energy: 2.1016817229443925
Energy: 2.7660273293796167
Energy: 2.1016817229368736
Energy: 1.6014866311015294
Energy: 2.3117567990350483
Energy: 2.267829145455736
Energy: 2.311756799041064
Energy: 2.18897805754692
Energy: 2.3051104339237614
Energy: 1.9274837758238712
Energy: 2.3051104332548236
Energy: 2.721261116237278
Energy: 1.2642219736236486
Energy: 2.25390624570875
Energy: 1.2642219736326714
Energy: 2.737799824500234
Energy: 1.2687054161915796
Energy: 1.2764032251338964
Energy: 1.2687054161848126
Energy: 1.8097415587609438
Energy: 1.2618470680953946
Energy: 1.2626359236435445
Energy: 1.2618470681014102
Energy: 2.861797905344312
Energy: 1.265665186829296
Energy: 1.27007118733592
Energy: 1.2656651868353113

minimum gb energy = 1.2613836193367807 eV
minimum distance =  2.25883596288049 Angstroms
sigma value = 37


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

Energy: 1.961790826379714
Energy: 1.1517232055831557
Energy: 1.1562995811479184
Energy: 1.217851751415526
Energy: 2.6302754440461023
Energy: 1.1517873381521926
Energy: 1.716781483544682
Energy: 1.151787338150899
Energy: 2.271128790072632
Energy: 1.8533618079182297
Energy: 1.7137935584582848
Energy: 1.853361807920817
Energy: 2.2688927360014612
Energy: 1.8494562860689998
Energy: 1.5432901850413878
Energy: 1.8494563561941204
Energy: 2.10368673171335
Energy: 1.868103597416623
Energy: 1.707564980469794
Energy: 1.8681035975162052
Energy: 1.4852245962062527
Energy: 1.1541082560777909
Energy: 2.5647949604152074
Energy: 1.1541082560855527
Energy: 1.143611467415937
Energy: 1.7799965504694941
Energy: 2.112417798524361
Energy: 1.7799970475509506
Energy: 1.2024257116280201
Energy: 1.1515149693328741
Energy: 2.5887214246941355
Energy: 1.1515149693315805
Energy: 1.1523245704135303
Energy: 1.1558978765094474
Energy: 2.5690451492376063
Energy: 1.1558978765081538
Energy: 1.1514009533084526
Energy: 1.1516665266836141
Energy: 2.8576040006332497
Energy: 1.1516665266823205
Energy: 1.1560200731198644
Energy: 1.2178517514129388
Energy: 1.9617908263784203
Energy: 1.151723205558576
Energy: 1.7167814930332996
Energy: 1.1517873381521926
Energy: 2.384378142592294
Energy: 1.1517873381521926
Energy: 1.7137935585216446
Energy: 1.8533618079156424
Energy: 2.271128790072632
Energy: 1.8533618079182297
Energy: 1.5432901850413878
Energy: 1.8494562725808665
Energy: 2.2688927363117917
Energy: 1.8494561914283236
Energy: 1.707564980471088
Energy: 1.8681035974205038
Energy: 2.1036866812702137
Energy: 1.8681035973623188
Energy: 2.564794960456575
Energy: 1.1541082560803781
Energy: 1.1438274787804255
Energy: 1.1541082560726161
Energy: 2.112417797240319
Energy: 1.779997009972699
Energy: 1.1436114674172306
Energy: 1.7799967757864714
Energy: 2.588721424894564
Energy: 1.1515149693315805
Energy: 1.2024257116254329
Energy: 1.1515149693328741
Energy: 2.5690451492376063
Energy: 1.1558978765081538
Energy: 1.1523245704122367
Energy: 1.1558978765094474
Energy: 2.8576040006332497
Energy: 1.1516665266797332
Energy: 1.1514009533084526
Energy: 1.1516665266810269

minimum gb energy = 1.143611467415937 eV
minimum distance =  2.27241214418623 Angstroms
sigma value = 25


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

Energy: 2.7042705023241185
Energy: 1.0475948321107134
Energy: 1.0537633948642198
Energy: 1.081510396123813
Energy: 2.5621262668598015
Energy: 1.0385803458124863
Energy: 1.4903396619129095
Energy: 1.0385803458134963
Energy: 2.5448677691606596
Energy: 1.0370901067014069
Energy: 1.509227004376109
Energy: 1.037090106702417
Energy: 2.049560321547051
Energy: 1.1558437604177854
Energy: 1.6176051272836058
Energy: 1.1558437604187954
Energy: 2.2666883268114715
Energy: 1.7601914922845827
Energy: 2.174920443473512
Energy: 1.7601976870931815
Energy: 2.025611196995041
Energy: 1.1536231506512584
Energy: 2.093938432934904
Energy: 1.1536231506573194
Energy: 2.0261919627136216
Energy: 2.023416658280914
Energy: 1.8840328030604392
Energy: 2.0234166582859645
Energy: 1.3380991287500597
Energy: 1.0364606353307118
Energy: 2.3067079224972677
Energy: 1.0364606353317218
Energy: 1.3918601375627517
Energy: 1.0328735979073567
Energy: 2.6419889530886875
Energy: 1.0328735979113974
Energy: 1.4018268881004297
Energy: 1.034157460989625
Energy: 2.333283090121318
Energy: 1.0341574609845743
Energy: 1.1785837968737312
Energy: 1.0204291683543973
Energy: 2.1318000629767364
Energy: 1.0204291684200129
Energy: 1.251518106445004
Energy: 1.0343159690908288
Energy: 2.2483475440556426
Energy: 1.0343159744514656
Energy: 1.2630313592433526
Energy: 1.023040184303575
Energy: 2.4894972253768346
Energy: 1.0230401843005448
Energy: 1.2366558639835956
Energy: 1.019691065555953
Energy: 2.424914509767686
Energy: 1.0196910655599938
Energy: 1.6774652607209364
Energy: 1.8027912469789222
Energy: 2.106243905748807
Energy: 1.8027912469779122
Energy: 1.7208828460961074
Energy: 1.0357271217519513
Energy: 2.4424384834711588
Energy: 1.0357271217479105
Energy: 2.002963963863663
Energy: 1.13574905339063
Energy: 2.535519018474218
Energy: 1.135749053350223
Energy: 1.6864803525342345
Energy: 1.757642423305836
Energy: 1.6396046409877756
Energy: 1.757642423304826
Energy: 2.104931066389514
Energy: 1.1534108683798114
Energy: 2.026765619094219
Energy: 1.153410868377791
Energy: 2.645014634306005
Energy: 1.149563349433489
Energy: 2.025515602536
Energy: 1.149563349433489
Energy: 2.3826370843961127
Energy: 1.6574839835254331
Energy: 1.3535300906212167
Energy: 1.657483941930701
Energy: 2.660072090718889
Energy: 1.0364814863293046
Energy: 1.2484981043211794
Energy: 1.036481486331325
Energy: 2.7480215807430395
Energy: 1.4266104300143112
Energy: 1.4277169244140884
Energy: 1.4266104300133011
Energy: 2.006732609260593
Energy: 1.0363178632534007
Energy: 1.0369329696556797
Energy: 1.0363178632503705
Energy: 2.1119870523349813
Energy: 1.0369659729219363
Energy: 1.0395622256742767
Energy: 1.036965972913855
Energy: 2.5177294533633092
Energy: 1.0455611234603739
Energy: 1.0468297137141158
Energy: 1.0455611234634046

minimum gb energy = 1.019691065555953 eV
minimum distance =  2.25700475943038 Angstroms
sigma value = 41


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

Energy: 2.7021111693450135
Energy: 0.938397975042481
Energy: 0.9372125620845837
Energy: 0.980469284781548
Energy: 2.4419197540400437
Energy: 0.9300981578338203
Energy: 1.3305040539793083
Energy: 0.930098157832164
Energy: 2.4722978098860318
Energy: 0.9300875321384304
Energy: 1.3170531265946523
Energy: 0.9300875321384304
Energy: 2.088171497662404
Energy: 0.9371934482326296
Energy: 1.6552013668906465
Energy: 0.9371934482906021
Energy: 2.354649427254431
Energy: 1.7220807135879541
Energy: 1.8623891919103701
Energy: 1.722080713638473
Energy: 2.073052245989599
Energy: 1.339784448591698
Energy: 1.8638568739128532
Energy: 1.3397844485941828
Energy: 2.0709958637562975
Energy: 1.027172488433228
Energy: 2.1635867248817395
Energy: 1.027172488433228
Energy: 1.807247247536028
Energy: 1.4577820742746912
Energy: 1.8610420136624506
Energy: 1.457762681110205
Energy: 1.65761521499677
Energy: 0.9265688406999394
Energy: 2.2732433485986516
Energy: 0.9265688406991113
Energy: 1.6509779277484973
Energy: 0.9271733275891039
Energy: 2.350178043897946
Energy: 0.927173327594073
Energy: 1.1871562832293963
Energy: 0.9397452352800182
Energy: 2.455183356561835
Energy: 0.9397452352866437
Energy: 1.298802482190024
Energy: 0.9284575930359854
Energy: 2.6638920528977943
Energy: 0.9284575930368136
Energy: 1.341019405273723
Energy: 0.9317448351252756
Energy: 2.3482525099254876
Energy: 0.931744835126932
Energy: 0.9292219122788018
Energy: 0.9387389483357156
Energy: 2.2851555129265253
Energy: 0.9387389483216366
Energy: 0.9312971109696732
Energy: 0.9287435175724285
Energy: 2.352041948794033
Energy: 0.9287435175732567
Energy: 0.9371297820590976
Energy: 0.9322919259257955
Energy: 2.476993903352246
Energy: 0.9322919259249672
Energy: 1.1930900898617713
Energy: 0.9346515974208718
Energy: 2.4863240686447408
Energy: 0.9346515974217
Energy: 1.2894383052956122
Energy: 0.9273565222781873
Energy: 2.34715285076187
Energy: 0.9273628431518119
Energy: 1.3235441381729813
Energy: 0.9335770756445388
Energy: 1.9636689116016313
Energy: 0.9335770756437106
Energy: 1.9034079090594989
Energy: 0.9316204784657441
Energy: 1.9543756431014654
Energy: 0.9316204784657441
Energy: 1.9234922370873617
Energy: 1.8609429388748648
Energy: 2.1446791126040043
Energy: 1.8609442578269413
Energy: 1.916929417535095
Energy: 1.0290805875548488
Energy: 2.110859330957482
Energy: 1.029080587555677
Energy: 2.2893894215053368
Energy: 1.021465695995169
Energy: 2.0734210360536776
Energy: 1.0214656959968251
Energy: 1.7706161209953666
Energy: 1.0323009576291977
Energy: 1.7548097553401447
Energy: 1.0323009576267133
Energy: 2.2985596759726654
Energy: 1.890865615348601
Energy: 1.6852844441497135
Energy: 1.890865615348601
Energy: 2.2763046653150893
Energy: 0.9304721654847886
Energy: 1.7610357134433303
Energy: 0.9304721654839605
Energy: 2.18290772934954
Energy: 0.9343781828002328
Energy: 1.1974953041812093
Energy: 0.9343781828018891
Energy: 2.3492817190895203
Energy: 1.4740026273475708
Energy: 1.3171026373925776
Energy: 1.4740026273467426
Energy: 2.2781004331261436
Energy: 0.9353425913957235
Energy: 1.3884288995586829
Energy: 0.9353425913990362
Energy: 2.2739257759055214
Energy: 0.936552344905894
Energy: 0.92821033039775
Energy: 0.9365523449042377
Energy: 2.208725466034348
Energy: 0.928315293961534
Energy: 0.9305738974382322
Energy: 0.928315293961534
Energy: 2.5134004899223306
Energy: 0.9381800236909648
Energy: 0.929551211551691
Energy: 0.9381800236917928

minimum gb energy = 0.9265688406991113 eV
minimum distance =  2.26954761429601 Angstroms
sigma value = 15


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

Energy: 2.3299880966695508
Energy: 0.8635162546033679
Energy: 0.8619134255564694
Energy: 0.8996265352989363
Energy: 2.4027512852120836
Energy: 0.8581357692560609
Energy: 1.0774987194387098
Energy: 0.8581357692546577
Energy: 2.400098814243612
Energy: 0.8561755904114661
Energy: 1.1798387617833377
Energy: 0.8561755904107644
Energy: 2.201313975879097
Energy: 0.8633898139804681
Energy: 1.4828204788054704
Energy: 0.8633898139643316
Energy: 2.4029850767189482
Energy: 1.5709685245582246
Energy: 1.646600317613261
Energy: 1.5709685245631355
Energy: 2.1773899873345277
Energy: 0.8535041154314705
Energy: 1.470045494739941
Energy: 0.8535041154321721
Energy: 1.8258120258156494
Energy: 0.8551146736958191
Energy: 1.9468293864949424
Energy: 0.8551146737049397
Energy: 2.1609919619091325
Energy: 1.6422640105902613
Energy: 1.6559369100326784
Energy: 1.6422640105909625
Energy: 1.8259126285236194
Energy: 0.9325882848015037
Energy: 2.0147278700891333
Energy: 0.9325882848008021
Energy: 1.8308101070161145
Energy: 0.9339191009506722
Energy: 2.2429696732343207
Energy: 0.9339191009562848
Energy: 1.647616703414083
Energy: 1.2463400659674637
Energy: 2.115539696312725
Energy: 1.2463400657648334
Energy: 1.4788278475701415
Energy: 0.8521187910143309
Energy: 2.3559989208557672
Energy: 0.8521187910205814
Energy: 1.6648813586590132
Energy: 0.8565527410437885
Energy: 2.3554533349608393
Energy: 0.8565527410423854
Energy: 1.2345079879211949
Energy: 0.8633534167958078
Energy: 2.017072173117597
Energy: 0.8633534167951062
Energy: 1.1760908456429489
Energy: 1.288476426565759
Energy: 2.399882134131017
Energy: 1.2884764261414923
Energy: 1.2428796324514402
Energy: 0.8607413999496046
Energy: 2.3498274294592005
Energy: 0.8607413999489032
Energy: 0.8545624362637202
Energy: 0.8658324675152093
Energy: 2.259520940025759
Energy: 0.865832467513806
Energy: 0.8538690960447772
Energy: 0.8541743307621278
Energy: 2.5312631853433745
Energy: 0.8541743307621278
Energy: 0.8706806740989991
Energy: 0.8612148526893193
Energy: 2.1844904469148005
Energy: 0.8612148526949319
Energy: 1.1853009483771408
Energy: 0.8588078567052885
Energy: 2.5393528390029267
Energy: 0.8588078567066918
Energy: 1.1647215567293618
Energy: 1.3192390918770829
Energy: 2.533186806852405
Energy: 1.319239091873575
Energy: 1.0693939835441773
Energy: 0.8622594765529812
Energy: 2.1956966608568194
Energy: 0.8622594765571907
Energy: 1.679498609949897
Energy: 0.8573849992892153
Energy: 2.0731750133685822
Energy: 0.8573849992913202
Energy: 1.650093850246564
Energy: 1.5911511152937605
Energy: 2.229969637900717
Energy: 1.591151115282535
Energy: 1.6854506841886325
Energy: 0.854737443000609
Energy: 1.8702782775549445
Energy: 0.854737441000585
Energy: 2.0046339092882173
Energy: 0.9340305758576203
Energy: 2.357149103268609
Energy: 0.9340305758639346
Energy: 1.6449940406973307
Energy: 0.9343264993266728
Energy: 2.0270584740246655
Energy: 0.9343264993287775
Energy: 2.066792708380061
Energy: 0.9344514439682262
Energy: 1.8821883416777576
Energy: 0.9344514431589812
Energy: 2.003462109388561
Energy: 0.8583168759121966
Energy: 2.0419767450338946
Energy: 0.8583168757887817
Energy: 1.898953834940543
Energy: 0.8537164908850804
Energy: 1.6721673789779032
Energy: 0.8537164909341913
Energy: 2.368044499682326
Energy: 1.2897437043617885
Energy: 1.45765962131195
Energy: 1.2897437220401684
Energy: 2.0131146114825196
Energy: 0.8621863825272291
Energy: 1.5798830809101494
Energy: 0.8621863825272291
Energy: 2.3578928253586358
Energy: 0.8572374616546974
Energy: 1.1973350683293589
Energy: 0.8572374616553989
Energy: 2.5336156589582384
Energy: 0.8562780561619999
Energy: 1.1705583082209456
Energy: 0.8562780560484071
Energy: 2.446849199333638
Energy: 0.8664486903558606
Energy: 0.8919328968818565
Energy: 0.8664486903565622
Energy: 2.3992227163509545
Energy: 0.856961304984785
Energy: 0.8647573277624337
Energy: 0.8569613049840834
Energy: 2.5183765381250716
Energy: 0.8580085080443559
Energy: 0.8630346546669709
Energy: 0.8580085080450573

minimum gb energy = 0.8521187910143309 eV
minimum distance =  2.26590958833028 Angstroms
sigma value = 85


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

Energy: 2.4515163179760324
Energy: 0.7708290332162824
Energy: 0.7704006875113242
Energy: 0.8410509076799223
Energy: 2.3158534334244774
Energy: 0.7731227313844933
Energy: 1.0686010071871126
Energy: 0.7731227313838849
Energy: 2.2324415740988584
Energy: 0.7725526564318593
Energy: 1.0503045266188922
Energy: 0.772552656431251
Energy: 1.9438463945515287
Energy: 0.7708051115244929
Energy: 1.312560067867311
Energy: 0.7708051115269269
Energy: 2.2843225914728613
Energy: 1.4524356210812446
Energy: 1.4909414977407527
Energy: 1.452435621080028
Energy: 1.9293249118870648
Energy: 0.7713091929650446
Energy: 1.473786831253571
Energy: 0.771309192965653
Energy: 1.937932750833676
Energy: 0.7724169231798552
Energy: 1.6152381180982966
Energy: 0.7724169229833976
Energy: 1.998332867221899
Energy: 1.459952191627046
Energy: 1.4619909730311145
Energy: 1.459952191627046
Energy: 1.9383131832226121
Energy: 0.7718378624202828
Energy: 1.7854664895247956
Energy: 0.7718378623953349
Energy: 1.9322106265363972
Energy: 0.9107406095700905
Energy: 2.0905439756249073
Energy: 0.910740609567048
Energy: 1.6148640413041098
Energy: 0.911101220444926
Energy: 2.1565807812039317
Energy: 0.911101220443709
Energy: 1.6191889829868895
Energy: 0.7702079930983986
Energy: 2.0921565295643116
Energy: 0.7702079930983986
Energy: 1.785282638505975
Energy: 0.7703790132609909
Energy: 2.0842475428588614
Energy: 0.7703790132597739
Energy: 1.4404420891297793
Energy: 0.7727152940829702
Energy: 1.619223440300176
Energy: 0.7727152938822531
Energy: 1.2874913269129067
Energy: 1.5343561749282084
Energy: 2.1737878180440053
Energy: 1.5343561749306425
Energy: 1.4051094397672106
Energy: 0.7750541534815582
Energy: 2.0813074232435125
Energy: 0.7750541534809497
Energy: 1.1098049783937995
Energy: 0.7709342431218751
Energy: 2.0884300664126547
Energy: 0.7709342431200497
Energy: 1.0307125557865657
Energy: 1.155770739121325
Energy: 2.420017239638418
Energy: 1.155770739239316
Energy: 1.0920957775301008
Energy: 0.7705661804633438
Energy: 2.170225861675371
Energy: 0.7705661804627354
Energy: 0.771174650922177
Energy: 0.7702859466687334
Energy: 2.382981043594959
Energy: 0.7702859466687334
Energy: 0.771365955720247
Energy: 0.770687038304099
Energy: 2.5301929933641345
Energy: 0.770687038302882
Energy: 0.7712321824789973
Energy: 0.7707172451556689
Energy: 2.234635283095634
Energy: 0.770717245154452
Energy: 1.0884355423860057
Energy: 0.7710924849822168
Energy: 2.525369154404165
Energy: 0.7710924849828253
Energy: 1.0320279988411718
Energy: 0.7703846034430509
Energy: 2.5326578247931018
Energy: 0.7703846034430509
Energy: 0.958086364270306
Energy: 0.77083196158571
Energy: 1.9495178069965144
Energy: 0.7708319615851014
Energy: 1.475751881185994
Energy: 0.7710815387789104
Energy: 2.5218563795694235
Energy: 0.7710815387783019
Energy: 1.4610532745832598
Energy: 0.770063493674298
Energy: 2.0394862266326905
Energy: 0.7700634936140857
Energy: 1.4945245927171011
Energy: 0.7728748144920939
Energy: 1.9770388657364562
Energy: 0.77287481446958
Energy: 1.7775905784913062
Energy: 0.7704359624717126
Energy: 2.1495112337183406
Energy: 0.7704359624704957
Energy: 1.7782002940063668
Energy: 0.7714049669507591
Energy: 1.9351651371406382
Energy: 0.7714049669507591
Energy: 2.0883286655222117
Energy: 0.9111494717592841
Energy: 1.618323006733315
Energy: 0.9111494717562416
Energy: 1.7800606109184465
Energy: 0.9109185512906017
Energy: 1.7754213421618446
Energy: 0.9109185512997291
Energy: 2.086768209364225
Energy: 0.770943680689392
Energy: 1.623226149184216
Energy: 0.770943680720397
Energy: 2.381192478099589
Energy: 0.7699668344910905
Energy: 1.6171923884529373
Energy: 0.7699668344929158
Energy: 1.8509195178485307
Energy: 0.7731404671254465
Energy: 1.4398950099003578
Energy: 0.7731405217790014
Energy: 2.2744980722218657
Energy: 0.769965443750455
Energy: 1.4697924165443093
Energy: 0.769965443750455
Energy: 2.378454929241107
Energy: 0.7716694183442961
Energy: 1.4660735251340165
Energy: 0.7716694183436877
Energy: 2.1091565766720666
Energy: 0.7719087770478695
Energy: 1.0970945162268848
Energy: 0.7719087770472611
Energy: 2.4191607169727702
Energy: 0.7702633093840521
Energy: 1.0407684546560128
Energy: 0.7702633093840521
Energy: 2.277689006003281
Energy: 0.7709906713127809
Energy: 1.121354008505883
Energy: 0.7709906713133895
Energy: 1.9025517540328505
Energy: 0.7703127742813405
Energy: 0.7718072136356627
Energy: 0.7703127742837744
Energy: 2.5305007127507886
Energy: 0.770627580429187
Energy: 0.7708460383320116
Energy: 0.770627580429187
Energy: 2.2378872895912565
Energy: 0.7703795239752034
Energy: 0.7709912061001195
Energy: 0.7703795239758118

minimum gb energy = 0.769965443750455 eV
minimum distance =  2.26505404101691 Angstroms
sigma value = 113


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

Energy: 0.02048007908404829
Energy: 0.7328300987078838
Energy: 1.7654705012155902
Energy: 0.020870627759832734
Energy: 3.9083893868138597
Energy: 0.17498032013793607
Energy: 1.204330246764306
Energy: 0.17498032013793607
Energy: 0.021233948746155466
Energy: 0.17534906352885124
Energy: 1.2163765243533353
Energy: 0.17534906352885124
Energy: 0.022892943698630444
Energy: 0.17331785201810265
Energy: 1.2144283385035748
Energy: 0.17331785201992175
Energy: 1.2089772603363647
Energy: 0.1776057781710954
Energy: 1.209118815146372
Energy: 0.17760577817062762
Energy: 0.021052044413498613
Energy: 0.174919085598474
Energy: 1.2013982842465811
Energy: 0.17491908559982533

minimum gb energy = 0.02048007908404829 eV
minimum distance =  2.4557559362065 Angstroms
sigma value = 1