Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Ni__MO_110256178378_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=3.5196183800697343
cohesive_energy=4.450347496491574
mass=58.6934
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: 2.38418579101562e-07 eV

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

Energy: 0.018326631436006928
Energy: 0.01904928385393862
Energy: 0.5300539632127317
Energy: 0.01904928385393862
Energy: 0.01904928385393862
Energy: 1.032622294178434
Energy: 0.01904928385393862
Energy: 1.032622294179059
Energy: 0.5300539632127317
Energy: 0.01904928385393862
Energy: 0.018326631436006928
Energy: 0.01904928385393862
Energy: 0.01904928385393862
Energy: 1.032622294178434
Energy: 0.01904928385393862
Energy: 1.032622294178434

minimum gb energy = 0.018326631436006928 eV
minimum distance =  2.42813078751629 Angstroms
sigma value = 1


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

Energy: 1.274947653912301
Energy: 1.2957987406663876
Energy: 1.2567654762881084
Energy: 1.2957987406655849
Energy: 1.2265263540159417
Energy: 1.2846602552122923
Energy: 1.2076979522258662
Energy: 1.2846602552130948
Energy: 1.1406605217815224
Energy: 1.2773371720954012
Energy: 1.2054018914457083
Energy: 1.2773371720970061
Energy: 1.194726279370908
Energy: 1.3084492999807675
Energy: 1.1837430652623158
Energy: 1.3084492999815702
Energy: 1.1981058819830652
Energy: 1.2976989535388017
Energy: 1.2111723489930728
Energy: 1.297698953537999
Energy: 1.1593387475032297
Energy: 1.2815095489105364
Energy: 1.1419904087269448
Energy: 1.2815095489137458
Energy: 1.2302986743497153
Energy: 1.2771920126505918
Energy: 1.1613929192764476
Energy: 1.2771920126481844
Energy: 1.0937915993996365
Energy: 1.2970546380856962
Energy: 1.1361220098096492
Energy: 1.297054638086499
Energy: 1.1869929609375909
Energy: 1.2095758947410538
Energy: 1.2130539885360578
Energy: 1.2095758947394488
Energy: 1.1326707218787353
Energy: 1.2769888479942082
Energy: 1.0862462068041732
Energy: 1.2769888479934055
Energy: 1.207657326620282
Energy: 1.2770141824667165
Energy: 1.1868777145385765
Energy: 1.2770141824651118
Energy: 1.1980438680670655
Energy: 1.2966915261265999
Energy: 1.1480899991548354
Energy: 1.2966915261257972
Energy: 1.2056162726771456
Energy: 1.276757262243067
Energy: 1.2302648810855916
Energy: 1.276757262242265
Energy: 1.2127921711336427
Energy: 1.2829481325352745
Energy: 1.169677824963044
Energy: 1.2829481325352745
Energy: 1.2109839730182137
Energy: 1.2954975691547348
Energy: 1.2053493045287764
Energy: 1.2954975691547348
Energy: 1.2108990347487134
Energy: 1.2958937593096842
Energy: 1.2053615334562195
Energy: 1.2958937593096842
Energy: 1.2055296341279707
Energy: 1.2773652778577167
Energy: 1.1362925153140575
Energy: 1.2773652778585194
Energy: 1.207785409114924
Energy: 1.2739784572689734
Energy: 1.2276489182494077
Energy: 1.273978457269776
Energy: 1.1038116788291816
Energy: 1.2961900472711332
Energy: 1.1466984079433051
Energy: 1.2961900472695282
Energy: 1.2084925699173026
Energy: 1.209202562067242
Energy: 1.1919843272513362
Energy: 1.2092025620664395
Energy: 1.1367227994364815
Energy: 1.2772525730033841
Energy: 1.084310978252409
Energy: 1.2772525730041866
Energy: 1.1845290583047134
Energy: 1.2932164721708386
Energy: 1.2115193692987585
Energy: 1.2932164721684312
Energy: 1.2107078878925746
Energy: 1.2986893813622251
Energy: 1.145036921030671
Energy: 1.29868938136062
Energy: 1.1846339649050386
Energy: 1.277172956424235
Energy: 1.159722213453955
Energy: 1.2771729564266425
Energy: 1.161363413680363
Energy: 1.2811835789259425
Energy: 1.230942774888205
Energy: 1.281183578926745
Energy: 1.2019539681175637
Energy: 1.2972643633060779
Energy: 1.1444769992943113
Energy: 1.2972643633068803
Energy: 1.1938996459237126
Energy: 1.357384791853457
Energy: 1.1867819376815794
Energy: 1.357384791853457
Energy: 1.1440034065433173
Energy: 1.276658668969838
Energy: 1.249395227570794
Energy: 1.2766586689706403
Energy: 1.225443477517448
Energy: 1.3180946636817006
Energy: 1.2014242744407162
Energy: 1.3180946636817006
Energy: 1.2723468027116815
Energy: 1.2962135009446978
Energy: 1.1985997441901857
Energy: 1.2962135009463027
Energy: 1.2306287615173257
Energy: 1.2864556352564156
Energy: 1.2053029169596674
Energy: 1.2864556352556134
Energy: 1.1848875602468634
Energy: 1.2783180761775146
Energy: 1.2058397104550256
Energy: 1.2783180761783168
Energy: 1.1980771109754422
Energy: 1.3076188841645238
Energy: 1.1830919569063
Energy: 1.3076188841661285

minimum gb energy = 1.084310978252409 eV
minimum distance =  2.21999339274473 Angstroms
sigma value = 1


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

Energy: 1.3502267890536
Energy: 1.3749764087828589
Energy: 1.3289217459796088
Energy: 1.374976408781944
Energy: 1.258455001702833
Energy: 1.3411796892127807
Energy: 1.2525442281804524
Energy: 1.341179689207291
Energy: 1.1927591177165693
Energy: 1.3683569917611995
Energy: 1.2518117892843956
Energy: 1.3683569917621146
Energy: 1.1924972573473636
Energy: 1.232998600828244
Energy: 1.1999544899748404
Energy: 1.2329986008236693
Energy: 1.1925137891439073
Energy: 1.3460020282110696
Energy: 1.2424334092859228
Energy: 1.3460020282147296
Energy: 1.2716063699358942
Energy: 1.346801294077721
Energy: 1.236114670597076
Energy: 1.3468012940786362
Energy: 1.255773495112326
Energy: 1.2318015319695437
Energy: 1.2000157921132155
Energy: 1.2318015319622242
Energy: 1.1283119557751398
Energy: 1.369388846949856
Energy: 1.1945762104540079
Energy: 1.3693888469535156
Energy: 1.2118222741400655
Energy: 1.275242655592689
Energy: 1.2524687069454523
Energy: 1.2752426555945187
Energy: 1.1914796598646589
Energy: 1.3684993923409816
Energy: 1.1322074447700023
Energy: 1.3684993923354918
Energy: 1.2570131627802463
Energy: 1.3086588689128968
Energy: 1.252715678907606
Energy: 1.308658868915642
Energy: 1.167408020814313
Energy: 1.3589707280456738
Energy: 1.251951160655567
Energy: 1.3589707280465886
Energy: 1.275441849621541
Energy: 1.345504777220146
Energy: 1.2533531770513813
Energy: 1.345504777220146
Energy: 1.2695943887498093
Energy: 1.3455329355131365
Energy: 1.2420128273856954
Energy: 1.3455329355131365
Energy: 1.1674364110761721
Energy: 1.3590344441077407
Energy: 1.2522952309983062
Energy: 1.3590344441013358
Energy: 1.2570306886572324
Energy: 1.3086421381789757
Energy: 1.2527347719043613
Energy: 1.308642138174401
Energy: 1.1915178595003852
Energy: 1.3680267887170316
Energy: 1.1474255235748385
Energy: 1.3680267887115423
Energy: 1.2117173797952054
Energy: 1.2749936898288081
Energy: 1.2524613976627768
Energy: 1.2749936898315528
Energy: 1.1283165765803815
Energy: 1.3694505878275844
Energy: 1.1946344042116164
Energy: 1.3694505878184349
Energy: 1.2559927464306788
Energy: 1.231907174560472
Energy: 1.207172491384087
Energy: 1.2319071745522374
Energy: 1.2711634083812842
Energy: 1.3467871694728237
Energy: 1.1944181856091736
Energy: 1.346787169468249
Energy: 1.1924816258217148
Energy: 1.346218880931665
Energy: 1.2564591445495752
Energy: 1.3462188809353246
Energy: 1.1925805435060401
Energy: 1.2339063500596998
Energy: 1.1997931127357844
Energy: 1.2339063500496767
Energy: 1.192711055290201
Energy: 1.3684041234449253
Energy: 1.2520272610793233
Energy: 1.3684041234503734
Energy: 1.2585011795397298
Energy: 1.3411662417682182
Energy: 1.2525644286337665
Energy: 1.3411662417691335
Energy: 1.3502267890536
Energy: 1.3749764087828589
Energy: 1.3101850059782467
Energy: 1.374976408781944
Energy: 1.2584550017064926
Energy: 1.3411796892127807
Energy: 1.2525442281813672
Energy: 1.341179689207291
Energy: 1.1927591177165693
Energy: 1.3683569917611995
Energy: 1.2518117892843956
Energy: 1.3683569917621146
Energy: 1.192497257345534
Energy: 1.232998600828244
Energy: 1.2014102460393052
Energy: 1.2329986008227545

minimum gb energy = 1.1283119557751398 eV
minimum distance =  2.21575268522142 Angstroms
sigma value = 25


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

Energy: 1.3006383907547954
Energy: 1.4306154430656248
Energy: 1.4126561366787673
Energy: 1.4306154430656248
Energy: 1.336300916349184
Energy: 1.3795908542976156
Energy: 1.2646413940770094
Energy: 1.3795908542976156
Energy: 1.238692828813537
Energy: 1.4753952444883227
Energy: 1.2724085567730796
Energy: 1.4753952444883227
Energy: 1.2563214038768866
Energy: 1.3907708666108194
Energy: 1.2459892802435404
Energy: 1.3907708666108194
Energy: 1.2477830390726916
Energy: 1.43281287750217
Energy: 1.3078135899774703
Energy: 1.4328128775032336
Energy: 1.358602521504327
Energy: 1.4751594599749485
Energy: 1.336181442731241
Energy: 1.4751594599749485
Energy: 1.2645537172859225
Energy: 1.2774202515653128
Energy: 1.2834198015472047
Energy: 1.2774202515642492
Energy: 1.4096614571504125
Energy: 1.432316091592586
Energy: 1.194554814105076
Energy: 1.4323160915915225
Energy: 1.2833297086291735
Energy: 1.3712371149887657
Energy: 1.264207940462631
Energy: 1.3712371149887657
Energy: 1.266400830872403
Energy: 1.4757492555576246
Energy: 1.2264069188777598
Energy: 1.4757492555597518
Energy: 1.320081236248043
Energy: 1.431273959359555
Energy: 1.2647455685761615
Energy: 1.4312739593606185
Energy: 1.2471739185887438
Energy: 1.431293143127212
Energy: 1.2654396021198868
Energy: 1.4312931431261486
Energy: 1.2723084526635087
Energy: 1.3834058537864005
Energy: 1.231999018627059
Energy: 1.383405853787464
Energy: 1.2838761043061884
Energy: 1.3554914081661678
Energy: 1.265795047269748
Energy: 1.3554914081661678
Energy: 1.2019392723140665
Energy: 1.4309607455117903
Energy: 1.1916776331561927
Energy: 1.4309607455117903
Energy: 1.2652434083534165
Energy: 1.2805084105295135
Energy: 1.2445208759704993
Energy: 1.2805084105295135
Energy: 1.1731088331654203
Energy: 1.474633222523316
Energy: 1.172902286232391
Energy: 1.474633222523316
Energy: 1.2460748166631086
Energy: 1.3850539824889976
Energy: 1.2566734916534736
Energy: 1.3850539824889976
Energy: 1.244079849882685
Energy: 1.3851103327018581
Energy: 1.2480281579461598
Energy: 1.3851103327018581
Energy: 1.249729820737878
Energy: 1.4742599185414709
Energy: 1.2645609106313522
Energy: 1.4742599185404073
Energy: 1.2934558986945435
Energy: 1.359909626895184
Energy: 1.2646324646668914
Energy: 1.359909626895184
Energy: 1.3025699949241003
Energy: 1.4316788023776275
Energy: 1.341463286155598
Energy: 1.431678802378691
Energy: 1.2649968821414779
Energy: 1.3814008550065153
Energy: 1.2650868827388444
Energy: 1.3814008550075787
Energy: 1.2347098356437236
Energy: 1.4781155634566552
Energy: 1.2666860974788938
Energy: 1.4781155634566552
Energy: 1.2651467200110627
Energy: 1.3893472111614733
Energy: 1.24510443995563
Energy: 1.3893472111614733

minimum gb energy = 1.172902286232391 eV
minimum distance =  2.21387577867695 Angstroms
sigma value = 9


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

Energy: 1.3606896958137404
Energy: 1.360049409404238
Energy: 1.5106680366089562
Energy: 1.360049409404238
Energy: 1.337198663958174
Energy: 1.4524092435060176
Energy: 1.3510797119657816
Energy: 1.4524092435060176
Energy: 1.2306649725797305
Energy: 1.3646536470818649
Energy: 1.3519009687735344
Energy: 1.3646536470869401
Energy: 1.3653015520260872
Energy: 1.4802132024498245
Energy: 1.259966524356577
Energy: 1.4802132024485555
Energy: 1.451528938514776
Energy: 1.4512006113244293
Energy: 1.3542574069577655
Energy: 1.4512006113231606
Energy: 1.2151770229539443
Energy: 1.3648351857646166
Energy: 1.260264757962007
Energy: 1.3648351857658854
Energy: 1.358442429017918
Energy: 1.2605100342090756
Energy: 1.2608333248451578
Energy: 1.260510034205298
Energy: 1.356392014788173
Energy: 1.364711817278554
Energy: 1.2466708846174441
Energy: 1.3647118172823602
Energy: 1.359421058288685
Energy: 1.4520483525406713
Energy: 1.3543596134285982
Energy: 1.4520483525381338
Energy: 1.3647686477433465
Energy: 1.3599761834185988
Energy: 1.2597556720622691
Energy: 1.3599761834173298
Energy: 1.2856896459950173
Energy: 1.4418144024098525
Energy: 1.3520415975491917
Energy: 1.44181440241239
Energy: 1.3655721983031062
Energy: 1.430517643941641
Energy: 1.2597409072216066
Energy: 1.43051764394291
Energy: 1.2151356513330123
Energy: 1.3602299122725154
Energy: 1.261109531646482
Energy: 1.3602299122725154
Energy: 1.3362773897947091
Energy: 1.364042073161941
Energy: 1.3517149910840867
Energy: 1.3640420731632101
Energy: 1.2151402333039742
Energy: 1.360198151419368
Energy: 1.2280820203464118
Energy: 1.3601981514180992
Energy: 1.3655658148382537
Energy: 1.430504975013091
Energy: 1.259741168127692
Energy: 1.4305049750105532
Energy: 1.2857113579026953
Energy: 1.4417779502071464
Energy: 1.3520384340593206
Energy: 1.4417779502071464
Energy: 1.3648133289306899
Energy: 1.3601246693355364
Energy: 1.259690164204197
Energy: 1.36012466933173
Energy: 1.3593110244270925
Energy: 1.4519174769694703
Energy: 1.335359365487924
Energy: 1.4519174769720082
Energy: 1.3563931260315991
Energy: 1.3645726461689698
Energy: 1.246685798674863
Energy: 1.364572646167701
Energy: 1.3584778080689575
Energy: 1.260518865287165
Energy: 1.2607679368274471
Energy: 1.260518865283359

minimum gb energy = 1.2151356513330123 eV
minimum distance =  2.30612991638487 Angstroms
sigma value = 25


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

Energy: 1.2959838398149035
Energy: 1.4785353119689462
Energy: 1.6455836977961102
Energy: 1.4785353119705156
Energy: 1.2711840689614948
Energy: 1.4544657757402224
Energy: 1.2541048807353379
Energy: 1.4544657757402224
Energy: 1.254577314455637
Energy: 1.4855986491345268
Energy: 1.253972704406148
Energy: 1.485598649136096
Energy: 1.2955305486974682
Energy: 1.4620659239889064
Energy: 1.4424307072946354
Energy: 1.4620659239889064
Energy: 1.4382283425064601
Energy: 1.2715494551835822
Energy: 1.2545292266236612
Energy: 1.2715494551835822
Energy: 1.2589149258445387
Energy: 1.5679649061083625
Energy: 1.2571728698800197
Energy: 1.5679649061083625
Energy: 1.2545364671551316
Energy: 1.4559066843566602
Energy: 1.254313030198143
Energy: 1.4559066843566602
Energy: 1.4391109541174165
Energy: 1.4776198184476177
Energy: 1.29557435720544
Energy: 1.477619818450756
Energy: 1.2541721664573913
Energy: 1.4541512236729677
Energy: 1.2745028190888388
Energy: 1.4541512236729677
Energy: 1.4952590675525794
Energy: 1.488467066219707
Energy: 1.2550519186364206
Energy: 1.4884670662212762
Energy: 1.3612993404482936
Energy: 1.5449203295388652
Energy: 1.6047349395916197
Energy: 1.5449203295372964
Energy: 1.2547783242606543
Energy: 1.3138266563961793
Energy: 1.4933069456252837
Energy: 1.3138266563993175
Energy: 1.428913812309262
Energy: 1.4872534091018983
Energy: 1.2539141790873845
Energy: 1.4872534091034677
Energy: 1.2541747947777078
Energy: 1.4589620373221996
Energy: 1.2959312561761211
Energy: 1.4589620373237686
Energy: 1.2541919539790523
Energy: 1.5441789096419056
Energy: 1.434058268790842
Energy: 1.5441789096403724
Energy: 1.2713111751036905
Energy: 1.4008200566922306
Energy: 1.2588546913803076
Energy: 1.4008200566922306
Energy: 1.2545779090419218
Energy: 1.3835035981865913
Energy: 1.4919567880912488
Energy: 1.3835035981865913

minimum gb energy = 1.2539141790873845 eV
minimum distance =  2.28912230983553 Angstroms
sigma value = 17


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

Energy: 1.4213886556401902
Energy: 1.4209629861813973
Energy: 1.6874857799852514
Energy: 1.4209629861813973
Energy: 1.476561747723944
Energy: 1.386016679895679
Energy: 1.2903984051374517
Energy: 1.3860166798965674
Energy: 1.4520628027661957
Energy: 1.4121613333201903
Energy: 1.2899913841543629
Energy: 1.4121613333201903
Energy: 1.2923513254057177
Energy: 1.4213192356702153
Energy: 1.3995645005549748
Energy: 1.4213192356702153
Energy: 1.4976773801593353
Energy: 1.5171006998090668
Energy: 1.3496590265254247
Energy: 1.5171006998090668
Energy: 1.3085308353497014
Energy: 1.3478616852269918
Energy: 1.4446387525622666
Energy: 1.3478616852269918
Energy: 1.295848276323353
Energy: 1.4455310406799782
Energy: 1.2908863454433406
Energy: 1.4455310406799782
Energy: 1.4456378583594618
Energy: 1.4206893399182239
Energy: 1.305552379874399
Energy: 1.4206893399173353
Energy: 1.3093409431390162
Energy: 1.4921645098204204
Energy: 1.5029172252912135
Energy: 1.4921645098221978
Energy: 1.5970262425052053
Energy: 1.3945052997463223
Energy: 1.2906582983254231
Energy: 1.3945052997463223
Energy: 1.2963843367915817
Energy: 1.4211036367380288
Energy: 1.456559869069989
Energy: 1.4211036367380288
Energy: 1.306792655094625
Energy: 1.4419326052966084
Energy: 1.306384744605368
Energy: 1.441932605297497
Energy: 1.4706137463996667
Energy: 1.4204794834433645
Energy: 1.4198618164885548
Energy: 1.4204794834406986
Energy: 1.2902658526841255
Energy: 1.476341965852828
Energy: 1.4658746496065944
Energy: 1.4763419658537165
Energy: 1.4198395715316299
Energy: 1.444940732704579
Energy: 1.3087748206434795
Energy: 1.4449407327036907
Energy: 1.4524027146681648
Energy: 1.4208005772320553
Energy: 1.4463032181423086
Energy: 1.4208005772302779
Energy: 1.2912949864482564
Energy: 1.4869453079089845
Energy: 1.6090251489667842
Energy: 1.486945307907207
Energy: 1.4440873750883885
Energy: 1.4115384330808762
Energy: 1.308547935707593
Energy: 1.411538433081765
Energy: 1.2914981714202975
Energy: 1.4874791491546204
Energy: 1.3809167478865256
Energy: 1.4874791491546204
Energy: 1.2907589472047196
Energy: 1.421722939057997
Energy: 1.293237075333458
Energy: 1.42172293905622
Energy: 1.368725637016873
Energy: 1.4124862086020702
Energy: 1.4516578790767543
Energy: 1.4124862086020702
Energy: 1.2912497489548522
Energy: 1.5377669639789204
Energy: 1.5971916158909085
Energy: 1.5377669639789204
Energy: 1.48794709561082
Energy: 1.4215473462880683
Energy: 1.2905394707415865
Energy: 1.4215473462871797
Energy: 1.3063340615647043
Energy: 1.4450811467989095
Energy: 1.4689355605611691
Energy: 1.4450811467989095
Energy: 1.306160918029554
Energy: 1.4126634707939756
Energy: 1.4663760095871923
Energy: 1.4126634707975303
Energy: 1.4904619082050121
Energy: 1.421023248550872
Energy: 1.2920816714292596
Energy: 1.4210232485499836
Energy: 1.325933196465034
Energy: 1.4927118502943293
Energy: 1.6396891523875259
Energy: 1.4927118502934407
Energy: 1.4454232526193773
Energy: 1.3488447056125403
Energy: 1.4531294020187204
Energy: 1.3488447056125403
Energy: 1.547012278410935
Energy: 1.48103477476992
Energy: 1.2957099584043474
Energy: 1.4810347747734744
Energy: 1.3057637879304969
Energy: 1.4902862052952368
Energy: 1.4436170050261143
Energy: 1.4902862052943482

minimum gb energy = 1.2899913841543629 eV
minimum distance =  2.1945873169891 Angstroms
sigma value = 53


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

Energy: 1.227123659717402
Energy: 1.226816232776234
Energy: 1.7843002153821503
Energy: 1.226816232776234
Energy: 1.486443043099352
Energy: 1.3479562164808105
Energy: 1.2889713798646953
Energy: 1.3479562164808105
Energy: 1.2282592088837885
Energy: 1.226344282976845
Energy: 1.3623956785474056
Energy: 1.2263442829747988
Energy: 1.2279302847602351
Energy: 1.2262747495659627
Energy: 1.3627342378536127
Energy: 1.2262747495659627
Energy: 1.4865535448366105
Energy: 1.3478364953554531
Energy: 1.2888584581145466
Energy: 1.3478364953554531
Energy: 1.227123659719448
Energy: 1.226816232776234
Energy: 1.6048656716376588
Energy: 1.226816232776234
Energy: 1.486443043099352
Energy: 1.3479562164787646
Energy: 1.3631062797240057
Energy: 1.3479562164808105
Energy: 1.2282592088837885
Energy: 1.2263442829788906
Energy: 1.4621927016608338
Energy: 1.226344282976845
Energy: 1.2279302847602351
Energy: 1.2262747495659627
Energy: 1.4419497262930958
Energy: 1.226274749567962
Energy: 1.4865535448325187
Energy: 1.3478364953554531
Energy: 1.3936715495494802
Energy: 1.347836495353407
Energy: 1.227123659715356
Energy: 1.226816232776234
Energy: 1.6684784313654124
Energy: 1.226816232776234
Energy: 1.486443043099352
Energy: 1.3479562164808105
Energy: 1.440538290199921
Energy: 1.3479562164808105
Energy: 1.2282592088837885
Energy: 1.2263442829788906
Energy: 1.4621927016649254
Energy: 1.226344282976845

minimum gb energy = 1.2262747495659627 eV
minimum distance =  2.27063635849422 Angstroms
sigma value = 9


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

Energy: 1.358120708934424
Energy: 1.5379660448219794
Energy: 1.7795465251156075
Energy: 1.5379660448219794
Energy: 1.5271003986934295
Energy: 1.4291357787580525
Energy: 1.368808174647878
Energy: 1.4291357787550236
Energy: 1.3420060429823046
Energy: 1.342395212460504
Energy: 1.3601203095931933
Energy: 1.3423952124635328
Energy: 1.4895180417475156
Energy: 1.6017842692512365
Energy: 1.3734120960859137
Energy: 1.6017842692504791
Energy: 1.5166889552308487
Energy: 1.4253624395867102
Energy: 1.3649124014572105
Energy: 1.4253624395874676
Energy: 1.3422570151298894
Energy: 1.3414438686042063
Energy: 1.5024602288485958
Energy: 1.3414438686042063
Energy: 1.7304506717329702
Energy: 1.4196348230082099
Energy: 1.3700986747669917
Energy: 1.4196348230097242
Energy: 1.3508907074511958
Energy: 1.447469277996759
Energy: 1.50426844515532
Energy: 1.447469277996002
Energy: 1.345516183703322
Energy: 1.6166558356095544
Energy: 1.355585168559228
Energy: 1.6166558356118261
Energy: 1.3444895101790653
Energy: 1.421915247301603
Energy: 1.3602588916192193
Energy: 1.4219152473038745
Energy: 1.353227027715234
Energy: 1.4462614458588936
Energy: 1.71092788296676
Energy: 1.4462614458596508
Energy: 1.5262448636075898
Energy: 1.5509348391039897
Energy: 1.3502865728505393
Energy: 1.550934839101718
Energy: 1.3462791300834747
Energy: 1.4464660386502444
Energy: 1.6149171894507404
Energy: 1.44646603864873
Energy: 1.4923396311414707
Energy: 1.4472185316783568
Energy: 1.3665943181094227
Energy: 1.4472185316775996
Energy: 1.355110656644307
Energy: 1.5187991693493461
Energy: 1.5002160572519583
Energy: 1.5187991693501035
Energy: 1.3516363872515802
Energy: 1.6143993346872765
Energy: 1.4949066053074145
Energy: 1.6143993346887908
Energy: 1.424960408428694
Energy: 1.5188424612924551
Energy: 1.3547899861926385
Energy: 1.5188424612924551
Energy: 1.3576666510605262
Energy: 1.4197024070584192
Energy: 1.5126286889443712
Energy: 1.4197024070584192
Energy: 1.5068502146005027
Energy: 1.352663876215151
Energy: 1.345394242638547
Energy: 1.352663876215908
Energy: 1.3508348077632246
Energy: 1.4388442806676485
Energy: 1.4406821796631528
Energy: 1.43884428066992
Energy: 1.4958384494982233
Energy: 1.6024570439177173
Energy: 1.490221816955616
Energy: 1.602457043915446
Energy: 1.4605559567319757
Energy: 1.5193761346784875
Energy: 1.3438375851872555
Energy: 1.5193761346800019
Energy: 1.3495196304300163
Energy: 1.3559267151315844
Energy: 1.3451569331759816
Energy: 1.3559267151277983
Energy: 1.7302650849402217
Energy: 1.4440986855288833
Energy: 1.350319682795769
Energy: 1.444098685528126
Energy: 1.3690544759712993
Energy: 1.5655745548459667
Energy: 1.6474077234452187
Energy: 1.565574554843695
Energy: 1.4180717034123316
Energy: 1.3419745137113166
Energy: 1.3429787434205502
Energy: 1.3419745137120738
Energy: 1.5051784991190271
Energy: 1.5243057549352645
Energy: 1.4888969381295012
Energy: 1.5243057549345074
Energy: 1.356159300731948
Energy: 1.6015533554552686
Energy: 1.4894510615854932
Energy: 1.6015533554537538
Energy: 1.428653526401388
Energy: 1.3417146680044618
Energy: 1.3415753169817812
Energy: 1.3417146680059762
Energy: 1.3602152594360026
Energy: 1.564056490193143
Energy: 1.6447140305833372
Energy: 1.5640564901916287
Energy: 1.5107966057006972
Energy: 1.4433858065613858
Energy: 1.349334345884662
Energy: 1.443385806562143
Energy: 1.3684635212614786
Energy: 1.423873520208064
Energy: 1.3431949155101206
Energy: 1.4238735202073065
Energy: 1.3609132309904315
Energy: 1.5166982435701217
Energy: 1.3421807452132135
Energy: 1.5166982435708791
Energy: 1.501909568330665
Energy: 1.60378161087177
Energy: 1.4900119845192152
Energy: 1.6037816108702554
Energy: 1.3648195592441228
Energy: 1.5716199647477234
Energy: 1.7300651812465906
Energy: 1.5716199647484803

minimum gb energy = 1.3414438686042063 eV
minimum distance =  2.21067807871004 Angstroms
sigma value = 73


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

Energy: 1.4447957391745052
Energy: 1.4431795971328516
Energy: 1.7895277953324864
Energy: 1.4431795971340533
Energy: 1.4568074745218391
Energy: 1.481939507126565
Energy: 1.373804304250009
Energy: 1.4819395071277663
Energy: 1.367313770514295
Energy: 1.3483912499548079
Energy: 1.376176076105075
Energy: 1.348391249952405
Energy: 1.3507176772241944
Energy: 1.3679963810995832
Energy: 1.3940198959325276
Energy: 1.367996381100785
Energy: 1.426856076644699
Energy: 1.4770030530693394
Energy: 1.4176402657165423
Energy: 1.4770030530693394
Energy: 1.3789537320605567
Energy: 1.3800178553044584
Energy: 1.5934103903739514
Energy: 1.3800178552996527
Energy: 1.7107975163663307
Energy: 1.5529679802179686
Energy: 1.37790000969328
Energy: 1.5529679802167673
Energy: 1.3533792748953093
Energy: 1.34703020468468
Energy: 1.6013461060481802
Energy: 1.3470302046858813
Energy: 1.6619832448349903
Energy: 1.3484481786236744
Energy: 1.346842131655304
Energy: 1.3484481786248756
Energy: 1.370103868988748
Energy: 1.4719501671724518
Energy: 1.3708299970943625
Energy: 1.4719501671712503
Energy: 1.3507031217717662
Energy: 1.3485776487090728
Energy: 1.5865041989445456
Energy: 1.3485776487102743
Energy: 1.511222376506144
Energy: 1.367699688245819
Energy: 1.3514351735339665
Energy: 1.3676996882481947
Energy: 1.3757474993212275
Energy: 1.4546170573570145
Energy: 1.5951369111299305
Energy: 1.454617057355813
Energy: 1.6325857935251789
Energy: 1.5377776520498665
Energy: 1.3784114602459474
Energy: 1.537777652051068
Energy: 1.350708327836079
Energy: 1.5791487479970747
Energy: 1.5836913400935766
Energy: 1.5791487479994775
Energy: 1.5899464831119268
Energy: 1.3477280732859633
Energy: 1.3538196651117924
Energy: 1.3477280732859633
Energy: 1.46007744675908
Energy: 1.4464938118375743
Energy: 1.3670208540387865
Energy: 1.4464938118387758
Energy: 1.4512208324831304
Energy: 1.3682117623759025
Energy: 1.3670018620853854
Energy: 1.3682117623771042
Energy: 1.515423471515855
Energy: 1.3470403430716227
Energy: 1.3516786100823563
Energy: 1.3470403430716227
Energy: 1.3744241934264334
Energy: 1.5068335956341825
Energy: 1.6948930204466748
Energy: 1.506833595632981
Energy: 1.6141211960537711
Energy: 1.3599001116049052
Energy: 1.3779004491249394
Energy: 1.3599001116049052
Energy: 1.3948314133019926
Energy: 1.4835829110826826
Energy: 1.5291199397514517
Energy: 1.483582911085085

minimum gb energy = 1.346842131655304 eV
minimum distance =  2.22934264270953 Angstroms
sigma value = 7


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

Energy: 1.3880008920345568
Energy: 1.3869002693426804
Energy: 1.7938260819946745
Energy: 1.3869002693435297
Energy: 1.6835308454864757
Energy: 1.4733620416091733
Energy: 1.3844268617984985
Energy: 1.4733620416168187
Energy: 1.358782832705166
Energy: 1.3871085981954177
Energy: 1.3857267635384862
Energy: 1.3871085981945679
Energy: 1.408347928893706
Energy: 1.4846340111886929
Energy: 1.3845361996243175
Energy: 1.484634011187843
Energy: 1.359553702865492
Energy: 1.460410642416227
Energy: 1.4046906541773152
Energy: 1.4604106424153778
Energy: 1.36212253158021
Energy: 1.3889595290783847
Energy: 1.6405445887148562
Energy: 1.388959529088579
Energy: 1.5237541492027147
Energy: 1.529644657368879
Energy: 1.4092723300247645
Energy: 1.529644657368879
Energy: 1.3620197833031962
Energy: 1.388466859006192
Energy: 1.69132567053369
Energy: 1.388466859001095
Energy: 1.542459908332359
Energy: 1.4676198763115722
Energy: 1.3758275356786622
Energy: 1.467619876314121
Energy: 1.3642182195508912
Energy: 1.4994898410015576
Energy: 1.5043838292003746
Energy: 1.4994898410049555
Energy: 1.4137051449244875
Energy: 1.3887012753663444
Energy: 1.4077809298493895
Energy: 1.3887012753697423
Energy: 1.4240341236531397
Energy: 1.4615113444503094
Energy: 1.4076297032703269
Energy: 1.4615113444486103
Energy: 1.3870195195852681
Energy: 1.391349681979534
Energy: 1.4090043671064052
Energy: 1.3913496819769853
Energy: 1.3981658568572717
Energy: 1.3791098382653864
Energy: 1.40654876427917
Energy: 1.3791098382653864
Energy: 1.3713243364962668
Energy: 1.601444741778921
Energy: 1.5354688100190856
Energy: 1.6014447417806201
Energy: 1.766808068606198
Energy: 1.378329735733295
Energy: 1.3719996144139202
Energy: 1.3783297357264988
Energy: 1.3717422602077074
Energy: 1.4664643540287483
Energy: 1.4435974689606232
Energy: 1.4664643540295978
Energy: 1.3925081410028872
Energy: 1.579009778209065
Energy: 1.4072648892255142
Energy: 1.5790097782073662
Energy: 1.3721348152910124
Energy: 1.3892596585367283
Energy: 1.4087206924349218
Energy: 1.389259658542675
Energy: 1.364165459369893
Energy: 1.4600809549614295
Energy: 1.4080427946535015
Energy: 1.4600809549673763
Energy: 1.4141000666669605
Energy: 1.5869610076439093
Energy: 1.3758571839660905
Energy: 1.5869610076490064
Energy: 1.3625278885664935
Energy: 1.3870281319296756
Energy: 1.5056799870983697
Energy: 1.3870281319262778
Energy: 1.6564543135332943
Energy: 1.467508902151366
Energy: 1.4076362527569648
Energy: 1.467508902151366
Energy: 1.3927555560576015
Energy: 1.3886615911488434
Energy: 1.639821135727959
Energy: 1.3886615911522415
Energy: 1.4140515822303226
Energy: 1.4607553869240752
Energy: 1.4092519993723611
Energy: 1.4607553869181287
Energy: 1.408935160216084
Energy: 1.3879341765355622
Energy: 1.400837345955118
Energy: 1.3879341765364117
Energy: 1.3592430455874498
Energy: 1.4918211893887963
Energy: 1.5208395215254025
Energy: 1.4918211893777529
Energy: 1.4085246290878006
Energy: 1.4662621387249852
Energy: 1.3846315636082434
Energy: 1.4662621387393886
Energy: 1.358228285030828
Energy: 1.3873516498741534
Energy: 1.560828822522865
Energy: 1.3873516498758525
Energy: 1.3902949297909653
Energy: 1.4028040049046422
Energy: 1.3838912657245828
Energy: 1.402804004910589
Energy: 1.3582470050325353
Energy: 1.3875036085756003
Energy: 1.62676778825226
Energy: 1.3875036085756003

minimum gb energy = 1.358228285030828 eV
minimum distance =  2.21248114564221 Angstroms
sigma value = 29


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

Energy: 1.353154863407401
Energy: 1.3335596800172411
Energy: 1.798552235260155
Energy: 1.3335596800183918
Energy: 1.300686083182169
Energy: 1.3577223018956963
Energy: 1.3546553169046662
Energy: 1.3577223018945457
Energy: 1.3658558773680813
Energy: 1.417930070346335
Energy: 1.2998119737445086
Energy: 1.417930070346039
Energy: 1.3549429146444643
Energy: 1.303491780113109
Energy: 1.3812956673474157
Energy: 1.3034917801145556
Energy: 1.3536545390130827
Energy: 1.3874393334986974
Energy: 1.3647618925162395
Energy: 1.3874393334992563
Energy: 1.347032915816526
Energy: 1.4184285114059259
Energy: 1.3467092409360093
Energy: 1.41842851140563
Energy: 1.3348971548978819
Energy: 1.3875652248816344
Energy: 1.353642276589408
Energy: 1.387565224882226
Energy: 1.3099738033257997
Energy: 1.303618565896474
Energy: 1.3547569117759946
Energy: 1.303618565897362
Energy: 1.2998048949530132
Energy: 1.4179365360171743
Energy: 1.2996429431526095
Energy: 1.4179365360157274

minimum gb energy = 1.2996429431526095 eV
minimum distance =  2.26720322846059 Angstroms
sigma value = 5


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

Energy: 1.3083997073258873
Energy: 1.3274616128894277
Energy: 1.761764143766296
Energy: 1.3274616128886252
Energy: 1.4906344129598021
Energy: 1.3548087165050076
Energy: 1.2648364567341124
Energy: 1.3548087165042049
Energy: 1.276787256524044
Energy: 1.3174766257901478
Energy: 1.5017191169623065
Energy: 1.3174766257901478
Energy: 1.2677093004015736
Energy: 1.3874737684840466
Energy: 1.2775545673021105
Energy: 1.3874737684856513
Energy: 1.288627986274736
Energy: 1.3956333914027028
Energy: 1.5164122914389486
Energy: 1.395633391399493
Energy: 1.3252760593042496
Energy: 1.329734155784852
Energy: 1.2638234297271997
Energy: 1.3297341557840499
Energy: 1.2743589970307907
Energy: 1.3931308569954752
Energy: 1.2910255149980212
Energy: 1.3931308569986853
Energy: 1.2710191934824084
Energy: 1.3314744774067644
Energy: 1.2817321842401215
Energy: 1.3314744774083693
Energy: 1.288806990150252
Energy: 1.3932199238130916
Energy: 1.2769423980365482
Energy: 1.393219923812289
Energy: 1.2838465283926948
Energy: 1.393756104361493
Energy: 1.268440407963713
Energy: 1.393756104359888
Energy: 1.3030820459412127
Energy: 1.330641971378299
Energy: 1.2813646734270223
Energy: 1.3306419713758915
Energy: 1.2809884810591416
Energy: 1.4086009232903716
Energy: 1.3290125170026543
Energy: 1.4086009232903716
Energy: 1.322657186919738
Energy: 1.3289124988482293
Energy: 1.3319417550077537
Energy: 1.328912498846624
Energy: 1.2888314032249406
Energy: 1.328315868380651
Energy: 1.3433817335634226
Energy: 1.3283158683814535
Energy: 1.5180296290363637
Energy: 1.3898814704592797
Energy: 1.2810354282389775
Energy: 1.389881470457675
Energy: 1.280006634780618
Energy: 1.3169975343933549
Energy: 1.3028528073776968
Energy: 1.3169975343941576
Energy: 1.4932824891395668
Energy: 1.4123318039504205
Energy: 1.2636278549870688
Energy: 1.4123318039488155
Energy: 1.2918315485616907
Energy: 1.3283980150198884
Energy: 1.4166560717713583
Energy: 1.3283980150206907
Energy: 1.2699472879970308
Energy: 1.396058383138406
Energy: 1.266263213856809
Energy: 1.396058383136801
Energy: 1.2750927122755
Energy: 1.3853742351859202
Energy: 1.2964562530486659
Energy: 1.3853742351819078
Energy: 1.2677365826200178
Energy: 1.3856155758776372
Energy: 1.2797140121484145
Energy: 1.3856155758784394
Energy: 1.2906009679952297
Energy: 1.3935360159773278
Energy: 1.294993787538464
Energy: 1.3935360159773278
Energy: 1.264208113801858
Energy: 1.3303603115971896
Energy: 1.2666617526584847
Energy: 1.3303603115971896
Energy: 1.3270242458245596
Energy: 1.333485429063277
Energy: 1.2763602282532516
Energy: 1.3334854290616722
Energy: 1.336382994567719
Energy: 1.3164960504349377
Energy: 1.2643480103773979
Energy: 1.3164960504365426
Energy: 1.3133175142019462
Energy: 1.3285818621660743
Energy: 1.2889803360158776
Energy: 1.3285818621660743
Energy: 1.2640304099207176
Energy: 1.3773302653366488
Energy: 1.3118789728839886
Energy: 1.377330265335044
Energy: 1.3426669253976036
Energy: 1.3660543603406234
Energy: 1.2802674108563161
Energy: 1.3660543603406234
Energy: 1.2805394699567505
Energy: 1.3567233069716595
Energy: 1.513498503812617
Energy: 1.3567233069732645
Energy: 1.4152005088407387
Energy: 1.3279576741168089
Energy: 1.2913801764702173
Energy: 1.327957674119216
Energy: 1.2640508096671015
Energy: 1.2961972463767961
Energy: 1.413832964909292
Energy: 1.2961972463759937
Energy: 1.5080789942596198
Energy: 1.3615224634490402
Energy: 1.277036855267145
Energy: 1.3615224634530525
Energy: 1.280923257085149
Energy: 1.386726450372663
Energy: 1.268377733835907
Energy: 1.3867264503734655

minimum gb energy = 1.2636278549870688 eV
minimum distance =  2.21351145459513 Angstroms
sigma value = 1


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

Energy: 1.2711927728256083
Energy: 1.2706838857769727
Energy: 1.7603776059699205
Energy: 1.2706838857791918
Energy: 1.2660047029761978
Energy: 1.2951846632228825
Energy: 1.2148301999077717
Energy: 1.295184663219554
Energy: 1.2083652154627662
Energy: 1.2710051806677547
Energy: 1.4254720005710018
Energy: 1.2710051806610976
Energy: 1.2343535311383675
Energy: 1.3546904448632695
Energy: 1.2166388515749358
Energy: 1.35469044486216
Energy: 1.206386164245828
Energy: 1.3990234077535635
Energy: 1.4977856212412732
Energy: 1.3990234077580015
Energy: 1.2043450790959254
Energy: 1.2752456449989913
Energy: 1.21689676884449
Energy: 1.2752456450012104
Energy: 1.2062233533222315
Energy: 1.397800796106242
Energy: 1.2598100043757994
Energy: 1.3978007961084609
Energy: 1.205823691484192
Energy: 1.2751500224230072
Energy: 1.3006113354536963
Energy: 1.2751500224207881
Energy: 1.2703910531525249
Energy: 1.2684612234721024
Energy: 1.2712001243997038
Energy: 1.2684612234676644
Energy: 1.2703670165093377
Energy: 1.2682964668142418
Energy: 1.3005707147951797
Energy: 1.2682964668131325
Energy: 1.2058263911210498
Energy: 1.2751279840563214
Energy: 1.2449351388287782
Energy: 1.27512798405854
Energy: 1.2065143531713065
Energy: 1.3977597776174793
Energy: 1.2597906817316504
Energy: 1.3977597776208077
Energy: 1.204335384326041
Energy: 1.2752956701582192
Energy: 1.2168549117361593
Energy: 1.2752956701548908
Energy: 1.2064098204653078
Energy: 1.3962623018677707
Energy: 1.5082737810609528
Energy: 1.3962623018655516
Energy: 1.2339145706802457
Energy: 1.3544348445687686
Energy: 1.2166562570627772
Energy: 1.3544348445676588
Energy: 1.2086748457752239
Energy: 1.2709688522214662
Energy: 1.3388662094269448
Energy: 1.2709688522247948
Energy: 1.2659126645523209
Energy: 1.2953448879254417
Energy: 1.2148187451970562
Energy: 1.2953448879243323
Energy: 1.2711927728256083
Energy: 1.2706838857769727
Energy: 1.2911718824869738
Energy: 1.2706838857791918
Energy: 1.2660047029761978
Energy: 1.2951846632228825
Energy: 1.2148301999077717
Energy: 1.295184663219554
Energy: 1.2083652154627662
Energy: 1.2710051806677547
Energy: 1.6670733543237892
Energy: 1.2710051806610976
Energy: 1.2343535311383675
Energy: 1.3546904448632695
Energy: 1.2166388515738262
Energy: 1.35469044486216
Energy: 1.206386164245828
Energy: 1.399023407752454
Energy: 1.4769803796489847
Energy: 1.3990234077580015
Energy: 1.2043450790948158
Energy: 1.2752456449989913
Energy: 1.2168967688455998
Energy: 1.2752456450012104
Energy: 1.2062233533222315
Energy: 1.397800796106242
Energy: 1.2342691597404176
Energy: 1.3978007961084609

minimum gb energy = 1.204335384326041 eV
minimum distance =  2.23491221068799 Angstroms
sigma value = 17


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

Energy: 1.262250136641119
Energy: 1.2622124035216837
Energy: 1.739774767686135
Energy: 1.2622124035230553
Energy: 1.436238387499456
Energy: 1.2462172255847508
Energy: 1.2231015386670854
Energy: 1.2462172255840647
Energy: 1.2187028455460214
Energy: 1.24574625751067
Energy: 1.5035904003225644
Energy: 1.2457462575120413
Energy: 1.2657567590495629
Energy: 1.2081995079511192
Energy: 1.209776222610007
Energy: 1.208199507951805
Energy: 1.2112950836169756
Energy: 1.3465686406920434
Energy: 1.2468059227632866
Energy: 1.3465686406920434
Energy: 1.206573536831942
Energy: 1.2260819879789386
Energy: 1.233781895338536
Energy: 1.226081987981682
Energy: 1.2257809244112259
Energy: 1.3245523972093123
Energy: 1.2487029183059946
Energy: 1.3245523972079405
Energy: 1.2046755879861724
Energy: 1.3142915670969757
Energy: 1.2135347895518984
Energy: 1.3142915670969757
Energy: 1.2593773011894944
Energy: 1.3090333671042407
Energy: 1.247318732694586
Energy: 1.309033367106298
Energy: 1.2456635732066181
Energy: 1.3111144052957366
Energy: 1.2216976812907037
Energy: 1.3111144052957366
Energy: 1.2184711673122857
Energy: 1.2849938729178905
Energy: 1.2150753898448106
Energy: 1.2849938729172046
Energy: 1.2214397866247753
Energy: 1.3162737743919348
Energy: 1.2118752314916905
Energy: 1.3162737743926205
Energy: 1.2050856979172704
Energy: 1.2992923499051212
Energy: 1.2226990697226254
Energy: 1.299292349905807
Energy: 1.2212834865406337
Energy: 1.3449021828948564
Energy: 1.2614486316465108
Energy: 1.344902182896228
Energy: 1.2028527713909212
Energy: 1.2220422473424442
Energy: 1.2731862102112843
Energy: 1.2220422473479307
Energy: 1.2187171879692185
Energy: 1.2469777842208163
Energy: 1.236214314188014
Energy: 1.2469777842215024
Energy: 1.2401992750191522
Energy: 1.2214993370532283
Energy: 1.222820729890115
Energy: 1.2214993370532283
Energy: 1.2104793023195097
Energy: 1.262342644903196
Energy: 1.22385401607275
Energy: 1.2623426449045676
Energy: 1.396399333463845
Energy: 1.319690863429698
Energy: 1.2189793423779347
Energy: 1.3196908634262692
Energy: 1.228926109895786
Energy: 1.2462267269436913
Energy: 1.2851255222926015
Energy: 1.2462267269450629
Energy: 1.423590276139893
Energy: 1.2351896119584895
Energy: 1.2129219926900352
Energy: 1.2351896119598613
Energy: 1.2112885703192475
Energy: 1.2626697519512922
Energy: 1.3692409553432714
Energy: 1.262669751954035
Energy: 1.2543020672734964
Energy: 1.2257896207971117
Energy: 1.2307661992532315
Energy: 1.225789620796426
Energy: 1.2185811549733168
Energy: 1.3272129805866133
Energy: 1.4141378513951781
Energy: 1.3272129805852417
Energy: 1.2451330920137207
Energy: 1.2632021252887886
Energy: 1.2124072118968614
Energy: 1.2632021252901604
Energy: 1.2098180132617133
Energy: 1.3482366445002232
Energy: 1.2372255178898746
Energy: 1.3482366445002232
Energy: 1.4109182144727075
Energy: 1.3015038985518155
Energy: 1.2190500211532593
Energy: 1.3015038985490721
Energy: 1.2785998914918615
Energy: 1.4444098973801878
Energy: 1.201929364514594
Energy: 1.4444098973808737
Energy: 1.2612916873767313
Energy: 1.3441437068527557
Energy: 1.212130960424187
Energy: 1.3441437068520699
Energy: 1.2094289138029264
Energy: 1.2984418030958313
Energy: 1.2717356217644593
Energy: 1.2984418030944596
Energy: 1.2137033089364977
Energy: 1.343965550623028
Energy: 1.219964092520278
Energy: 1.3439655506237138
Energy: 1.2016785989652814
Energy: 1.2819344817382836
Energy: 1.2135694634203964
Energy: 1.281934481741027
Energy: 1.218889567078312
Energy: 1.3113783069972849
Energy: 1.4412209111237828
Energy: 1.3113783069952276
Energy: 1.283218143820945
Energy: 1.4636855471227403
Energy: 1.2317683609976942
Energy: 1.4636855471213692
Energy: 1.2178065911754097
Energy: 1.2643486566012683
Energy: 1.256253649024816
Energy: 1.2643486566005824
Energy: 1.2587720637105246
Energy: 1.3266206334313764
Energy: 1.2236810273336045
Energy: 1.3266206334306907
Energy: 1.230965213077511
Energy: 1.2273600503010642
Energy: 1.2098012574686026
Energy: 1.227360050294892
Energy: 1.2383981129344683
Energy: 1.348812443474296
Energy: 1.211758242341945
Energy: 1.348812443474982

minimum gb energy = 1.2016785989652814 eV
minimum distance =  2.22307042160872 Angstroms
sigma value = 89


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

Energy: 1.1170880599615294
Energy: 1.11701996029313
Energy: 1.5090327727839423
Energy: 1.1170199602949247
Energy: 1.1325509877844273
Energy: 1.1566709530228614
Energy: 1.1351153252993003
Energy: 1.1566709530228614
Energy: 1.1325538049744817
Energy: 1.3329015206985955
Energy: 1.850144779443629
Energy: 1.3329015206985955
Energy: 1.1138136972889738
Energy: 1.1566156201981468
Energy: 1.1351156534473956
Energy: 1.1566156201981468
Energy: 1.135497710967504
Energy: 1.2391439551914303
Energy: 1.1408216262856075
Energy: 1.239143955189636
Energy: 1.1175952549842854
Energy: 1.118363061411694
Energy: 1.1206410297296554
Energy: 1.118363061413488
Energy: 1.1325900887717082
Energy: 1.3329969301341353
Energy: 1.134079113486353
Energy: 1.3329969301359297
Energy: 1.135399376694718
Energy: 1.3327265732361466
Energy: 1.1350913175207742
Energy: 1.3327265732361466
Energy: 1.1338980468900535
Energy: 1.2390950925973547
Energy: 1.1159364192640036
Energy: 1.2390950925955604
Energy: 1.1568078793046168
Energy: 1.118212127429536
Energy: 1.1204901261054594
Energy: 1.1182121274331247
Energy: 1.1166127175673966
Energy: 1.1579149560575501
Energy: 1.1320238672323848
Energy: 1.1579149560575501
Energy: 1.11694031485821
Energy: 1.3337702435820311
Energy: 1.1354744093464755
Energy: 1.3337702435820311
Energy: 1.1185952711109015
Energy: 1.1207091296491436
Energy: 1.1315012520393852
Energy: 1.1207091296491436
Energy: 1.1195004117731344
Energy: 1.235578225718021
Energy: 1.1204931811803698
Energy: 1.2355782257198153
Energy: 1.1159639498053215
Energy: 1.120576761886764
Energy: 1.118749668569427
Energy: 1.120576761886764

minimum gb energy = 1.1138136972889738 eV
minimum distance =  2.24595167519198 Angstroms
sigma value = 13


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

Energy: 1.1183301170157478
Energy: 1.074928781642115
Energy: 1.6683107643534327
Energy: 1.074928781642867
Energy: 1.1584599393917758
Energy: 1.1028769175791564
Energy: 1.0687961038094225
Energy: 1.1028769175814128
Energy: 1.076459642184587
Energy: 1.0753566352718875
Energy: 1.2901220700187805
Energy: 1.0753566352771522
Energy: 1.0801050617098096
Energy: 1.103374056520179
Energy: 1.0624661879091089
Energy: 1.1033740565209313
Energy: 1.089778577279958
Energy: 1.1663693445111722
Energy: 1.0854705621930967
Energy: 1.1663693445036514
Energy: 1.0622794927636743
Energy: 1.1042791091006638
Energy: 1.0912080988268331
Energy: 1.1042791090976556
Energy: 1.082695682744906
Energy: 1.1672808385544964
Energy: 1.2601397455005992
Energy: 1.1672808385552484
Energy: 1.0539760595257583
Energy: 1.1033765691585158
Energy: 1.0911175469485768
Energy: 1.1033765691472348
Energy: 1.0830421541686561
Energy: 1.1671859162630196
Energy: 1.363455485549236
Energy: 1.1671859162615155
Energy: 1.2873909790422655
Energy: 1.1900643306736272
Energy: 1.0627738111553517
Energy: 1.19006433067814
Energy: 1.0825615599105138
Energy: 1.1921346680236489
Energy: 1.0713928199470786
Energy: 1.1921346680198883
Energy: 1.0995175795793786
Energy: 1.1903547455863763
Energy: 1.0619072673350047
Energy: 1.190354745592393
Energy: 1.1310773649564847
Energy: 1.0954904420199543
Energy: 1.0696540477855652
Energy: 1.0954904420207063
Energy: 1.4850892115159195
Energy: 1.1907380546613342
Energy: 1.0619562283952773
Energy: 1.1907380546635904
Energy: 1.0826373254578874
Energy: 1.0748977403429953
Energy: 1.0681543702292213
Energy: 1.074897740351952
Energy: 1.095119667504994
Energy: 1.1911153968245685
Energy: 1.068772724289265
Energy: 1.1911153968268249
Energy: 1.0951283456084018
Energy: 1.1595414467865384
Energy: 1.066931816232042
Energy: 1.1595414467865384
Energy: 1.085761903756141
Energy: 1.1634494545502527
Energy: 1.0873834363438433
Energy: 1.163449454552509
Energy: 1.0951079954151959
Energy: 1.096170405890009
Energy: 1.1040635827831378
Energy: 1.096170405890009
Energy: 1.0951646865104194
Energy: 1.0971383832394639
Energy: 1.0878785321408286
Energy: 1.0971383832447286
Energy: 1.0858329651148642
Energy: 1.1635695950174607
Energy: 1.0872312508862587
Energy: 1.1635695950189648
Energy: 1.0949628459823806
Energy: 1.1594808180500464
Energy: 1.0655211810249656
Energy: 1.1594808180598237
Energy: 1.0951206666728677
Energy: 1.191093070562403
Energy: 1.0679956214922266
Energy: 1.191093070554882
Energy: 1.0826417598835572
Energy: 1.0748639653408398
Energy: 1.0716040443025732
Energy: 1.074863965341592
Energy: 1.484892663358931
Energy: 1.1907025246397398
Energy: 1.0619884240855169
Energy: 1.1907025246404919
Energy: 1.1300577390870594
Energy: 1.095614617862133
Energy: 1.0716738016077805
Energy: 1.095614617862133
Energy: 1.0996283801591047
Energy: 1.1903373402864346
Energy: 1.061838205722462
Energy: 1.190337340280418
Energy: 1.0895240007866163
Energy: 1.1920407258717378
Energy: 1.0721287124191938
Energy: 1.1920407258664734
Energy: 1.2877401226877114
Energy: 1.1902115805850266
Energy: 1.062756216574182
Energy: 1.1902115805775741
Energy: 1.0829922267454493
Energy: 1.167445286362154
Energy: 1.451057615165978
Energy: 1.1674452863696747
Energy: 1.0537047121746215
Energy: 1.103308673833512
Energy: 1.0910988652339844
Energy: 1.103308673832008
Energy: 1.0829487435321767
Energy: 1.1671951718280547
Energy: 1.2597040315963586
Energy: 1.1671951718160212
Energy: 1.0624326627368679
Energy: 1.1042001184679457
Energy: 1.0910174679779123
Energy: 1.1042001184619972
Energy: 1.0827582688243202
Energy: 1.1664235603293367
Energy: 1.0827915573910427
Energy: 1.166423560330841
Energy: 1.0797595861245195
Energy: 1.1031025375283188
Energy: 1.062542805862275
Energy: 1.1031025375388477

minimum gb energy = 1.0537047121746215 eV
minimum distance =  2.2602359075046 Angstroms
sigma value = 37


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

Energy: 1.0255332031047752
Energy: 1.0247085072445152
Energy: 1.643875249502724
Energy: 1.0247085072432214
Energy: 1.0454143396266768
Energy: 1.0243810680192822
Energy: 0.9796578130869963
Energy: 1.0243810680192822
Energy: 0.9696293690670739
Energy: 1.17008633720856
Energy: 1.6823080313684058
Energy: 1.17008633720856
Energy: 0.9713259408920066
Energy: 1.0245027855255389
Energy: 0.9796800573758274
Energy: 1.024502785524245
Energy: 0.9779114893806785
Energy: 1.024307858503358
Energy: 1.0042325804880363
Energy: 1.024307858503358
Energy: 0.9690819542659671
Energy: 1.0244029812229285
Energy: 0.9729677832303949
Energy: 1.0244029812229285
Energy: 0.9811595142040174
Energy: 1.2095172591162155
Energy: 1.3058460716720077
Energy: 1.2095172591162155
Energy: 0.9710137119757271
Energy: 1.0257049643822613
Energy: 1.028631167909717
Energy: 1.0257049643822613
Energy: 0.978144550171018
Energy: 1.0246420340696347
Energy: 1.4803923528525034
Energy: 1.0246420340696347
Energy: 1.382038275429058
Energy: 1.1522583963781603
Energy: 0.9731839138064942
Energy: 1.1522583963755721
Energy: 0.9788372888590539
Energy: 1.0769274155707262
Energy: 0.9780289992474194
Energy: 1.0769274155707262
Energy: 1.3590591546095296
Energy: 1.0247578243673947
Energy: 0.9796879881135235
Energy: 1.0247578243673947
Energy: 0.9695253658241131
Energy: 1.0252406940167356
Energy: 0.9827503209699476
Energy: 1.0252406940180294
Energy: 1.3053170485451404
Energy: 1.077432752024124
Energy: 0.970149191388825
Energy: 1.0774327520305935
Energy: 1.0241548809030687
Energy: 1.0778146579984496
Energy: 0.9704181886362028
Energy: 1.0778146579997434
Energy: 1.0246640694714222
Energy: 1.0249204413971766
Energy: 0.979628705004039
Energy: 1.0249204413984705
Energy: 0.9694980969939826
Energy: 1.1536151637513523
Energy: 0.9693123272595936
Energy: 1.1536151637500582
Energy: 0.9792680651513499
Energy: 1.1992224422139726
Energy: 0.9788210891565055
Energy: 1.1992224422139726
Energy: 0.9790093300110653
Energy: 1.0263835107253243
Energy: 0.9702331567877683
Energy: 1.0263835107253243
Energy: 0.9697885392931429
Energy: 1.025123619992378
Energy: 0.9694612607073794
Energy: 1.025123619993672

minimum gb energy = 0.9690819542659671 eV
minimum distance =  2.26340244274767 Angstroms
sigma value = 25


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

Energy: 0.9544587737722644
Energy: 0.8992363372667458
Energy: 1.5682754052993464
Energy: 0.8992363372667458
Energy: 1.1689124342242965
Energy: 0.9219168583652727
Energy: 0.9037601831107314
Energy: 0.9219168583662829
Energy: 0.8951515501857688
Energy: 0.8947608830896622
Energy: 1.2224532105928754
Energy: 0.8947608830886519
Energy: 0.9051247102384374
Energy: 0.9229086147205531
Energy: 0.9034367114723885
Energy: 0.9229086147195428
Energy: 0.9023430605255849
Energy: 0.9221610171248218
Energy: 0.9043602051333178
Energy: 0.9221610171258322
Energy: 0.8694791209262286
Energy: 0.9231730562765311
Energy: 0.9004425249149062
Energy: 0.9231730562755207
Energy: 0.9028203665510579
Energy: 0.8951022586306112
Energy: 0.9068752266073938
Energy: 0.8951022586306112
Energy: 0.8686133462336082
Energy: 0.9539297993055579
Energy: 0.8969143175774991
Energy: 0.9539297993045474
Energy: 0.9021879596467843
Energy: 0.9219899997771009
Energy: 1.2968610555505031
Energy: 0.9219899997781111
Energy: 0.8691788506884454
Energy: 0.900007179320045
Energy: 0.9562432441256057
Energy: 0.9000071793180243
Energy: 0.9028506924946615
Energy: 0.8949405118575666
Energy: 1.3989566928449684
Energy: 0.8949405118555458
Energy: 1.196730719752195
Energy: 1.0655999334802695
Energy: 0.8969850500838871
Energy: 1.0655999334802695
Energy: 0.9022439523543541
Energy: 0.9226657227465616
Energy: 1.2724308566080726
Energy: 0.9226657227465616
Energy: 1.1935060772064985
Energy: 1.0015832185558202
Energy: 0.9003886164847427
Energy: 1.0015832185568305
Energy: 0.9033461331409197
Energy: 0.8949890557162359
Energy: 0.868790516301384
Energy: 0.8949890557152256
Energy: 1.1910242973830798
Energy: 1.0646912941892546
Energy: 0.9006458137211182
Energy: 1.0646912941902653
Energy: 0.9022620775301067
Energy: 0.9536864908126292
Energy: 0.876328587703792
Energy: 0.9536864908156604
Energy: 1.1740267791284904
Energy: 0.9220689846496055
Energy: 0.9003574817499833
Energy: 0.9220689846496055
Energy: 0.9614536614122335
Energy: 0.8948782126410616
Energy: 0.8691077839160971
Energy: 0.8948782126420721
Energy: 1.403190548323551
Energy: 1.0594945346734133
Energy: 0.9009796529770486
Energy: 1.0594945346744236
Energy: 0.9023385179078884
Energy: 1.0568905543261151
Energy: 0.8699439251959765
Energy: 1.0568905543240943
Energy: 0.8951358122642122
Energy: 0.9224324078841162
Energy: 0.9003622317450048
Energy: 0.9224324078851265
Energy: 0.9036513879286477
Energy: 0.9982187065564055
Energy: 1.1932551500058282
Energy: 0.9982187065564055
Energy: 0.8747568571577613
Energy: 1.0600695642773064
Energy: 0.9007569271770125
Energy: 1.0600695642762958
Energy: 0.9008112078400055
Energy: 1.0576983586551159
Energy: 1.19090495237194
Energy: 1.0576983586541056
Energy: 0.868483164181628
Energy: 0.9536181278934553
Energy: 0.8945866708822419
Energy: 0.9536181278934553

minimum gb energy = 0.868483164181628 eV
minimum distance =  2.27137242938877 Angstroms
sigma value = 41


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

Energy: 1.2492156625238025
Energy: 0.8420022592642473
Energy: 0.8191578083793309
Energy: 0.842002259265904
Energy: 1.2673544716732965
Energy: 0.821465892746613
Energy: 0.8111015919384789
Energy: 0.8214658927432995
Energy: 0.8397035263120308
Energy: 0.808300731058323
Energy: 0.7929188023210463
Energy: 0.8083007310574946
Energy: 1.0463352969345006
Energy: 0.8225352814104419
Energy: 0.8111934547947863
Energy: 0.8225352814120985
Energy: 0.8056830412500184
Energy: 0.8647479298827659
Energy: 0.8259604563783703
Energy: 0.8647479298835943
Energy: 0.8263309838444262
Energy: 0.8225486829159234
Energy: 0.8112624049974353
Energy: 0.8225486829134384
Energy: 0.8100699075218429
Energy: 0.8218789610248135
Energy: 0.8273981168491444
Energy: 0.8218789610272987
Energy: 0.7919223204507982
Energy: 0.8404372059439278
Energy: 0.8068583472644139
Energy: 0.8404372059439278
Energy: 0.8142844642974675
Energy: 0.8422654189424107
Energy: 1.154289337019953
Energy: 0.8422654189407539
Energy: 0.7984384736102266
Energy: 0.8088141890611961
Energy: 0.8409079644125935
Energy: 0.8088141890636813
Energy: 0.8102612080879341
Energy: 0.8217895033212436
Energy: 1.4214344415331057
Energy: 0.8217895033204152
Energy: 0.7919050961159109
Energy: 0.842678726755704
Energy: 1.2496689744970724
Energy: 0.8426787267565323
Energy: 0.8144312524529967
Energy: 0.8443387442304718
Energy: 1.5162478718380898
Energy: 0.8443387442279867
Energy: 1.0587651183712674
Energy: 0.9276097743681113
Energy: 0.8408056653332316
Energy: 0.9276097743581712
Energy: 0.8102578421037167
Energy: 0.8218637260798175
Energy: 1.2334738598015842
Energy: 0.8218637260798175
Energy: 1.0620942800277824
Energy: 0.843774460111282
Energy: 0.8069590023558472
Energy: 0.8437744601079686
Energy: 0.8143575343511577
Energy: 0.8408464347193813
Energy: 1.14171132993092
Energy: 0.8408464347202096
Energy: 1.0594165045777038
Energy: 0.9272117086147322
Energy: 0.8111160954260712
Energy: 0.9272117086131508
Energy: 0.8103126960748341
Energy: 0.8406991752013875
Energy: 0.7918839931376054
Energy: 0.8406991752030442
Energy: 1.0720684547506223
Energy: 0.8437617377267896
Energy: 0.8143005045516024
Energy: 0.8437617377284464
Energy: 0.8440893921058035
Energy: 0.8410356728270962
Energy: 0.7930700935381
Energy: 0.841035672828753
Energy: 1.4259876877397946
Energy: 0.949537759477024
Energy: 0.8111953107499764
Energy: 0.949537759477024
Energy: 1.2515943031976855
Energy: 0.8397821655516938
Energy: 0.7921659415066427
Energy: 0.8397821655525223
Energy: 1.2700327390933543
Energy: 0.8427374257298662
Energy: 0.8140021247394282
Energy: 0.8427374257315229
Energy: 0.8443709466503797
Energy: 0.9297330105898632
Energy: 0.7957467750145583
Energy: 0.9297330105898632
Energy: 1.2462685117691306
Energy: 0.8651351727905253
Energy: 0.8114469394670409
Energy: 0.8651351727905253
Energy: 0.8103873845787765
Energy: 0.8408550814210344
Energy: 1.0617136455140794
Energy: 0.8408550814210344
Energy: 0.8118098706161855
Energy: 0.8410114663639351
Energy: 0.8139661959533885
Energy: 0.8410114663647634
Energy: 0.8140808645120131
Energy: 0.9300197128502549
Energy: 1.063117906547274
Energy: 0.9300197128502549
Energy: 0.7972786675430352
Energy: 1.1667197607978037
Energy: 0.8154288842599067
Energy: 1.166719760798632
Energy: 0.8177548797376207
Energy: 0.8408079919213285
Energy: 1.0719739856193309
Energy: 0.8408079919229852
Energy: 0.7916212578540802
Energy: 0.8410453095964493
Energy: 0.8492036481316401
Energy: 0.8410453096560911

minimum gb energy = 0.7916212578540802 eV
minimum distance =  2.25819540563839 Angstroms
sigma value = 15


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

Energy: 1.1346062150884835
Energy: 0.766853273989651
Energy: 1.4760960360924347
Energy: 0.7668532739861422
Energy: 1.2969843213493288
Energy: 0.7629255531293309
Energy: 0.7639905885892313
Energy: 0.7629255531293309
Energy: 0.7929368860001259
Energy: 0.7620415008082102
Energy: 1.460525068953857
Energy: 0.7620415008068068
Energy: 1.1403220815118846
Energy: 0.7639615908030486
Energy: 0.7639405914282834
Energy: 0.7639615908016452
Energy: 0.7604675806474407
Energy: 0.8442243268193901
Energy: 0.7641482717372241
Energy: 0.8442243268179865
Energy: 1.1099828823183153
Energy: 0.7633596330083112
Energy: 0.763927505835997
Energy: 0.7633596330048026
Energy: 0.7632748136821118
Energy: 0.7783460633288992
Energy: 0.7630067795100223
Energy: 0.7783460633366185
Energy: 0.9217297180652636
Energy: 0.7771570011357238
Energy: 0.763912651802075
Energy: 0.7771570011364256
Energy: 0.76583781419521
Energy: 0.7787883727013634
Energy: 1.0440488837071298
Energy: 0.7787883727006617
Energy: 0.7317805138659014
Energy: 0.7621601644294752
Energy: 0.7611658935576623
Energy: 0.7621601644294752
Energy: 0.7632475546582286
Energy: 0.7637557454781473
Energy: 1.1410790800640407
Energy: 0.7637557454781473
Energy: 0.73329555677275
Energy: 0.7625253153766702
Energy: 0.793636955272178
Energy: 0.7625253153766702
Energy: 0.765992607396871
Energy: 0.7792346847547548
Energy: 1.5125794446887693
Energy: 0.7792346847540531
Energy: 0.7314772616273494
Energy: 0.7670611332497995
Energy: 1.1351106706271692
Energy: 0.7670611332610272
Energy: 0.7633045437326549
Energy: 0.7634117614667985
Energy: 1.4423201499173532
Energy: 0.763411761465395
Energy: 0.9553365199270364
Energy: 0.7624113938460841
Energy: 0.7937402191970734
Energy: 0.7624113938432772
Energy: 0.7660698100259373
Energy: 0.7781931272576088
Energy: 1.3604927096130948
Energy: 0.7781931272548019
Energy: 0.961393848914844
Energy: 0.8428716890195015
Energy: 0.7611749671611359
Energy: 0.842871689009677
Energy: 0.763436637969731
Energy: 0.7618332477812119
Energy: 1.1092630370098422
Energy: 0.7618332477798084
Energy: 0.9746988055955985
Energy: 0.7629532785455588
Energy: 0.7638477099578846
Energy: 0.7629532785455588
Energy: 0.7657672381989662
Energy: 0.7947507735182073
Energy: 1.0167800931672937
Energy: 0.7947507735168039
Energy: 0.9696503829320511
Energy: 0.7768952114367618
Energy: 0.7694018128103244
Energy: 0.7768952114367618
Energy: 0.7632494924700198
Energy: 0.761707575471222
Energy: 0.731574838022604
Energy: 0.761707575474029
Energy: 1.3328799553434107
Energy: 0.7633278173657398
Energy: 0.7639007842250846
Energy: 0.7633278173643363
Energy: 0.7958951723154124
Energy: 0.7938280022562171
Energy: 0.7361454171635343
Energy: 0.7938280022583223
Energy: 1.3006720967008134
Energy: 0.7769835641161191
Energy: 0.7692631347891074
Energy: 0.7769835641140139
Energy: 1.137089400744263
Energy: 0.7619349923232833
Energy: 0.7315054363653092
Energy: 0.7619349923281954
Energy: 1.4419971069630269
Energy: 0.7639866922505395
Energy: 0.7640178224025587
Energy: 0.7639866922568552
Energy: 0.7956692501749992
Energy: 0.8742615246560674
Energy: 0.7335200873431346
Energy: 0.8742615246560674
Energy: 1.1391092331667905
Energy: 0.7777345637350103
Energy: 0.7694373894076386
Energy: 0.7777345637371155
Energy: 0.7632865430638088
Energy: 0.8353274184269326
Energy: 0.9811475628690889
Energy: 0.8353274184227222
Energy: 1.1234019259787675
Energy: 0.7612752237420652
Energy: 0.7639411325468012
Energy: 0.7612752237441704
Energy: 0.7660718088672331
Energy: 0.8672207779699356
Energy: 0.9629625617057974
Energy: 0.8672207779664269
Energy: 0.742936813631675
Energy: 0.7936862749500155
Energy: 0.7695603402698964
Energy: 0.7936862749500155
Energy: 0.7450174454589605
Energy: 0.835403650206423
Energy: 0.9701553306937165
Energy: 0.8354036502071248
Energy: 0.7540524819741921
Energy: 0.7614645286859975
Energy: 0.7669237821006878
Energy: 0.761464528684594
Energy: 0.7661803599433575
Energy: 0.8751775452545401
Energy: 1.333092160427487
Energy: 0.8751775452566453

minimum gb energy = 0.7314772616273494 eV
minimum distance =  2.26015098770278 Angstroms
sigma value = 85


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

Energy: 1.0662569048764263
Energy: 0.7464190971610266
Energy: 1.420330566931401
Energy: 0.7464190971610266
Energy: 1.3247139446698337
Energy: 0.74077684740306
Energy: 0.7013360138083029
Energy: 0.7407768474036687
Energy: 1.0228838601086374
Energy: 0.7405356804206705
Energy: 0.6608238280614558
Energy: 0.7405356804212792
Energy: 1.186855635125496
Energy: 0.7408010174260917
Energy: 0.7011765970907987
Energy: 0.7408010174267002
Energy: 0.7388812274417534
Energy: 0.6991962079772996
Energy: 0.7152023359037846
Energy: 0.6991962079766911
Energy: 1.1351063494117493
Energy: 0.7413007962096048
Energy: 0.7013600459903533
Energy: 0.7413007962065616
Energy: 0.6976731423025935
Energy: 0.7655664331994394
Energy: 0.7153121180132205
Energy: 0.7655664332000479
Energy: 0.9929140985547945
Energy: 0.7394956991242492
Energy: 0.7011998993046556
Energy: 0.7394956991266837
Energy: 0.7005713097962748
Energy: 0.7182624653864945
Energy: 0.9584537333174824
Energy: 0.7182624653864945
Energy: 0.8254827783622931
Energy: 0.7651441602322164
Energy: 0.698434099681374
Energy: 0.7651441602316079
Energy: 0.7031482047515542
Energy: 0.7406176229309409
Energy: 1.0467188589506262
Energy: 0.7406176229303324
Energy: 0.6593906407687333
Energy: 0.7395084052829644
Energy: 0.7396036107829679
Energy: 0.7395084052762696
Energy: 0.7004581876598566
Energy: 0.7172495853018033
Energy: 1.2456665547756511
Energy: 0.7172495853018033
Energy: 0.6635162473749341
Energy: 0.7407638044260423
Energy: 1.0235217631252702
Energy: 0.740763804424825
Energy: 0.701514130182473
Energy: 0.7407770795681059
Energy: 1.417765251970184
Energy: 0.7407770795681059
Energy: 0.6591447349577935
Energy: 0.746327956210657
Energy: 1.066723683371066
Energy: 0.746327956210657
Energy: 0.7006316446914128
Energy: 0.7171883433141385
Energy: 1.4811931898318957
Energy: 0.717188343314747
Energy: 0.7885339845504404
Energy: 0.7408401204731786
Energy: 1.0236988314117215
Energy: 0.7408401204731786
Energy: 0.7016695672785851
Energy: 0.7406653103685177
Energy: 1.277003509764731
Energy: 0.7406653103709523
Energy: 0.859150023670652
Energy: 0.7461511582873297
Energy: 0.739657875835704
Energy: 0.7461511582879383
Energy: 0.7006273525308452
Energy: 0.7170646324470856
Energy: 1.2015923603140184
Energy: 0.7170646324470856
Energy: 0.858224670248837
Energy: 0.7409885085604906
Energy: 0.6985318808713102
Energy: 0.7409885085610991
Energy: 0.7014917539168596
Energy: 0.7391234538903918
Energy: 0.992708635248629
Energy: 0.7391234538897831
Energy: 0.8701914843226481
Energy: 0.7687067572847182
Energy: 0.7014708547685747
Energy: 0.7687067572853268
Energy: 0.7006872815427543
Energy: 0.7390469352359514
Energy: 0.9079561355217456
Energy: 0.7390469352359514
Energy: 1.186213156678654
Energy: 0.7408535475254199
Energy: 0.7020672382262714
Energy: 0.7408535475223768
Energy: 0.7417228647639241
Energy: 0.739129071810513
Energy: 0.6590781041088403
Energy: 0.7391290718092958
Energy: 1.1995872077071423
Energy: 0.768980843797372
Energy: 0.7012661561221913
Energy: 0.768980843797372
Energy: 1.0253100641123694
Energy: 0.7412235632372703
Energy: 0.6632021327248225
Energy: 0.7412235632342273
Energy: 1.417865020922794
Energy: 0.7409616417981383
Energy: 0.7016643551540797
Energy: 0.7409616417981383
Energy: 1.0684550052397896
Energy: 0.7389120162655831
Energy: 0.6591816030546219
Energy: 0.7389120162655831
Energy: 1.303188617985836
Energy: 0.7650500526721604
Energy: 0.7014637236190525
Energy: 0.7650500526691173
Energy: 1.0253944249728986
Energy: 0.7412808723324338
Energy: 0.662334858910189
Energy: 0.7412808723318252
Energy: 1.2768455350191878
Energy: 0.7408339886457489
Energy: 0.7017272379566052
Energy: 0.7408339886475747
Energy: 0.7417427039312916
Energy: 0.739079198279569
Energy: 0.8591534538640173
Energy: 0.7390791982807863
Energy: 1.010615733516126
Energy: 0.7649446878507429
Energy: 0.7012405340396
Energy: 0.7649446878489171
Energy: 0.7007272835536292
Energy: 0.7412227641353493
Energy: 0.8583098544575491
Energy: 0.7412227641365665
Energy: 0.9923834764687967
Energy: 0.7390518891989337
Energy: 0.7022394047993921
Energy: 0.7390518891983252
Energy: 0.7014457497731199
Energy: 0.7389151965478321
Energy: 0.870891624618143
Energy: 0.7389151965466149
Energy: 0.6708531762314808
Energy: 0.7925184787776323
Energy: 0.7010462708400258
Energy: 0.7925184787758063
Energy: 0.7002928323780532
Energy: 0.739026115524333
Energy: 1.1859155375105335
Energy: 0.7390261155249415
Energy: 0.6591020076950166
Energy: 0.7390363167620299
Energy: 0.7390755577583766
Energy: 0.7390363167620299
Energy: 0.703481578978051
Energy: 0.7391206988216158
Energy: 1.1996650956592716
Energy: 0.7391206988222245

minimum gb energy = 0.6590781041088403 eV
minimum distance =  2.27652788023753 Angstroms
sigma value = 113


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

Energy: 0.020728476021841788
Energy: 0.022321057654369324
Energy: 1.3167537455470488
Energy: 0.02232105765395344
Energy: 0.9196724167416043
Energy: 0.42791331897964907
Energy: 0.4286177776986389
Energy: 0.42791331898011703
Energy: 0.020728476021373916
Energy: 0.022321057654369324
Energy: 1.3167537455479845
Energy: 0.02232105765395344
Energy: 0.9196724167420721
Energy: 0.42791331898011703
Energy: 0.42861777769770315
Energy: 0.42791331898011703
Energy: 0.020728476021841788
Energy: 0.022321057654369324
Energy: 1.3167537455470488
Energy: 0.02232105765395344
Energy: 0.9196724167406685
Energy: 0.42791331897964907
Energy: 0.4286177776972353
Energy: 0.42791331898011703

minimum gb energy = 0.020728476021373916 eV
minimum distance =  2.48112895588654 Angstroms
sigma value = 1