Model name: model_name=MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5213917419314393
cohesive_energy=4.450349978305028
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.0 eV

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

Energy: 0.01814658145286788
Energy: 1.4518190785468232
Energy: 0.01814658145286788
Energy: 1.4518190785464926
Energy: 0.01814658145286788
Energy: 1.4518190785468232
Energy: 1.4518190785468232
Energy: 0.7782975823434641
Energy: 1.4518190785464926
Energy: 0.7782975823434641
Energy: 1.4518190785464926
Energy: 0.7782975823434641
Energy: 0.01814658145286788
Energy: 1.4518190785464926
Energy: 0.01814658145286788
Energy: 1.4518190785464926
Energy: 0.01814658145286788
Energy: 1.4518190785468232
Energy: 1.4518190785468232
Energy: 0.7782975823437946
Energy: 1.4518190785464926
Energy: 0.7782975823437946
Energy: 1.4518190785471539
Energy: 0.7782975823434641
Energy: 0.01814658145286788
Energy: 1.4518190785464926
Energy: 0.01814658145286788
Energy: 1.4518190785468232
Energy: 0.01814658145286788
Energy: 1.4518190785464926
Energy: 1.4518190785468232
Energy: 0.7782975823434641
Energy: 1.4518190785464926
Energy: 0.7782975823434641
Energy: 1.4518190785468232
Energy: 0.7782975823437946

minimum gb energy = 0.01814658145286788 eV
minimum distance =  2.45180337461276 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.562267867236534
Energy: 1.4474894602460213
Energy: 1.5622678672373298
Energy: 1.4474894602452257
Energy: 1.5622678672373298
Energy: 1.4474894602460213
Energy: 1.7364346363531051
Energy: 1.3593825784829965
Energy: 1.7364346363531051
Energy: 1.3593825784829965
Energy: 1.7364346363523093
Energy: 1.3593825784829965
Energy: 1.51493445473489
Energy: 1.526623421748515
Energy: 1.51493445473489
Energy: 1.5266234217493109
Energy: 1.5149344547340944
Energy: 1.5266234217493109
Energy: 1.6294908061615774
Energy: 1.4099249914319028
Energy: 1.6294908061623727
Energy: 1.4099249914319028
Energy: 1.6294908061623727
Energy: 1.4099249914326983
Energy: 1.468172969302785
Energy: 1.5894236899741199
Energy: 1.4681729693035808
Energy: 1.5894236899741199
Energy: 1.4681729693035808
Energy: 1.5894236899741199
Energy: 1.5666660162124433
Energy: 1.404315478090326
Energy: 1.566666016213239
Energy: 1.4043154780911213
Energy: 1.5666660162124433
Energy: 1.404315478090326
Energy: 1.4707701797308077
Energy: 1.5315517214134506
Energy: 1.4707701797331942
Energy: 1.5315517214142462
Energy: 1.4707701797308077
Energy: 1.5315517214134506
Energy: 1.4185496820150838
Energy: 1.6418321761023413
Energy: 1.4185496820150838
Energy: 1.6418321761015457
Energy: 1.4185496820158794
Energy: 1.6418321761023413
Energy: 1.5431206725884927
Energy: 1.5356562267983394
Energy: 1.5431206725884927
Energy: 1.5356562267983394
Energy: 1.5431206725876971
Energy: 1.5356562267983394
Energy: 1.3448170164631437
Energy: 1.6224849264169938
Energy: 1.3448170164631437
Energy: 1.6224849264161985
Energy: 1.3448170164631437
Energy: 1.6224849264169938
Energy: 1.7241646723073298
Energy: 1.3937417015065738
Energy: 1.7241646723073298
Energy: 1.3937417015065738
Energy: 1.7241646723073298
Energy: 1.3937417015065738
Energy: 1.3162086765836456
Energy: 1.8426309464269033
Energy: 1.3162086765836456
Energy: 1.8426309464269033
Energy: 1.3162086765836456
Energy: 1.8426309464276986
Energy: 1.6312886696263535
Energy: 1.3115579732749014
Energy: 1.6312886696271491
Energy: 1.3115579732749014
Energy: 1.6312886696279445
Energy: 1.3115579732749014
Energy: 1.416468388391141
Energy: 1.4177865086618988
Energy: 1.4164683883919367
Energy: 1.4177865086626946
Energy: 1.4164683883919367
Energy: 1.4177865086618988
Energy: 1.7258464740060135
Energy: 1.3543319130917888
Energy: 1.7258464740060135
Energy: 1.3543319130925842
Energy: 1.7258464740060135
Energy: 1.3543319130925842
Energy: 1.7245563238235568
Energy: 1.5555393697646855
Energy: 1.7245563238235568
Energy: 1.5555393697646855
Energy: 1.7245563238235568
Energy: 1.5555393697646855
Energy: 1.5149727967900415
Energy: 1.4817248313926654
Energy: 1.5149727967900415
Energy: 1.4817248313926654
Energy: 1.5149727967900415
Energy: 1.4817248313926654
Energy: 1.515091288227894
Energy: 1.4388653994642704
Energy: 1.515091288227894
Energy: 1.4388653994642704
Energy: 1.5150912882270984
Energy: 1.4388653994634746
Energy: 1.3495150299974679
Energy: 1.4128377224331967
Energy: 1.3495150299974679
Energy: 1.412837722433992
Energy: 1.3495150299974679
Energy: 1.4128377224331967
Energy: 1.5448123834063652
Energy: 1.4050012505671898
Energy: 1.5448123834063652
Energy: 1.4050012505663942
Energy: 1.5448123834063652
Energy: 1.4050012505663942
Energy: 1.372365335979104
Energy: 1.8685968679668763
Energy: 1.372365335979104
Energy: 1.8685968679668763
Energy: 1.372365335979104
Energy: 1.8685968679676719
Energy: 1.5241263782884154
Energy: 1.5387539513719857
Energy: 1.5241263782884154
Energy: 1.5387539513727815
Energy: 1.5241263782884154
Energy: 1.5387539513727815
Energy: 1.3322504115306668
Energy: 1.6119985850780514
Energy: 1.3322504115298712
Energy: 1.6119985850780514
Energy: 1.3322504115298712
Energy: 1.6119985850780514

minimum gb energy = 1.3115579732749014 eV
minimum distance =  2.23136535775411 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.8464733122719088
Energy: 1.5697318527851742
Energy: 1.7846181717840452
Energy: 1.569731852786491
Energy: 1.8464733122719088
Energy: 1.569731852786491
Energy: 1.638480876121847
Energy: 1.4294720019192813
Energy: 1.638480876121847
Energy: 1.4294720019192813
Energy: 1.6384808761245624
Energy: 1.4294720019188292
Energy: 1.4198206378824965
Energy: 1.4283650988090637
Energy: 1.4198206378815916
Energy: 1.4283650988086114
Energy: 1.4198206378815916
Energy: 1.4283650988090637
Energy: 1.586671371260457
Energy: 1.6291128248065274
Energy: 1.5866713712618146
Energy: 1.6291128248051698
Energy: 1.5866713712618146
Energy: 1.629112824804717
Energy: 1.5285454917601697
Energy: 1.5095792887940263
Energy: 1.5285454917592647
Energy: 1.5095792887962887
Energy: 1.5285454917601697
Energy: 1.5095792887962887
Energy: 1.386478019169284
Energy: 1.4223731568482743
Energy: 1.3864780191670214
Energy: 1.4223731568482743
Energy: 1.3864780191670214
Energy: 1.4223731568482743
Energy: 1.5899123591271724
Energy: 1.6712661729595457
Energy: 1.5908181895736024
Energy: 1.6712661729599985
Energy: 1.5899125906848406
Energy: 1.6712661729599985
Energy: 1.338388313386056
Energy: 1.779309512835243
Energy: 1.338353320706841
Energy: 1.779309512835243
Energy: 1.3383883133846983
Energy: 1.779309512835243
Energy: 1.3750458369481628
Energy: 1.4242780614542945
Energy: 1.3750458369504253
Energy: 1.4242780614511679
Energy: 1.3750458369521943
Energy: 1.4242780614511679
Energy: 1.3914253457665837
Energy: 1.6594802038021543
Energy: 1.391424955514986
Energy: 1.6594802038035117
Energy: 1.391425345765679
Energy: 1.6594802038030592
Energy: 1.6931800545493256
Energy: 1.3910471655203553
Energy: 1.6931800545502307
Energy: 1.3910471655185452
Energy: 1.693180054549778
Energy: 1.391047165518093
Energy: 1.4197630656548286
Energy: 1.5666413985371832
Energy: 1.419762899413199
Energy: 1.5666413985394456
Energy: 1.4197630656552809
Energy: 1.5666413985394456
Energy: 1.7227934168239032
Energy: 1.3504838169964581
Energy: 1.7227934168216406
Energy: 1.3504838169969104
Energy: 1.7227934168234507
Energy: 1.3504838169969104
Energy: 1.7220500685862086
Energy: 1.568632472261395
Energy: 1.7220500685871136
Energy: 1.5686324722618477
Energy: 1.7220500685871136
Energy: 1.5686324722618477
Energy: 1.58263410272374
Energy: 1.4292107678136567
Energy: 1.58263410272193
Energy: 1.4292107678136567
Energy: 1.58263410272374
Energy: 1.4292107678136567
Energy: 1.4227810536782475
Energy: 1.4288889325598142
Energy: 1.4227810536773426
Energy: 1.4288889325575516
Energy: 1.422781053677795
Energy: 1.4288889325575516
Energy: 1.635473953194223
Energy: 1.551734979258442
Energy: 1.635473953194223
Energy: 1.551734979259306
Energy: 1.6354739531960327
Energy: 1.5517349792588944
Energy: 1.529924221255306
Energy: 1.4228602072817664
Energy: 1.529924221255306
Energy: 1.4228602072790513
Energy: 1.529924221256211
Energy: 1.4228602072795038
Energy: 1.3869144436508305
Energy: 1.4221113101388416
Energy: 1.386914443651283
Energy: 1.4221113101379366
Energy: 1.3869144436490206
Energy: 1.422111310137484
Energy: 1.5916408810590246
Energy: 1.6815276612952248
Energy: 1.591673757640011
Energy: 1.681527661294772
Energy: 1.5916408810567622
Energy: 1.681527661294772
Energy: 1.3448355150450628
Energy: 1.7989158006549286
Energy: 1.3451769458182934
Energy: 1.7989158006558337
Energy: 1.3448355150455156
Energy: 1.7989158006544759
Energy: 1.517408479031004
Energy: 1.42339007250342
Energy: 1.5174084790323614
Energy: 1.4233900725047774
Energy: 1.5174084790323614
Energy: 1.423390072504325
Energy: 1.391190443434655
Energy: 1.6572152278835302
Energy: 1.3911897071635098
Energy: 1.6572152278830774
Energy: 1.39119044343375
Energy: 1.6572152278830774
Energy: 1.7363521067538283
Energy: 1.5315685689020808
Energy: 1.7363521067529233
Energy: 1.5315685689020808
Energy: 1.7363521067497556
Energy: 1.5315685689020808
Energy: 1.4191105597648057
Energy: 1.4029529580437732
Energy: 1.4201181397418499
Energy: 1.4029529580424158
Energy: 1.4191105597657105
Energy: 1.4029529580424158
Energy: 1.7763998484540557
Energy: 1.5704694196159477
Energy: 1.722766763184903
Energy: 1.5704694196186215
Energy: 1.776399848454961
Energy: 1.570469419618169
Energy: 1.7780073059567285
Energy: 1.5843352058348057
Energy: 1.721848848973654
Energy: 1.5843352058339009
Energy: 1.778007305956276
Energy: 1.5843352058334481
Energy: 1.4238005169208723
Energy: 1.4276126944565688
Energy: 1.4238005169199675
Energy: 1.427612694456116
Energy: 1.4238005169167998
Energy: 1.427612694455664
Energy: 1.6561563159104358
Energy: 1.4288346620502796
Energy: 1.6561563159113406
Energy: 1.4288346620520895
Energy: 1.6561563159108883
Energy: 1.4288346620520895
Energy: 1.3907450450504162
Energy: 1.667712299425437
Energy: 1.3907450450495114
Energy: 1.6677122994240798
Energy: 1.3907450450490588
Energy: 1.6677122994240798
Energy: 2.0649590755214766
Energy: 1.425188506869779
Energy: 2.0649590755214766
Energy: 1.4251885068715888
Energy: 2.064959075522834
Energy: 1.4251885068715888
Energy: 1.351056155058349
Energy: 1.348754946630823
Energy: 1.351056155057444
Energy: 1.3487549466222661
Energy: 1.351056155056539
Energy: 1.3487549466222661
Energy: 1.5924663648278776
Energy: 1.6906541402243496
Energy: 1.5925866672643305
Energy: 1.690654140223897
Energy: 1.59246636482652
Energy: 1.690654140223897
Energy: 1.4298821267846318
Energy: 1.5825968061746252
Energy: 1.4298821267846318
Energy: 1.5825968061777929
Energy: 1.4298821267828217
Energy: 1.5825968061777929
Energy: 1.4283791939421264
Energy: 1.4224215323682396
Energy: 1.428379193942579
Energy: 1.4224215323682396
Energy: 1.428379193942579
Energy: 1.4224215323682396
Energy: 1.6203980963897868
Energy: 1.5846295400119013
Energy: 1.6203980963875244
Energy: 1.5846295400119013
Energy: 1.6203980963884292
Energy: 1.5846295400119013
Energy: 1.4356130132204905
Energy: 1.5304612802877369
Energy: 1.4356144315152755
Energy: 1.530461280285927
Energy: 1.4356130132223004
Energy: 1.530461280285927
Energy: 1.4558317500458045
Energy: 1.3853917887354357
Energy: 1.4558317500435418
Energy: 1.3853917887349831
Energy: 1.4558317500430893
Energy: 1.3853917887354357
Energy: 1.7219396942093008
Energy: 1.572551820997539
Energy: 1.7219396942097533
Energy: 1.5725518209952765
Energy: 1.7219396942083958
Energy: 1.5725518209948242
Energy: 1.8010533637428947
Energy: 1.2960766558334127
Energy: 1.8010533637433472
Energy: 1.2960766558325076
Energy: 1.8010533637442525
Energy: 1.2960766558320551
Energy: 1.4199851038988018
Energy: 1.3729334680860985
Energy: 1.419985103899254
Energy: 1.3729334680879086
Energy: 1.4199851039001592
Energy: 1.3729334680879086

minimum gb energy = 1.2960766558320551 eV
minimum distance =  2.32969380022088 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.500309789834154
Energy: 1.5019164115325152
Energy: 1.500309789834154
Energy: 1.5019164115325152
Energy: 1.500309789834154
Energy: 1.5019164115325152
Energy: 1.7410013986557953
Energy: 1.4189582450177856
Energy: 1.7410013986547468
Energy: 1.4189582450177856
Energy: 1.7410013986557953
Energy: 1.4189582450177856
Energy: 1.4412185933097201
Energy: 1.4669687372691462
Energy: 1.4412185933086716
Energy: 1.4669687372691462
Energy: 1.4412185933097201
Energy: 1.4669687372691462
Energy: 1.4755986877468306
Energy: 1.3046721542742188
Energy: 1.475598687747879
Energy: 1.3046721542742188
Energy: 1.4755986877468306
Energy: 1.3046721542742188
Energy: 1.520036865891326
Energy: 1.4583715715823375
Energy: 1.520036865891326
Energy: 1.4583715715823375
Energy: 1.520036865891326
Energy: 1.4583715715823375
Energy: 1.518617513981637
Energy: 1.4581321864649264
Energy: 1.5186175139806362
Energy: 1.4581321864649264
Energy: 1.5186175139806362
Energy: 1.4581321864649264
Energy: 1.4541096283045059
Energy: 1.4584278931657584
Energy: 1.4541096283045059
Energy: 1.4584278931657584
Energy: 1.4541096283045059
Energy: 1.4584278931657584
Energy: 1.3864096569189386
Energy: 1.458948203690935
Energy: 1.3864096569199873
Energy: 1.458948203690935
Energy: 1.3864096569199873
Energy: 1.458948203690935
Energy: 1.7152434738829927
Energy: 1.3000847584321753
Energy: 1.7152434738840412
Energy: 1.3000847584321753
Energy: 1.7152434738829927
Energy: 1.3000847584321753
Energy: 1.3313351967134466
Energy: 1.7112359468092786
Energy: 1.3313351967134466
Energy: 1.7112359468092786
Energy: 1.3313351967134466
Energy: 1.7112359468092786
Energy: 1.7237064155567305
Energy: 1.317176992791379
Energy: 1.7237064155567305
Energy: 1.317176992791379
Energy: 1.7237064155567305
Energy: 1.317176992791379
Energy: 1.505590630050503
Energy: 1.5047237924849677
Energy: 1.505590630050503
Energy: 1.5047237924849677
Energy: 1.505590630050503
Energy: 1.5047237924849677
Energy: 1.7588719501225525
Energy: 1.4194256493450421
Energy: 1.7588719501225525
Energy: 1.4194256493450421
Energy: 1.7588719501225525
Energy: 1.4194256493460904
Energy: 1.441239889028964
Energy: 1.4058424676940295
Energy: 1.441239889028964
Energy: 1.4058424676940295
Energy: 1.441239889028964
Energy: 1.4058424676940295
Energy: 1.5156616837358226
Energy: 1.4873124991441065
Energy: 1.5156616837358226
Energy: 1.4873124991441065
Energy: 1.5156616837358226
Energy: 1.4873124991441065
Energy: 1.519122733505991
Energy: 1.458225771158549
Energy: 1.5191227335070392
Energy: 1.458225771158549
Energy: 1.519122733505991
Energy: 1.458225771158549
Energy: 1.5216522777822337
Energy: 1.600272040049122
Energy: 1.5216522777822337
Energy: 1.600272040049122
Energy: 1.5216522777832822
Energy: 1.6002720400501707
Energy: 1.456801703083002
Energy: 1.4586695758227122
Energy: 1.456801703083002
Energy: 1.4586695758227122
Energy: 1.456801703083002
Energy: 1.4586695758227122

minimum gb energy = 1.3000847584321753 eV
minimum distance =  2.24313026081542 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.2024360298243315
Energy: 1.2253910373431625
Energy: 1.2024360298243315
Energy: 1.2253910373425405
Energy: 1.2024360298243315
Energy: 1.2253910373431625
Energy: 1.4724543067092266
Energy: 1.5117382257127256
Energy: 1.4724543067092266
Energy: 1.5117382257127256
Energy: 1.4724543067086047
Energy: 1.5117382257127256
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921232653
Energy: 1.5109412635429078
Energy: 1.2635673998000365
Energy: 1.158944785528328
Energy: 1.2635673998006582
Energy: 1.1589447855289499
Energy: 1.2635673998000365
Energy: 1.1589447855289499
Energy: 1.1816456052318742
Energy: 1.2014372168737693
Energy: 1.1816456052318742
Energy: 1.2014372168743914
Energy: 1.1816456052312523
Energy: 1.2014372168743914
Energy: 1.1817044059603354
Energy: 1.2012323575561605
Energy: 1.1817044059603354
Energy: 1.2012323575561605
Energy: 1.1817044059603354
Energy: 1.2012323575555386
Energy: 1.2636974812444688
Energy: 1.1589487844325428
Energy: 1.2636974812450907
Energy: 1.1589487844344084
Energy: 1.2636974812450907
Energy: 1.1589487844331647
Energy: 1.1589197618939657
Energy: 1.5109506864153432
Energy: 1.1589197618939657
Energy: 1.5109506864153432
Energy: 1.1589197618945877
Energy: 1.5109506864153432
Energy: 1.472335365510652
Energy: 1.5116924886811363
Energy: 1.472335365508786
Energy: 1.5116924886817584
Energy: 1.4723353655100302
Energy: 1.5116924886817584
Energy: 1.2024360298237098
Energy: 1.2253910373425405
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.4724543067092266
Energy: 1.5117382257127256
Energy: 1.4724543067086047
Energy: 1.5117382257127256
Energy: 1.4724543067079827
Energy: 1.5117382257121035
Energy: 1.1589385921232653
Energy: 1.510941263542286
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.2635673998000365
Energy: 1.1589447855295718
Energy: 1.2635673998000365
Energy: 1.1589447855295718
Energy: 1.2635673998006582
Energy: 1.1589447855295718
Energy: 1.1816456052318742
Energy: 1.2014372168731473
Energy: 1.1816456052318742
Energy: 1.2014372168737693
Energy: 1.1816456052318742
Energy: 1.2014372168737693
Energy: 1.1817044059603354
Energy: 1.2012323575561605
Energy: 1.1817044059609576
Energy: 1.2012323575561605
Energy: 1.1817044059603354
Energy: 1.2012323575561605
Energy: 1.263697481243847
Energy: 1.1589487844331647
Energy: 1.2636974812450907
Energy: 1.1589487844337867
Energy: 1.2636974812450907
Energy: 1.1589487844331647
Energy: 1.1589197618939657
Energy: 1.5109506864153432
Energy: 1.1589197618945877
Energy: 1.5109506864153432
Energy: 1.1589197618939657
Energy: 1.5109506864147213
Energy: 1.472335365509408
Energy: 1.5116924886817584
Energy: 1.472335365509408
Energy: 1.5116924886817584
Energy: 1.4723353655112739
Energy: 1.5116924886817584
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.4724543067092266
Energy: 1.5117382257127256
Energy: 1.4724543067092266
Energy: 1.5117382257127256
Energy: 1.4724543067092266
Energy: 1.5117382257127256
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.2635673998000365
Energy: 1.1589447855289499
Energy: 1.2635673997994146
Energy: 1.158944785528328
Energy: 1.2635673998006582
Energy: 1.1589447855289499
Energy: 1.1816456052312523
Energy: 1.2014372168743914
Energy: 1.1816456052312523
Energy: 1.2014372168743914
Energy: 1.1816456052318742
Energy: 1.2014372168743914
Energy: 1.1817044059603354
Energy: 1.2012323575561605
Energy: 1.1817044059597137
Energy: 1.2012323575555386
Energy: 1.1817044059609576
Energy: 1.2012323575555386
Energy: 1.2636974812450907
Energy: 1.1589487844337867
Energy: 1.2636974812444688
Energy: 1.1589487844337867
Energy: 1.2636974812444688
Energy: 1.1589487844337867
Energy: 1.1589197618939657
Energy: 1.5109506864153432
Energy: 1.1589197618939657
Energy: 1.5109506864147213
Energy: 1.1589197618945877
Energy: 1.5109506864153432
Energy: 1.472335365510652
Energy: 1.5116924886805145
Energy: 1.4723353655100302
Energy: 1.5116924886811363
Energy: 1.472335365509408
Energy: 1.5116924886817584
Energy: 1.2024360298237098
Energy: 1.2253910373425405
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.2024360298237098
Energy: 1.2253910373431625
Energy: 1.4724543067086047
Energy: 1.5117382257127256
Energy: 1.4724543067086047
Energy: 1.5117382257127256
Energy: 1.4724543067086047
Energy: 1.5117382257127256
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921226436
Energy: 1.510941263542286
Energy: 1.1589385921232653
Energy: 1.510941263542286

minimum gb energy = 1.1589197618939657 eV
minimum distance =  2.2453139687694 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.2120486909391484
Energy: 1.1742998215336475
Energy: 1.2120486909391484
Energy: 1.1742998215336475
Energy: 1.2120486909391484
Energy: 1.1742998215336475
Energy: 1.498897362558244
Energy: 1.2280719227161527
Energy: 1.498897362558244
Energy: 1.2280719227161527
Energy: 1.4988973625597675
Energy: 1.2280719227161527
Energy: 1.2192694401354771
Energy: 1.3549966430272748
Energy: 1.2192694400669595
Energy: 1.3549966430272748
Energy: 1.219269440109614
Energy: 1.3549966430272748
Energy: 1.5368516468032365
Energy: 1.1408061771106364
Energy: 1.536851646801748
Energy: 1.1408061771106364
Energy: 1.536851646801748
Energy: 1.1408061771106364
Energy: 1.5389313137487886
Energy: 1.140556627047162
Energy: 1.538931313747265
Energy: 1.140556627047162
Energy: 1.538931313747265
Energy: 1.140556627047162
Energy: 1.4152710092389098
Energy: 1.4751364440055657
Energy: 1.4152710092389098
Energy: 1.4751364440055657
Energy: 1.4152710092389098
Energy: 1.4751364440055657
Energy: 1.334616067339372
Energy: 1.2317385536195564
Energy: 1.334616067339372
Energy: 1.2317385536195564
Energy: 1.334616067339372
Energy: 1.2317385536195564
Energy: 1.2092255046943248
Energy: 1.1757939314683628
Energy: 1.2092255046943248
Energy: 1.1757939314683628
Energy: 1.2092255046943248
Energy: 1.1757939314668393
Energy: 1.5102896307133322
Energy: 1.2195548207823506
Energy: 1.5102896307133322
Energy: 1.219554817449153
Energy: 1.5102896307133322
Energy: 1.2195548901827842
Energy: 1.328383189224343
Energy: 1.4410450349892854
Energy: 1.328383189224343
Energy: 1.4410450349892854
Energy: 1.328383189224343
Energy: 1.4410450349877622
Energy: 1.600296308303425
Energy: 1.140803318569114
Energy: 1.285147135742507
Energy: 1.140803318569114
Energy: 1.600296308303425
Energy: 1.140803318569114
Energy: 1.4710342002077645
Energy: 1.3590823100066924
Energy: 1.4710342002077645
Energy: 1.3590823100066924
Energy: 1.4710342002077645
Energy: 1.3590823100066924

minimum gb energy = 1.140556627047162 eV
minimum distance =  2.2210249817401 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.2634760689779825
Energy: 1.203382641934106
Energy: 1.2634760689792668
Energy: 1.2033826419336782
Energy: 1.2634760689788387
Energy: 1.2033826419345344
Energy: 1.2654571855877361
Energy: 1.1394939096044048
Energy: 1.265457185586452
Energy: 1.1394939096039767
Energy: 1.265457185588164
Energy: 1.1394939096039767
Energy: 1.0758793698135445
Energy: 1.5001920611965314
Energy: 1.0758793698126885
Energy: 1.500192061195675
Energy: 1.0758793698126885
Energy: 1.500192061196103
Energy: 1.1037456728378439
Energy: 1.0559705306542266
Energy: 1.1037456728382715
Energy: 1.0559705306546547
Energy: 1.1037456728374158
Energy: 1.0559705306546547
Energy: 1.2248720885797222
Energy: 1.1610820159732902
Energy: 1.2248720885788662
Energy: 1.1610820159728623
Energy: 1.2248720885797222
Energy: 1.1610820159732902
Energy: 1.22402939188459
Energy: 1.2467616864154525
Energy: 1.22402939188459
Energy: 1.1954564966315901
Energy: 1.224029391884162
Energy: 1.2467616864180207
Energy: 1.148824362276245
Energy: 1.2618446173039846
Energy: 1.148824362275817
Energy: 1.2618446173031284
Energy: 1.148824362276245
Energy: 1.2618446173031284
Energy: 1.0284015579756607
Energy: 1.255451585867895
Energy: 1.0284015579752326
Energy: 1.255451585867895
Energy: 1.0284015579756607
Energy: 1.255451585867895
Energy: 1.3909691713657133
Energy: 1.1605955409879725
Energy: 1.390969171366141
Energy: 1.1605955409888282
Energy: 1.390969171366141
Energy: 1.1605955409879725
Energy: 1.2162485816112123
Energy: 1.4717761033710834
Energy: 1.2162485816112123
Energy: 1.4717761033710834
Energy: 1.2162485816112123
Energy: 1.4717761033710834
Energy: 1.1022685438152637
Energy: 1.0602275842914959
Energy: 1.1022685438161197
Energy: 1.0602275842914959
Energy: 1.1022685438152637
Energy: 1.0602275842914959
Energy: 1.1489267505330156
Energy: 1.2578365600046757
Energy: 1.1489267505334435
Energy: 1.2578365600042478
Energy: 1.1489267505330156
Energy: 1.2578365600046757
Energy: 1.3173756441383173
Energy: 1.1908452244259087
Energy: 1.3173756441378892
Energy: 1.1908452244263368
Energy: 1.3173756441383173
Energy: 1.1908452244263368
Energy: 1.2615567696809604
Energy: 1.567710821865321
Energy: 1.2615567696835288
Energy: 1.5677108218657492
Energy: 1.2615567696818164
Energy: 1.5677108218657492
Energy: 1.0751266110099853
Energy: 1.2301366697306724
Energy: 1.075126611009129
Energy: 1.2301366697306724
Energy: 1.075126611007845
Energy: 1.2301366697302445
Energy: 1.327156537044479
Energy: 1.15014706672003
Energy: 1.327156537044051
Energy: 1.1501470667204583
Energy: 1.327156537044479
Energy: 1.150147066719602
Energy: 1.4302639614225319
Energy: 1.056417109386737
Energy: 1.4302639614233883
Energy: 1.056417109387593
Energy: 1.430263961423816
Energy: 1.056417109387165
Energy: 1.0881260638356256
Energy: 1.1653267711500817
Energy: 1.0881260638360537
Energy: 1.1653267711500817
Energy: 1.0881260638356256
Energy: 1.1653267711505095
Energy: 1.0248806822738332
Energy: 1.4734161034991589
Energy: 1.0248806822746892
Energy: 1.4734161034991589
Energy: 1.0248806822738332
Energy: 1.4734161034991589
Energy: 1.4697370597605475
Energy: 1.2582558838847175
Energy: 1.4697370597601194
Energy: 1.2582558838847175
Energy: 1.4697370597601194
Energy: 1.2582558838847175
Energy: 1.0248670303420415
Energy: 1.4740503975175632
Energy: 1.0248670303407572
Energy: 1.4740503975171353
Energy: 1.0248670303416136
Energy: 1.4740503975171353
Energy: 1.088455981027268
Energy: 1.1653753299012026
Energy: 1.088455981028552
Energy: 1.1653753299012026
Energy: 1.088455981027268
Energy: 1.1653753299016307
Energy: 1.4303713235200155
Energy: 1.0568641188334316
Energy: 1.4303713235195878
Energy: 1.0568641188321475
Energy: 1.4303713235195878
Energy: 1.0568641188325756
Energy: 1.327146339737088
Energy: 1.2463607157997312
Energy: 1.327146339736232
Energy: 1.2463607157997312
Energy: 1.327146339736232
Energy: 1.2463607158001588
Energy: 1.0752663256370154
Energy: 1.2298800283107358
Energy: 1.075266325637443
Energy: 1.2298800283107358
Energy: 1.075266325636587
Energy: 1.2298800283107358
Energy: 1.2616447717844677
Energy: 1.299152044803734
Energy: 1.2616447717844677
Energy: 1.299152044803734
Energy: 1.2616447717844677
Energy: 1.2991520448033058
Energy: 1.317352532687451
Energy: 1.190891544585948
Energy: 1.3173525326870228
Energy: 1.190891544585948
Energy: 1.317352532689591
Energy: 1.190891544585948
Energy: 1.1491448572110616
Energy: 1.1728565619360465
Energy: 1.1491448572114893
Energy: 1.1728565619364744
Energy: 1.1491448572110616
Energy: 1.1728565619364744
Energy: 1.1023602299739956
Energy: 1.0602783957931732
Energy: 1.1023602299739956
Energy: 1.0602783957936008
Energy: 1.1023602299735678
Energy: 1.0602783957931732
Energy: 1.20732841221118
Energy: 1.484465664802284
Energy: 1.2073284122137484
Energy: 1.484465664802284
Energy: 1.207328412210324
Energy: 1.484465664801856
Energy: 1.39077210657438
Energy: 1.1608284958374846
Energy: 1.39077210657438
Energy: 1.1608284958374846
Energy: 1.3907721065752363
Energy: 1.1608284958374846
Energy: 1.0284368785724995
Energy: 1.2553066226478635
Energy: 1.0284368785724995
Energy: 1.2553066226478635
Energy: 1.0284368785716436
Energy: 1.2553066226478635
Energy: 1.149128311097576
Energy: 1.2621992632344154
Energy: 1.149128311097576
Energy: 1.2621992632331314
Energy: 1.1491283110980042
Energy: 1.2621992632331314
Energy: 1.223857210203641
Energy: 1.1955037797014811
Energy: 1.2238572102040688
Energy: 1.1955037796997692
Energy: 1.223857210203641
Energy: 1.195503779699341
Energy: 1.2248663526426924
Energy: 1.1610810969674488
Energy: 1.2248663526431203
Energy: 1.1610810969674488
Energy: 1.2248663526431203
Energy: 1.1610810969674488
Energy: 1.1037329379728613
Energy: 1.0557554661463966
Energy: 1.1037329379737173
Energy: 1.0557554661459685
Energy: 1.1037329379728613
Energy: 1.0557554661463966
Energy: 1.0758594641142594
Energy: 1.5002018892306817
Energy: 1.0758594641146872
Energy: 1.5002018892311098
Energy: 1.0758594641142594
Energy: 1.5002018892306817
Energy: 1.264629809919972
Energy: 1.1426772247756454
Energy: 1.2646298099255364
Energy: 1.142677224776073
Energy: 1.264629809921256
Energy: 1.1426772247756454
Energy: 1.2634760689788387
Energy: 1.2033826419315379
Energy: 1.2634760689792668
Energy: 1.2033826419315379
Energy: 1.2634760689779825
Energy: 1.203382641932394
Energy: 1.265457185586452
Energy: 1.1476514230777135
Energy: 1.2654571855873078
Energy: 1.1476514230777135
Energy: 1.2654571855860237
Energy: 1.1476514230777135
Energy: 1.0758793698148288
Energy: 1.5001920611973873
Energy: 1.0758793698139726
Energy: 1.5001920611973873
Energy: 1.0758793698144007
Energy: 1.5001920611978155
Energy: 1.1037456728369877
Energy: 1.0559705306550828
Energy: 1.1037456728378439
Energy: 1.0559705306550828
Energy: 1.1037456728374158
Energy: 1.0559705306550828
Energy: 1.2248720885810063
Energy: 1.1610820159724342
Energy: 1.2248720885797222
Energy: 1.1610820159720059
Energy: 1.2248720885805782
Energy: 1.1610820159720059

minimum gb energy = 1.0248670303407572 eV
minimum distance =  2.3016750472395 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.5503070107390045
Energy: 0.5628653860394836
Energy: 0.5503070107390045
Energy: 0.5628653860375348
Energy: 0.5503070107399788
Energy: 0.5628653860414321
Energy: 0.7101141429809357
Energy: 0.5511008737007517
Energy: 0.7101141429809357
Energy: 0.5511008736997773
Energy: 0.7101141429799612
Energy: 0.5511008737007517
Energy: 0.6178657168546693
Energy: 0.6811441308653511
Energy: 0.617865716853695
Energy: 0.6811441308663255
Energy: 0.6178657168546693
Energy: 0.6811441308653511
Energy: 0.5627284397630151
Energy: 0.5501954529259444
Energy: 0.5627284397620408
Energy: 0.5501954529269188
Energy: 0.5627284397639896
Energy: 0.550195452922047
Energy: 0.7106033582714975
Energy: 0.716020736340647
Energy: 0.7106033582705674
Energy: 0.716020736340647
Energy: 0.7106033582705674
Energy: 0.716020736340647
Energy: 0.5503991439591551
Energy: 0.6171399476481635
Energy: 0.5503991439601296
Energy: 0.6171399476481635
Energy: 0.5503991439591551
Energy: 0.6171399476481635
Energy: 0.5505227641947402
Energy: 0.6170459040707217
Energy: 0.5505227641918171
Energy: 0.6170459040697474
Energy: 0.5505227641937659
Energy: 0.6170459040697474
Energy: 0.7106896371216437
Energy: 0.7159637490988033
Energy: 0.7106896371216437
Energy: 0.7159637490988033
Energy: 0.7106896371216437
Energy: 0.7159637490988033
Energy: 0.562724531440774
Energy: 0.5501591191816471
Energy: 0.5627245314427227
Energy: 0.5501591191796983
Energy: 0.562724531443697
Energy: 0.550159119178724
Energy: 0.6178314841615205
Energy: 0.6812009339629366
Energy: 0.6178314841605461
Energy: 0.6812009339629366
Energy: 0.6178314841615205
Energy: 0.6812009339629366
Energy: 0.7102016780455936
Energy: 0.5510641648817021
Energy: 0.7102016780446193
Energy: 0.5510641648817021
Energy: 0.7102016780446193
Energy: 0.5510641648817021
Energy: 0.5503070107390045
Energy: 0.5628653860404579
Energy: 0.5503070107399788
Energy: 0.5628653860375348
Energy: 0.5503070107399788
Energy: 0.5628653860385092
Energy: 0.7101141429799612
Energy: 0.5511008736997773
Energy: 0.7101141429799612
Energy: 0.5511008737007517
Energy: 0.7101141429799612
Energy: 0.5511008737007517
Energy: 0.6178657168546693
Energy: 0.6811441308682742
Energy: 0.6178657168546693
Energy: 0.6811441308672999
Energy: 0.6178657168556437
Energy: 0.6811441308672999
Energy: 0.5627284397630151
Energy: 0.5501954529269188
Energy: 0.5627284397630151
Energy: 0.5501954529278932
Energy: 0.562728439764964
Energy: 0.5501954529239957
Energy: 0.7106033582705674
Energy: 0.716020736340647
Energy: 0.7106033582705674
Energy: 0.716020736340647
Energy: 0.7106033582705674
Energy: 0.716020736340647
Energy: 0.5503991439601296
Energy: 0.6171399476471892
Energy: 0.5503991439591551
Energy: 0.6171399476481635
Energy: 0.5503991439591551
Energy: 0.6171399476481635
Energy: 0.5505227641937659
Energy: 0.6170459040707217
Energy: 0.5505227641937659
Energy: 0.6170459040707217
Energy: 0.5505227641918171
Energy: 0.6170459040697474
Energy: 0.7106896371216437
Energy: 0.7159637490988033
Energy: 0.7106896371216437
Energy: 0.7159637490988033
Energy: 0.7106896371206693
Energy: 0.7159637490988033

minimum gb energy = 0.550159119178724 eV
minimum distance =  2.40637267727425 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.1092090506712986
Energy: 1.089067579496585
Energy: 1.1092090506712986
Energy: 1.089067579497299
Energy: 1.1092090506712986
Energy: 1.089067579496585
Energy: 1.2005719688729746
Energy: 1.1168680539737872
Energy: 1.200571968871547
Energy: 1.1168680539737872
Energy: 1.2005719688722611
Energy: 1.1168680539745008
Energy: 1.152562969199851
Energy: 1.579938213099855
Energy: 1.152562969199851
Energy: 1.5799382131005686
Energy: 1.152562969199851
Energy: 1.5799382131005686
Energy: 1.2126327088943563
Energy: 0.9424218974191765
Energy: 1.2126327088943563
Energy: 0.9424218974191765
Energy: 1.2126327088936428
Energy: 0.9424218974191765
Energy: 1.0582793882975328
Energy: 0.9036242342835977
Energy: 1.0582793882975328
Energy: 0.9036242342843114
Energy: 1.0582793882975328
Energy: 0.9036242342835977
Energy: 1.0806630526254253
Energy: 1.1970825429768719
Energy: 1.0806630526247119
Energy: 1.1970825429768719
Energy: 1.0806630526261394
Energy: 1.1970825429768719
Energy: 0.9120728902917729
Energy: 1.282706534967691
Energy: 0.9120728902917729
Energy: 1.2827065349684048
Energy: 0.9120728902917729
Energy: 1.282706534967691
Energy: 1.1169962571467136
Energy: 0.8688062868637387
Energy: 1.116996257146
Energy: 0.8688062868630251
Energy: 1.116996257146
Energy: 0.8688062868630251
Energy: 1.1135789131305567
Energy: 0.872764571773548
Energy: 1.1135789131305567
Energy: 0.872764571773548
Energy: 1.11357891313127
Energy: 0.8727645717728344
Energy: 0.8889747025603578
Energy: 1.359703582847478
Energy: 0.8889747025603578
Energy: 1.3597035828489057
Energy: 0.8889747025610715
Energy: 1.359703582847478
Energy: 1.093935729622313
Energy: 1.3707083663634965
Energy: 1.093935729622313
Energy: 1.3707083663634965
Energy: 1.093935729622313
Energy: 1.3707083663634965
Energy: 1.0606545917885541
Energy: 0.9042100295064187
Energy: 1.0606545917892678
Energy: 0.9042100295064187
Energy: 1.0606545917899817
Energy: 0.9042100295064187
Energy: 1.1515764856171034
Energy: 0.9486454464521532
Energy: 1.1515764856171034
Energy: 0.9486454464521532
Energy: 1.1515764856178168
Energy: 0.9486454464521532
Energy: 1.212603103365354
Energy: 1.5490461715143555
Energy: 1.2126031033660678
Energy: 1.5490461715143555
Energy: 1.212603103365354
Energy: 1.5490461715143555
Energy: 1.1990101739572188
Energy: 1.1132517012876948
Energy: 1.1990101739557912
Energy: 1.1132517012876948
Energy: 1.1990101739579324
Energy: 1.1132517012884087
Energy: 1.1098690417438117
Energy: 1.1271579533835574
Energy: 1.1098690417445252
Energy: 1.1271579533842713
Energy: 1.1098690417438117
Energy: 1.1271579533835574
Energy: 1.0299800306567144
Energy: 1.0550053791886593
Energy: 1.0299800306567144
Energy: 1.0550053791886593
Energy: 1.0299800306567144
Energy: 1.0550053791893728
Energy: 1.394856470315561
Energy: 1.540120481753031
Energy: 1.394856470315561
Energy: 1.5401204817501761
Energy: 1.394856470315561
Energy: 1.5401204817523173
Energy: 1.298484055727516
Energy: 0.9385468899519213
Energy: 1.2984840557282296
Energy: 0.9385468899519213
Energy: 1.2984840557289434
Energy: 0.9385468899512077
Energy: 1.0603840631615395
Energy: 1.0333984312039375
Energy: 1.0603840631608907
Energy: 1.0333984312039375
Energy: 1.0603840631615395
Energy: 1.0333984312039375
Energy: 0.890264380161073
Energy: 1.1802671111658103
Energy: 0.8902643801603595
Energy: 1.1802671111650966
Energy: 0.8902643801617869
Energy: 1.1802671111658103
Energy: 1.1754237317412584
Energy: 1.2826372736905212
Energy: 1.175423731745541
Energy: 1.282637273691235
Energy: 1.175423731741972
Energy: 1.2826372736905212
Energy: 1.2325210778917637
Energy: 1.051224563060155
Energy: 1.2325210778931912
Energy: 1.051224563060155
Energy: 1.2325210778931912
Energy: 1.0512245630594412
Energy: 1.1153161811295726
Energy: 0.9778736160431837
Energy: 1.1153161811295726
Energy: 0.97787361604247
Energy: 1.1153161811281451
Energy: 0.9778736160431837
Energy: 0.8903042504170336
Energy: 1.35581671242977
Energy: 0.8903042504163199
Energy: 1.3558167124290563
Energy: 0.8903042504170336
Energy: 1.3558167124311975
Energy: 1.6287927265393578
Energy: 1.177809602402699
Energy: 1.628792726538644
Energy: 1.1778096024034128
Energy: 1.628792726538644
Energy: 1.1778096024034128

minimum gb energy = 0.8688062868630251 eV
minimum distance =  2.2919819293727 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.2538198093800776
Energy: 1.0498664304246823
Energy: 1.2538198093800776
Energy: 1.0498664304246823
Energy: 1.2538198093800776
Energy: 1.0498664304246823
Energy: 1.2374913270895826
Energy: 1.283159607501716
Energy: 1.23749132708902
Energy: 1.283159607501716
Energy: 1.2374913270895826
Energy: 1.283159607501716
Energy: 1.5364128559805883
Energy: 1.4604977585399637
Energy: 1.5364128559805883
Energy: 1.460497758540526
Energy: 1.5364128559805883
Energy: 1.4604977585410888
Energy: 1.167086690737348
Energy: 0.9850160082345406
Energy: 1.167086690737911
Energy: 0.9850160082345406
Energy: 1.167086690737911
Energy: 0.9850160082339782
Energy: 0.9635811917238426
Energy: 1.0422833837843486
Energy: 0.96358119172328
Energy: 1.0422833837837862
Energy: 0.9635811917238426
Energy: 1.0422833837837862
Energy: 1.2242641892781176
Energy: 1.4569317866005522
Energy: 1.2242641892781176
Energy: 1.4569317866005522
Energy: 1.22426418927868
Energy: 1.4569317866005522
Energy: 0.9862566795841304
Energy: 1.3727377205231182
Energy: 0.986256679584693
Energy: 1.3727377205236808
Energy: 0.9862566795841304
Energy: 1.3727377205236808
Energy: 0.963930722011366
Energy: 0.9859452290580233
Energy: 0.9639307220108033
Energy: 0.9859452290580233
Energy: 0.963930722011366
Energy: 0.9859452290580233
Energy: 0.9779440614621397
Energy: 1.024511448568728
Energy: 0.9779440614615772
Energy: 1.024511448568728
Energy: 0.9779440614621397
Energy: 1.024511448568728
Energy: 1.0531119497485313
Energy: 1.4832878224436252
Energy: 1.053111949749094
Energy: 1.4832878224436252
Energy: 1.053111949749094
Energy: 1.4832878224436252
Energy: 1.0535449394582617
Energy: 1.159056217086929
Energy: 1.0535449394582617
Energy: 1.159056217086929
Energy: 1.0535449394582617
Energy: 1.1590562170874916
Energy: 0.9516555281274398
Energy: 1.1632744131104917
Energy: 0.9516555281263146
Energy: 1.1632744131104917
Energy: 0.9516555281268771
Energy: 1.1632744131104917
Energy: 0.9640863779060797
Energy: 1.0237616488284407
Energy: 0.9640863779049546
Energy: 1.0237616488284407
Energy: 0.9640863779049546
Energy: 1.0237616488284407
Energy: 0.9284942415493467
Energy: 1.3859521564403345
Energy: 0.9284942415493467
Energy: 1.3859521564403345
Energy: 0.9284942415499093
Energy: 1.3859521564403345
Energy: 1.221738791000188
Energy: 1.4616903838772421
Energy: 1.2217387909990627
Energy: 1.4616903838778048
Energy: 1.2217387909996256
Energy: 1.4616903838772421
Energy: 0.9262338563827762
Energy: 1.170140396949774
Energy: 0.9262338563827762
Energy: 1.1701403969503366
Energy: 0.9262338563827762
Energy: 1.1701403969503366
Energy: 0.9728860596568074
Energy: 1.023209764110304
Energy: 0.9728860596568074
Energy: 1.0232097641108664
Energy: 0.97288605965737
Energy: 1.023209764110304
Energy: 1.2149033783744572
Energy: 1.7720442985397045
Energy: 1.2149033783750196
Energy: 1.7720442985397045
Energy: 1.2149033783744572
Energy: 1.7720442985397045
Energy: 1.2371500239344488
Energy: 1.2764144041383039
Energy: 1.2371500239344488
Energy: 1.2764144041383039
Energy: 1.2371500239344488
Energy: 1.2764144041383039
Energy: 1.0528251860509807
Energy: 1.3032238492306754
Energy: 1.0528251860504183
Energy: 1.3032238492306754
Energy: 1.0528251860504183
Energy: 1.3032238492306754
Energy: 0.9803449280052099
Energy: 1.2369263600630733
Energy: 0.9803449280052099
Energy: 1.2369263600630733
Energy: 0.9803449280052099
Energy: 1.2369263600630733
Energy: 1.1173588140352582
Energy: 1.6084111128125067
Energy: 1.1173588140346955
Energy: 1.6084111128125067
Energy: 1.1173588140346955
Energy: 1.6084111128125067
Energy: 1.131493622696322
Energy: 0.9867936567322164
Energy: 1.131493622696322
Energy: 0.9867936567322164
Energy: 1.131493622696322
Energy: 0.986793656731654
Energy: 0.9737877123470581
Energy: 1.2915343922918185
Energy: 0.9737877123464955
Energy: 1.2915343922912559
Energy: 0.9737877123470581
Energy: 1.2915343922918185
Energy: 0.9349367868152372
Energy: 1.2928716496398551
Energy: 0.9349367868157997
Energy: 1.2928716496398551
Energy: 0.9349367868163624
Energy: 1.2928716496398551
Energy: 0.9862150263130637
Energy: 0.9869990243464353
Energy: 0.986215026313626
Energy: 0.9869990243458726
Energy: 0.9862150263130637
Energy: 0.9869990243458726
Energy: 0.9700973945890246
Energy: 0.9853777198137812
Energy: 0.970097394588462
Energy: 0.9853777198137812
Energy: 0.970097394588462
Energy: 0.9853777198132188
Energy: 0.9755113146638779
Energy: 1.2354082415158147
Energy: 0.9755113146638779
Energy: 1.2354082415158147
Energy: 0.9755113146638779
Energy: 1.2354082415158147
Energy: 1.0532529311711374
Energy: 1.2980125643019045
Energy: 1.0532529311722625
Energy: 1.2980125643019045
Energy: 1.0532529311717
Energy: 1.2980125643019045
Energy: 1.4522726050424823
Energy: 0.9273953241074454
Energy: 1.4522726050424823
Energy: 0.9273953241074454
Energy: 1.4522726050419195
Energy: 0.9273953241074454
Energy: 0.9538763179760994
Energy: 1.1611672079049524
Energy: 0.9538763179766617
Energy: 1.1611672079049524
Energy: 0.9538763179766617
Energy: 1.1611672079049524
Energy: 0.9941867445918904
Energy: 1.0149952216236122
Energy: 0.994186744592453
Energy: 1.0149952216236122
Energy: 0.9941867445918904
Energy: 1.0149952216241749
Energy: 0.9343542190056577
Energy: 1.168395058257611
Energy: 0.9343542190056577
Energy: 1.1683950582570484
Energy: 0.9343542190062204
Energy: 1.168395058257611

minimum gb energy = 0.9262338563827762 eV
minimum distance =  2.33041231874282 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.1259596357087953
Energy: 1.0421382786190794
Energy: 1.1259596357092259
Energy: 1.0421382786190794
Energy: 1.1259596357092259
Energy: 1.0421382786194382
Energy: 1.4001125402664152
Energy: 0.9847183242240852
Energy: 1.4001125402636159
Energy: 0.9847183242237262
Energy: 1.400112540267205
Energy: 0.9847183242240852
Energy: 1.6322523512921683
Energy: 1.557138934354737
Energy: 1.6322523512925267
Energy: 1.557138934355096
Energy: 1.6322523512921683
Energy: 1.557138934359044
Energy: 1.3397333049675029
Energy: 1.0051656981171337
Energy: 1.339733304968723
Energy: 1.0051656981171337
Energy: 1.3397333049682925
Energy: 1.0051656981171337
Energy: 1.028544407437537
Energy: 1.0035285570415893
Energy: 1.0285444074359578
Energy: 1.0035285570451784
Energy: 1.0285444074355987
Energy: 1.003528557046327
Energy: 1.357251502410812
Energy: 1.0389546427152696
Energy: 1.3572515024123912
Energy: 1.03895464271448
Energy: 1.3572515024119605
Energy: 1.038954642714911
Energy: 1.0331037619121797
Energy: 1.1336659152191804
Energy: 1.0331037619125387
Energy: 1.133665915218032
Energy: 1.033103761911749
Energy: 1.1336659152191804
Energy: 1.0906778095574385
Energy: 1.1012739636655626
Energy: 1.090677809556649
Energy: 1.1012739636655626
Energy: 1.0906778095574385
Energy: 1.1012739636652038
Energy: 1.046605639259534
Energy: 1.0559191228471458
Energy: 1.046605639257955
Energy: 1.0559191228471458
Energy: 1.046605639261544
Energy: 1.0559191228467153
Energy: 1.4095616610493371
Energy: 1.019633367726629
Energy: 1.409561661047758
Energy: 1.0196333677262703
Energy: 1.4095616610473274
Energy: 1.019633367726629
Energy: 1.0865276752982624
Energy: 1.4631394803582043
Energy: 1.0865276752982624
Energy: 1.4631394803582043
Energy: 1.0865276752986932
Energy: 1.463139480358994
Energy: 1.61056875475142
Energy: 1.005296729901344
Energy: 1.6105687547517786
Energy: 1.0052967299009852
Energy: 1.6105687547517786
Energy: 1.005296729901344
Energy: 1.057886649530782
Energy: 1.0466956771221347
Energy: 1.057886649530782
Energy: 1.0466956771256521
Energy: 1.0578866495303514
Energy: 1.0466956771224936
Energy: 1.1161618918810032
Energy: 1.0919455129574365
Energy: 1.116161891881434
Energy: 1.091945512957006
Energy: 1.1161618918806444
Energy: 1.0919455129577955
Energy: 1.1021890133691519
Energy: 1.0320275030074852
Energy: 1.102189013370731
Energy: 1.0320275030063368
Energy: 1.1021890133703003
Energy: 1.0320275030071266
Energy: 1.0448044783530008
Energy: 1.3598691402859553
Energy: 1.0448044783530008
Energy: 1.3598691402859553
Energy: 1.0448044783530008
Energy: 1.3598691402855245
Energy: 1.3131795591303645
Energy: 1.0356663783469817
Energy: 1.31317955911931
Energy: 1.0356663783469817
Energy: 1.3131795591287851
Energy: 1.0356663783477713
Energy: 1.0025983005815473
Energy: 1.0531824311312417
Energy: 1.0025983005815473
Energy: 1.0531824311316724
Energy: 1.0025983005815473
Energy: 1.0531824311308828
Energy: 1.4086869412980918
Energy: 1.3733630466986417
Energy: 1.4086869412973022
Energy: 1.3733630466982112
Energy: 1.4086869412973022
Energy: 1.3733630466978521
Energy: 1.5916108137420295
Energy: 1.0732399669127652
Energy: 1.591610813742388
Energy: 1.0732399669131238
Energy: 1.5916108137415987
Energy: 1.0732399669131238
Energy: 1.0028874921311994
Energy: 1.127066261731623
Energy: 1.0028874921311994
Energy: 1.1270662617311924
Energy: 1.0028874921324196
Energy: 1.1270662617311924
Energy: 0.9813688518506031
Energy: 1.1402025903067456
Energy: 0.9813688518513926
Energy: 1.1402025903055255
Energy: 0.981368851850244
Energy: 1.140202590304377
Energy: 1.4922515101031022
Energy: 1.3116137847649803
Energy: 1.492251510095206
Energy: 1.3116137847649803
Energy: 1.4922515101066194
Energy: 1.3116137847641904
Energy: 1.010678816707304
Energy: 1.0553918494966759
Energy: 1.0106788167080938
Energy: 1.0553918494963168
Energy: 1.0106788167080938
Energy: 1.0553918494955272
Energy: 1.0035012970746262
Energy: 1.0354645720143483
Energy: 1.0035012970706783
Energy: 1.0354645720139894
Energy: 1.003501297079364
Energy: 1.0354645720139894
Energy: 1.0336044884164393
Energy: 1.3560235966660803
Energy: 1.0336044884164393
Energy: 1.3560235966660803
Energy: 1.0336044884152191
Energy: 1.3560235966668697
Energy: 1.1400107698223414
Energy: 1.0357539200638504
Energy: 1.140010769821552
Energy: 1.0357539200638504
Energy: 1.1400107698207622
Energy: 1.0357539200642814
Energy: 1.1192347138520229
Energy: 1.0103509482859638
Energy: 1.1192347138508023
Energy: 1.0103509482855333
Energy: 1.1192347138520229
Energy: 1.0103509482855333
Energy: 1.0562234489657079
Energy: 1.307923594213956
Energy: 1.0562234489664974
Energy: 1.307923594210008
Energy: 1.0562234489657079
Energy: 1.307923594210367
Energy: 1.016401274252196
Energy: 1.4084201430656513
Energy: 1.016401274252196
Energy: 1.4084201430652206
Energy: 1.0164012742514064
Energy: 1.4084201430640721
Energy: 1.0525852856372864
Energy: 0.9985439963010564
Energy: 1.0525852856364966
Energy: 0.9985439963010564
Energy: 1.0525852856364966
Energy: 0.998543996301487
Energy: 1.0111762666204065
Energy: 1.6077858337749933
Energy: 1.0111762666199757
Energy: 1.6077858337749933
Energy: 1.0111762666199757
Energy: 1.6077858337753521
Energy: 1.590225795687204
Energy: 1.0745914372860002
Energy: 1.5902257956860553
Energy: 1.0745914372860002
Energy: 1.5902257956868449
Energy: 1.074591437286431
Energy: 1.087461327285374
Energy: 1.1100721198748211
Energy: 1.0874613272861635
Energy: 1.1100721198748211
Energy: 1.087461327285733
Energy: 1.110072119875611
Energy: 1.087515058132689
Energy: 1.110057112009997
Energy: 1.087515058132689
Energy: 1.1100571120095661
Energy: 1.0875150581318993
Energy: 1.110057112009997
Energy: 1.589544343917587
Energy: 1.074206010592779
Energy: 1.589544343917587
Energy: 1.074206010592779
Energy: 1.5895443439167973
Energy: 1.0742060105932096
Energy: 1.0111173793115145
Energy: 1.6076466136919698
Energy: 1.011117379311945
Energy: 1.6076466136919698
Energy: 1.011117379311945
Energy: 1.6076466136915393
Energy: 1.052607250556516
Energy: 0.9989310805898038
Energy: 1.052607250556516
Energy: 0.9989310805898038
Energy: 1.0526072505553676
Energy: 0.9989310805905933
Energy: 1.0168611519034885
Energy: 1.4084229352262485
Energy: 1.016861151904278
Energy: 1.4084229352262485
Energy: 1.016861151904278
Energy: 1.4084229352262485
Energy: 1.0565063103655976
Energy: 1.3059855752770244
Energy: 1.0565063103663872
Energy: 1.3059855752766658
Energy: 1.0565063103652388
Energy: 1.3059855752770244
Energy: 1.1193189366296712
Energy: 1.0103488891466665
Energy: 1.1193189366308196
Energy: 1.0103488891466665
Energy: 1.1193189366296712
Energy: 1.0103488891474564
Energy: 1.1402107466243203
Energy: 1.035733351261241
Energy: 1.1402107466231002
Energy: 1.0357333512616718
Energy: 1.1402107466251101
Energy: 1.035733351261241
Energy: 1.0336066012922966
Energy: 1.3558014348342042
Energy: 1.033606601291866
Energy: 1.3558014348353529
Energy: 1.0336066012915073
Energy: 1.3558014348353529
Energy: 1.003320791084107
Energy: 1.0349674936112232
Energy: 1.0033207910821689
Energy: 1.0349674936108646
Energy: 1.0033207910777902
Energy: 1.0349674936108646
Energy: 1.0107104228297636
Energy: 1.0550453158131088
Energy: 1.0107104228294048
Energy: 1.0550453158119601
Energy: 1.010710422828974
Energy: 1.0550453158103807
Energy: 1.492218800069992
Energy: 1.31122904988554
Energy: 1.4922188000703511
Energy: 1.3112290498858987
Energy: 1.492218800069992
Energy: 1.3112290498858987
Energy: 0.9816340064916063
Energy: 1.140069240684807
Energy: 0.9816340064908164
Energy: 1.140069240684807
Energy: 0.9816340064908164
Energy: 1.1400692406844481

minimum gb energy = 0.981368851850244 eV
minimum distance =  2.31840584034446 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.09927559703827
Energy: 1.020467269890092
Energy: 1.09927559703827
Energy: 1.020467269890092
Energy: 1.09927559703827
Energy: 1.020467269890092
Energy: 1.0678761571103885
Energy: 0.9920447921094085
Energy: 1.0678761571103885
Energy: 0.9920447921094085
Energy: 1.0678761571103885
Energy: 0.9920447921094085
Energy: 1.4399129614443895
Energy: 1.285963980645811
Energy: 1.4399129614443895
Energy: 1.2859639806431722
Energy: 1.4399129614443895
Energy: 1.285963980645811
Energy: 1.06788917424171
Energy: 0.9920557160027181
Energy: 1.06788917424171
Energy: 0.9920557160027181
Energy: 1.06788917424171
Energy: 0.9920557160027181
Energy: 1.09927559703827
Energy: 1.020467269890092
Energy: 1.09927559703827
Energy: 1.020467269890092
Energy: 1.09927559703827
Energy: 1.020467269890092
Energy: 1.0678761571103885
Energy: 0.9920447921094085
Energy: 1.0678761571103885
Energy: 0.9920447921094085
Energy: 1.0678761571103885
Energy: 0.9920447921094085
Energy: 1.0405860509843068
Energy: 1.2859639806431722
Energy: 1.0405860509843068
Energy: 1.2859639806431722
Energy: 1.0405860509843068
Energy: 1.2859639806431722

minimum gb energy = 0.9920447921094085 eV
minimum distance =  2.31967193867554 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.628905262580011
Energy: 1.1887794551051563
Energy: 1.5913747290708364
Energy: 1.188779455108747
Energy: 1.628905262580011
Energy: 1.188779455108747
Energy: 1.207785188493329
Energy: 1.121347302982427
Energy: 1.2077851884969197
Energy: 1.121347302982427
Energy: 1.2077851885005104
Energy: 1.121347302982427
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Energy: 1.2827553441571298
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Energy: 1.2680706629339675
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Energy: 1.2680706629375582
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Energy: 1.4176240735602212
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Energy: 1.1219164834647606
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Energy: 1.1219164834683513
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Energy: 1.3487078613013699
Energy: 1.3032589559237815
Energy: 1.2247005221608083
Energy: 1.3032589559237815
Energy: 1.2247005221608083
Energy: 1.3032589559237815
Energy: 1.2247005221608083
Energy: 1.1462735847230832
Energy: 1.357843203216724
Energy: 1.1462793572946242
Energy: 1.357843202520399
Energy: 1.1462735847266738
Energy: 1.3578432034392136
Energy: 1.5523110639845004
Energy: 1.1226073288534342
Energy: 1.552311063988091
Energy: 1.1226073288498433
Energy: 1.5523110639845004
Energy: 1.1226073288498433
Energy: 1.1874001807983783
Energy: 1.4458401498826643
Energy: 1.1874001807947876
Energy: 1.4458401498826643
Energy: 1.1874001807947876
Energy: 1.4458401498826643
Energy: 1.3117950728417658
Energy: 1.122834896621553
Energy: 1.311795072838175
Energy: 1.1228348966179622
Energy: 1.3117950728417658
Energy: 1.1228348966179622
Energy: 1.2179687301808304
Energy: 1.194375636461548
Energy: 1.2179687301808304
Energy: 1.194375636461548
Energy: 1.2179687301808304
Energy: 1.194375636461548
Energy: 1.395003977153264
Energy: 1.1291139597164157
Energy: 1.3950039771568548
Energy: 1.1291139597164157
Energy: 1.3950039771568548
Energy: 1.1291139597164157
Energy: 1.2834496831223543
Energy: 1.2899117044952464
Energy: 1.2834492516102076
Energy: 1.289911704491721
Energy: 1.2834496831258797
Energy: 1.289911704491721
Energy: 1.2258964724487684
Energy: 1.191682512114927
Energy: 1.225896472452359
Energy: 1.191682512114927
Energy: 1.2258964724487684
Energy: 1.1916825121113361
Energy: 1.1458489851552827
Energy: 1.2631029044830502
Energy: 1.1458489851552827
Energy: 1.2631029044830502
Energy: 1.1458489851552827
Energy: 1.2631029044830502
Energy: 1.2290395291698113
Energy: 1.2318709036752442
Energy: 1.229039529173402
Energy: 1.2318709036752442
Energy: 1.2290395291698113
Energy: 1.2318709036752442
Energy: 1.2849273820576406
Energy: 1.2217887884287775
Energy: 1.2848491935345978
Energy: 1.2217887884287775
Energy: 1.2849265684116282
Energy: 1.2217887884287775

minimum gb energy = 1.0755653711434736 eV
minimum distance =  2.27866396327628 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.5446015377218263
Energy: 1.2017136889381166
Energy: 1.4355646591378683
Energy: 1.2017136889381166
Energy: 1.5446015377218263
Energy: 1.2017136889381166
Energy: 1.1777027208330153
Energy: 1.3783898714975367
Energy: 1.1777027208320299
Energy: 1.3782004188352126
Energy: 1.1777027208320299
Energy: 1.3783898714985223
Energy: 1.1245714455193567
Energy: 1.2882996296446299
Energy: 1.364967703354018
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Energy: 1.1245714455173854
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Energy: 1.121264489242202
Energy: 1.2683994688426283
Energy: 1.1212644892407235
Energy: 1.2683994688445994
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Energy: 1.2273792168016462
Energy: 1.2310842196496745
Energy: 1.2273792168026318
Energy: 1.2310842196501672
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Energy: 1.2310842196491816
Energy: 1.1350337590383093
Energy: 1.1052752706498237
Energy: 1.1350337590358452
Energy: 1.0418252480703907
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Energy: 1.0899993595290454
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Energy: 1.089999359530031
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Energy: 1.0899993595329882
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Energy: 1.0468565255822022
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Energy: 1.0468565255802307
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Energy: 1.1525580768068628
Energy: 1.2684547492056426
Energy: 1.3696840072987733
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Energy: 1.369684007299266
Energy: 1.2684547492021931
Energy: 1.3696840073002516
Energy: 1.2302164990610707
Energy: 1.1308487169463348
Energy: 1.2302164990630418
Energy: 1.1308487169458419
Energy: 1.2302164990620563
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Energy: 1.1693436872586607
Energy: 1.1417005414882408
Energy: 1.0421657422690285
Energy: 1.1417005414907049
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Energy: 1.0162373365987425
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Energy: 1.3507611225163025
Energy: 1.2119618526923142
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Energy: 1.26781671182086
Energy: 1.347665364243114
Energy: 1.26781671182086
Energy: 1.347665364243114
Energy: 1.267816711818396
Energy: 1.3476653642440997
Energy: 1.3038815892889775
Energy: 1.5485021811765205
Energy: 1.3038815892909488
Energy: 1.5485021811760278
Energy: 1.3038815892899631
Energy: 1.5485021811745494
Energy: 1.133823717176611
Energy: 1.1208932731051944
Energy: 1.1338237171780894
Energy: 1.1208932731189931
Energy: 1.133823717179075
Energy: 1.1208932731160364
Energy: 1.2043931726628525
Energy: 1.3294006589201737
Energy: 1.2043931726643309
Energy: 1.2664613232152973
Energy: 1.2043931726633452
Energy: 1.329400658922145
Energy: 1.2859968720722739
Energy: 1.1725457107101767
Energy: 1.286053254020924
Energy: 1.1725457107106696
Energy: 1.2859968720737522
Energy: 1.1725457107106696
Energy: 1.2911446705073995
Energy: 1.093208920990823
Energy: 1.2911446705093708
Energy: 1.0930892741066431
Energy: 1.2911446705098635
Energy: 1.093208920990823
Energy: 1.2687862559888066
Energy: 1.300543027000737
Energy: 1.2687862559892993
Energy: 1.3005430270022154
Energy: 1.2687862559883138
Energy: 1.3005430270022154
Energy: 1.0461986721945453
Energy: 1.262316407643499
Energy: 1.0461986721940526
Energy: 1.2623164076425135
Energy: 1.0461986721945453
Energy: 1.2623164076430062
Energy: 1.0421769308366786
Energy: 1.3361308608176492
Energy: 1.0421769308371716
Energy: 1.336130860815678
Energy: 1.0421769308366786
Energy: 1.336130860815678
Energy: 1.043024399241463
Energy: 1.013366539438921
Energy: 1.043024399241956
Energy: 1.0133665394379356
Energy: 1.0430243992399846
Energy: 1.0133665394403997
Energy: 1.3154083349865104
Energy: 1.6870544878565361
Energy: 1.2139683885149808
Energy: 1.687054487854565
Energy: 1.315408334987496
Energy: 1.6870544878575218
Energy: 1.5450597679135314
Energy: 1.2219213033302925
Energy: 1.545059767916981
Energy: 1.2219213033347278
Energy: 1.5450597679184594
Energy: 1.221921303331771
Energy: 1.1311708191245748
Energy: 1.0964983186196195
Energy: 1.1311708191250676
Energy: 1.0964983186166628
Energy: 1.131170819124082
Energy: 1.0964983186181412
Energy: 1.140308477506432
Energy: 1.0482244202131306
Energy: 1.140308477505939
Energy: 1.1061810999141182
Energy: 1.1403084775069248
Energy: 1.048224420214609

minimum gb energy = 1.0133665394379356 eV
minimum distance =  2.33629902145624 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.62896448778683
Energy: 1.1733948094444284
Energy: 1.6289644877874354
Energy: 1.1733948094444284
Energy: 1.62896448778683
Energy: 1.1733948094444284
Energy: 1.3105181240127717
Energy: 1.0937910263765358
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Energy: 1.310518124013377
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Energy: 1.2239952631501911
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Energy: 1.1699967227964188
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Energy: 1.363692264016188
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Energy: 1.291375784230495
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Energy: 1.071935513783803
Energy: 1.3678831640209717
Energy: 1.0719355137844082
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Energy: 1.0719355137844082
Energy: 1.3678831640215772
Energy: 1.3528494883797817
Energy: 1.2191747982232495
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Energy: 1.2191747982232495
Energy: 1.3528494883797817
Energy: 1.2191747982232495
Energy: 1.177771086984075
Energy: 1.2718279251058495
Energy: 1.177771086984075
Energy: 1.271827925105244
Energy: 1.177771086984075
Energy: 1.271827925105244
Energy: 1.3030829780645057
Energy: 1.0938090402183678
Energy: 1.3030829780632949
Energy: 1.0938090402189729
Energy: 1.3030829780645057
Energy: 1.0938090402189729
Energy: 1.3232359467837573
Energy: 1.1626247274805104
Energy: 1.3232359467825467
Energy: 1.1626247274811157
Energy: 1.323235946783152
Energy: 1.1626247274805104
Energy: 1.3641291893974001
Energy: 1.1165937158081887
Energy: 1.3641291893974001
Energy: 1.1165937158081887
Energy: 1.3641291893974001
Energy: 1.1165937158081887
Energy: 1.3083529633290245
Energy: 1.0942460610729672
Energy: 1.3083529633290245
Energy: 1.0942460610729672
Energy: 1.3083529633290245
Energy: 1.0942460610729672
Energy: 1.178085222267034
Energy: 1.2230804764974184
Energy: 1.178085222267034
Energy: 1.223080476496813
Energy: 1.178085222267034
Energy: 1.2230804764974184
Energy: 1.3795877758368886
Energy: 1.2516342734976444
Energy: 1.3795877758368886
Energy: 1.2516342734976444
Energy: 1.3795877758368886
Energy: 1.2516342734976444
Energy: 1.0720174667015807
Energy: 1.3455197000682468
Energy: 1.0720174667021862
Energy: 1.3455197000682468
Energy: 1.0720174667021862
Energy: 1.3455197000682468
Energy: 1.271415873224806
Energy: 1.5882294024786143
Energy: 1.2714158732260166
Energy: 1.5882294024786143
Energy: 1.271415873224806
Energy: 1.5882294024786143
Energy: 1.134056020899905
Energy: 1.1421109170166124
Energy: 1.134056020899905
Energy: 1.142110917017218
Energy: 1.134056020899905
Energy: 1.142110917017218
Energy: 1.36708143079427
Energy: 1.2676875144670419
Energy: 1.3670814307948476
Energy: 1.2676875144670419
Energy: 1.3670814307948476
Energy: 1.2676875144670419
Energy: 1.153681359350212
Energy: 1.2474657035851882
Energy: 1.153681359350212
Energy: 1.2474657035845829
Energy: 1.1536813593508173
Energy: 1.2474657035839776
Energy: 1.5319033156452644
Energy: 1.0697305622425983
Energy: 1.5319033156446593
Energy: 1.0697305622425983
Energy: 1.5319033156452644
Energy: 1.0697305622432034
Energy: 1.1339801454381429
Energy: 1.2884217377084923
Energy: 1.133980145436932
Energy: 1.2884217377084923
Energy: 1.1339801454375376
Energy: 1.2884217377084923
Energy: 1.2268135927958939
Energy: 1.2885048912801012
Energy: 1.2268135927958939
Energy: 1.2885048912794959
Energy: 1.2268135927958939
Energy: 1.2885048912801012
Energy: 1.2770650929513916
Energy: 1.1932613804706391
Energy: 1.2770650929513916
Energy: 1.1932613804706391
Energy: 1.2770650929513916
Energy: 1.1932613804706391

minimum gb energy = 1.0693943750665538 eV
minimum distance =  2.3002282659744 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.2437140310308052
Energy: 1.1841688336039033
Energy: 1.2437140310308052
Energy: 1.1841688336039033
Energy: 1.2437140310308052
Energy: 1.1841688336039033
Energy: 1.395872424503865
Energy: 1.1077702518094823
Energy: 1.395872424503865
Energy: 1.1077702518079144
Energy: 1.3958724245046488
Energy: 1.1077702518086983
Energy: 1.2113647726329528
Energy: 1.355986715110211
Energy: 1.2113647726329528
Energy: 1.355986715109427
Energy: 1.2113647726329528
Energy: 1.355986715109427
Energy: 1.591846524717964
Energy: 1.1536062229232686
Energy: 1.5918465247171807
Energy: 1.1536062229232686
Energy: 1.591846524717964
Energy: 1.1536062229232686
Energy: 1.6017086780930154
Energy: 1.2852844507984198
Energy: 1.6017086780930154
Energy: 1.2852844507984198
Energy: 1.6017086780930154
Energy: 1.2852844507984198
Energy: 1.3361422166440344
Energy: 1.1075560017549
Energy: 1.3361422166440344
Energy: 1.1075560017549
Energy: 1.3361422166432506
Energy: 1.1075560017549
Energy: 1.2417483337405493
Energy: 1.3996354651400678
Energy: 1.2417483337397657
Energy: 1.3996354651400678
Energy: 1.2417483337405493
Energy: 1.3996354651392837
Energy: 1.3650063212836026
Energy: 1.2617536573675046
Energy: 1.3650063212828185
Energy: 1.2617536573675046
Energy: 1.3650063212828185
Energy: 1.2617536573682884
Energy: 1.540129006878459
Energy: 1.107935458858642
Energy: 1.540129006878459
Energy: 1.107935458858642
Energy: 1.540129006878459
Energy: 1.107935458859426
Energy: 1.088510760966467
Energy: 1.1782155906252871
Energy: 1.088510760966467
Energy: 1.1782155906245035
Energy: 1.0885107609656834
Energy: 1.1782155906245035
Energy: 1.2698782902936252
Energy: 1.155407079834548
Energy: 1.2698782902920576
Energy: 1.155407079834548
Energy: 1.2698782902928414
Energy: 1.155407079834548
Energy: 1.4373288942414566
Energy: 1.4487689778493686
Energy: 1.4373288942414566
Energy: 1.4487689778493686
Energy: 1.437328894240673
Energy: 1.4487689778493686
Energy: 1.2776627911422878
Energy: 1.1079660297464864
Energy: 1.2776627911430714
Energy: 1.1079660297464864
Energy: 1.2776627911422878
Energy: 1.1079660297472702
Energy: 1.2402141796748714
Energy: 1.1182076935225396
Energy: 1.2402141796740875
Energy: 1.118207693523323
Energy: 1.2402141796748714
Energy: 1.118207693523323
Energy: 1.2819869167856723
Energy: 1.317619717497946
Energy: 1.2819869167856723
Energy: 1.317619717497946
Energy: 1.2819869167856723
Energy: 1.317619717497946
Energy: 1.3065694184598373
Energy: 1.3264537106018162
Energy: 1.3065694184590535
Energy: 1.3264537106025995
Energy: 1.3065694184582697
Energy: 1.3264537106018162
Energy: 1.0878385248530889
Energy: 1.2651720452373503
Energy: 1.0878385248523053
Energy: 1.2651720452373503
Energy: 1.0878385248530889
Energy: 1.2651720452365667
Energy: 1.3105046754841878
Energy: 1.056660871505471
Energy: 1.3105046754841878
Energy: 1.056660871505471
Energy: 1.3105046754841878
Energy: 1.056660871505471
Energy: 1.0888711123166595
Energy: 1.1998154614921597
Energy: 1.0888711123158759
Energy: 1.1998154614921597
Energy: 1.0888711123166595
Energy: 1.1998154614921597
Energy: 1.3621973162375
Energy: 1.1081911262393058
Energy: 1.362197316238284
Energy: 1.1081911262393058
Energy: 1.362197316238284
Energy: 1.1081911262400896
Energy: 1.2589062434456788
Energy: 1.3230888895732524
Energy: 1.2589062434456788
Energy: 1.323088889574036
Energy: 1.2589062434456788
Energy: 1.323088889574036
Energy: 1.3761475242542676
Energy: 1.1333012879581672
Energy: 1.3761475242542676
Energy: 1.1333012879581672
Energy: 1.3761475242542676
Energy: 1.1333012879581672
Energy: 1.2194710986771184
Energy: 1.1082922397017276
Energy: 1.2194710986771184
Energy: 1.1082922397009438
Energy: 1.2194710986771184
Energy: 1.1082922397017276
Energy: 1.2999337591702333
Energy: 1.4487926872769876
Energy: 1.299933759171017
Energy: 1.4487926872769876
Energy: 1.299933759171017
Energy: 1.4487926872769876

minimum gb energy = 1.056660871505471 eV
minimum distance =  2.26430100427383 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.2014415682944402
Energy: 1.0619578295708734
Energy: 1.2014415682933317
Energy: 1.0619578295708734
Energy: 1.2014415682944402
Energy: 1.0619578295708734
Energy: 1.0184570127095798
Energy: 1.0020460694447852
Energy: 1.0184570127095798
Energy: 1.0020460694447852
Energy: 1.0184570127095798
Energy: 1.0020460694436768
Energy: 1.2461040056454582
Energy: 1.1771540957391144
Energy: 1.2461040056454582
Energy: 1.1771540957391144
Energy: 1.2461040056454582
Energy: 1.1771540957391144
Energy: 0.9583577582066809
Energy: 1.213600615805133
Energy: 0.9583577582077892
Energy: 1.213600615805133
Energy: 0.9583577582077892
Energy: 1.213600615805133
Energy: 1.2038340340085971
Energy: 1.1660252056631466
Energy: 1.2038340340097051
Energy: 1.1660252056631466
Energy: 1.2038340340097051
Energy: 1.1660252056631466
Energy: 1.1293241920043509
Energy: 1.167508788585713
Energy: 1.1293241920043509
Energy: 1.167508788585713
Energy: 1.1293241920043509
Energy: 1.167508788585713
Energy: 1.1229442491514163
Energy: 1.018561344481947
Energy: 1.1229442491514163
Energy: 1.018561344481947
Energy: 1.122944249152525
Energy: 1.018561344481947
Energy: 0.9578741993139542
Energy: 1.1978188071966143
Energy: 0.9578741993139542
Energy: 1.1978188071955058
Energy: 0.9578741993139542
Energy: 1.1978188071977225
Energy: 1.1817713089142918
Energy: 1.0021662483275455
Energy: 1.1817713089154003
Energy: 1.0021662483286538
Energy: 1.1817713089142918
Energy: 1.0021662483286538
Energy: 1.06327121215772
Energy: 1.0205808201353461
Energy: 1.06327121215772
Energy: 1.0205808201353461
Energy: 1.06327121215772
Energy: 1.0205808201353461
Energy: 1.061764627305933
Energy: 1.209253822159322
Energy: 1.061764627305933
Energy: 1.2092538221582136
Energy: 1.0617646273070414
Energy: 1.209253822159322
Energy: 1.1683814250575444
Energy: 1.1405534115851046
Energy: 1.1683814250575444
Energy: 1.1405534115851046
Energy: 1.1683814250575444
Energy: 1.1405534115851046
Energy: 0.9580086718655024
Energy: 1.1649308933535354
Energy: 0.9580086718643942
Energy: 1.1649308933535354
Energy: 0.9580086718643942
Energy: 1.1649308933535354
Energy: 1.080077626914592
Energy: 1.2082256120162507
Energy: 1.0800776269134833
Energy: 1.2082256120162507
Energy: 1.0800776269134833
Energy: 1.2082256120162507
Energy: 1.1285966879415248
Energy: 1.3896531525514106
Energy: 1.1285966879426332
Energy: 1.3896531525514106
Energy: 1.1285966879426332
Energy: 1.3896531525514106
Energy: 1.127164576554622
Energy: 1.4078148228206027
Energy: 1.127164576554622
Energy: 1.4078148228206027
Energy: 1.127164576554622
Energy: 1.4078148228206027
Energy: 1.0777213421067873
Energy: 1.2338431283142435
Energy: 1.0777213421067873
Energy: 1.2338431283142435
Energy: 1.0777213421067873
Energy: 1.233843128315352

minimum gb energy = 0.9578741993139542 eV
minimum distance =  2.29141558911672 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.076094670479956
Energy: 0.9615556226084583
Energy: 1.076094670479528
Energy: 0.9615556226088863
Energy: 1.0760946704803842
Energy: 0.9615556226084583
Energy: 1.142988617757514
Energy: 1.0241633156562715
Energy: 1.1429886177579418
Energy: 1.0241633156571275
Energy: 1.1429886177570858
Energy: 1.0241633156571275
Energy: 1.097225320315361
Energy: 1.0266249111500394
Energy: 1.0972253203140767
Energy: 1.0266249111504675
Energy: 1.0972253203157887
Energy: 1.0266249111504675
Energy: 1.2659394107299529
Energy: 1.0505234524891693
Energy: 1.2659394107316648
Energy: 1.0505234524891693
Energy: 1.2659394107299529
Energy: 1.0505234524891693
Energy: 1.394105485967618
Energy: 1.1572491179797901
Energy: 1.3941054859671902
Energy: 1.1572491179785058
Energy: 1.394105485967618
Energy: 1.157249117978934
Energy: 1.0561720550703213
Energy: 1.0066985977765328
Energy: 1.0561720550707492
Energy: 0.9691746605450147
Energy: 1.0561720550707492
Energy: 1.0066985977735365
Energy: 1.1287763599998502
Energy: 0.9990321927682577
Energy: 1.1287763600007061
Energy: 0.999032192769114
Energy: 1.1287763600007061
Energy: 0.9990321927686859
Energy: 1.2631597591249484
Energy: 1.2482673539103568
Energy: 1.2631597591266601
Energy: 1.2482673539103568
Energy: 1.263159759125376
Energy: 1.2482673539103568
Energy: 1.0339383643178321
Energy: 1.01642771993494
Energy: 1.0339383643186881
Energy: 1.0164277199345124
Energy: 1.033938364317443
Energy: 1.01642771993494
Energy: 0.9705786999533133
Energy: 0.881914242171233
Energy: 0.9705786999528853
Energy: 0.8819142421708049
Energy: 0.9705786999533133
Energy: 0.8819142421716611
Energy: 0.891023931795215
Energy: 1.2253054479869236
Energy: 0.8910239317956432
Energy: 1.2253054479873517
Energy: 0.891023931795215
Energy: 1.2253054479873517
Energy: 1.1048259969236347
Energy: 0.9376963488197901
Energy: 1.1048259969236347
Energy: 0.937696348820646
Energy: 1.104825996924491
Energy: 0.937696348820218
Energy: 1.1653964330632496
Energy: 0.9837352855475894
Energy: 1.1653964330636775
Energy: 0.9837352855467333
Energy: 1.1653964330632496
Energy: 0.9837352855467333
Energy: 0.9825165358480058
Energy: 1.0958396574897689
Energy: 0.9825165358488618
Energy: 1.0958396574897689
Energy: 0.9825165358492899
Energy: 1.0958396574893412
Energy: 1.0645785424300505
Energy: 1.2999464988339726
Energy: 1.0645785424304786
Energy: 1.2999464988339726
Energy: 1.0645785424279104
Energy: 1.2999464988344007
Energy: 0.8917632107936149
Energy: 1.1529180801278345
Energy: 0.8917632107953267
Energy: 1.1529180801269785
Energy: 0.8917632107936149
Energy: 1.1529180801274066
Energy: 0.980613388330278
Energy: 1.047629431353619
Energy: 0.980613388330706
Energy: 1.047629431353619
Energy: 0.980613388330278
Energy: 1.047629431353191
Energy: 1.0610204704203134
Energy: 1.267749157747281
Energy: 1.0610204704207413
Energy: 1.2677491577468532
Energy: 1.0610204704198851
Energy: 1.2677491577468532
Energy: 1.015303230186259
Energy: 1.4031489378215347
Energy: 1.0153032301854026
Energy: 1.4031489378211068
Energy: 1.0153032301854026
Energy: 1.4031489378211068
Energy: 0.9793365163910893
Energy: 0.9173110674400884
Energy: 0.9793365163928015
Energy: 0.9173110674400884
Energy: 0.9793365163915174
Energy: 0.9173110674435128
Energy: 1.0149674601719847
Energy: 1.4030098481215152
Energy: 1.014967460171557
Energy: 1.4030098481215152
Energy: 1.0149674601719847
Energy: 1.4030098481210869
Energy: 1.0601170809040097
Energy: 1.267715252681365
Energy: 1.0601170809057217
Energy: 1.267715252681365
Energy: 1.0601170809052938
Energy: 1.267715252681365
Energy: 0.9806501460346008
Energy: 1.0474327625274027
Energy: 0.9806501460341729
Energy: 1.0474327625269748
Energy: 0.9806501460341729
Energy: 1.0474327625269748
Energy: 0.8920568930315297
Energy: 1.2502495717128566
Energy: 0.8920568930311016
Energy: 1.2502495717128566
Energy: 0.8920568930323859
Energy: 1.2502495717128566
Energy: 1.0638758741203338
Energy: 1.2997339865138515
Energy: 1.0638758741173373
Energy: 1.2997339865134234
Energy: 1.0638758741207617
Energy: 1.2997339865138515
Energy: 0.9827376512444924
Energy: 1.095815515539557
Energy: 0.9827376512432083
Energy: 1.095815515539557
Energy: 0.9827376512444924
Energy: 1.095815515539557
Energy: 1.165405587062033
Energy: 0.9840308874224541
Energy: 1.1654055870624611
Energy: 0.984030887422882
Energy: 1.165405587062033
Energy: 0.98403088742331
Energy: 1.1042405473764214
Energy: 1.2829235662899436
Energy: 1.1042405473751373
Energy: 1.2829235662899436
Energy: 1.1042405473755654
Energy: 1.2829235662899436
Energy: 0.8907076956373823
Energy: 1.2253398408820255
Energy: 0.8907076956382384
Energy: 1.2253398408820255
Energy: 0.8907076956378103
Energy: 1.2253398408820255
Energy: 0.9720080812779218
Energy: 0.8814937880241716
Energy: 0.9720080812800619
Energy: 0.8814937880245995
Energy: 0.9720080812787777
Energy: 0.8814937880233155
Energy: 1.2437065235155458
Energy: 1.0160398695285153
Energy: 1.2437065235151177
Energy: 1.0160398695285153
Energy: 1.2437065235155458
Energy: 1.0160398695280874
Energy: 1.2631391179605196
Energy: 1.24821198310403
Energy: 1.2631391179605196
Energy: 1.24821198310403
Energy: 1.2631391179600917
Energy: 1.24821198310403
Energy: 1.1282404142015234
Energy: 0.999190461197723
Energy: 1.1282404142015234
Energy: 0.999190461198151
Energy: 1.1282404142019513
Energy: 0.999190461198151
Energy: 1.0561876242188428
Energy: 0.9363423876228262
Energy: 1.0561876242196988
Energy: 0.9363423876228262
Energy: 1.0561876242192707
Energy: 0.9363423876228262
Energy: 1.3941024213291688
Energy: 1.1572925822198044
Energy: 1.3941024213291688
Energy: 1.1572925822202322
Energy: 1.3941024213295972
Energy: 1.1572925822198044
Energy: 1.2657580783137834
Energy: 1.2722977910013782
Energy: 1.265758078314211
Energy: 1.2722977910013782
Energy: 1.265758078314211
Energy: 1.2722977910018065
Energy: 1.0972439033925452
Energy: 1.0269755903894702
Energy: 1.0972439033925452
Energy: 1.026975590389042
Energy: 1.0972439033925452
Energy: 1.026975590389042
Energy: 1.1430622727236999
Energy: 0.9347494737903838
Energy: 1.143062272724556
Energy: 0.9347494737890997
Energy: 1.1430622727241277
Energy: 0.9347494737903838
Energy: 1.076094670480812
Energy: 0.9615556226101705
Energy: 1.076094670480812
Energy: 0.9615556226105983
Energy: 1.076094670479956
Energy: 0.9615556226101705
Energy: 1.142988617757514
Energy: 0.9299219275056181
Energy: 1.142988617757514
Energy: 0.9299219275047621
Energy: 1.142988617757514
Energy: 0.92992192750519
Energy: 1.097225320315361
Energy: 1.0266249111508958
Energy: 1.0972253203145048
Energy: 1.0266249111517516
Energy: 1.0972253203157887
Energy: 1.02662491115218
Energy: 1.2659394107290967
Energy: 1.0505234524891693
Energy: 1.2659394107299529
Energy: 1.0505234524891693
Energy: 1.2659394107290967
Energy: 1.0505234524895972
Energy: 1.3941054859667623
Energy: 1.1572491179780777
Energy: 1.3941054859671902
Energy: 1.1572491179785058
Energy: 1.394105485966334
Energy: 1.1572491179780777

minimum gb energy = 0.8814937880233155 eV
minimum distance =  2.2502056055334 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.9832795484399901
Energy: 0.8827388558705744
Energy: 0.9832795484399901
Energy: 0.8827388558712713
Energy: 0.9832795484406869
Energy: 0.8827388558705744
Energy: 1.0283038350318319
Energy: 0.8673203663421576
Energy: 1.0283038350311349
Energy: 0.8673203663428545
Energy: 1.0283038350318319
Energy: 0.8673203663442484
Energy: 1.0259130079958787
Energy: 0.9450772290737731
Energy: 1.025913007995182
Energy: 0.9450772290744699
Energy: 1.0259130079958787
Energy: 0.9450772290737731
Energy: 1.1769547324529135
Energy: 0.9893853341518815
Energy: 1.1769547324529135
Energy: 0.9893853341518815
Energy: 1.1769547324522165
Energy: 0.9893853341518815
Energy: 1.2407261931214666
Energy: 0.8603615084235525
Energy: 1.2407261931200726
Energy: 0.8603615084235525
Energy: 1.2407261931214666
Energy: 0.8603615084242495
Energy: 1.033141322641851
Energy: 0.8665825016484258
Energy: 1.0331413226404573
Energy: 0.8665825016484258
Energy: 1.033141322641154
Energy: 0.8665825016491226
Energy: 1.1569307150402095
Energy: 0.9595001727769111
Energy: 1.1569307150395125
Energy: 0.9595001727783049
Energy: 1.1569307150402095
Energy: 0.9595001727769111
Energy: 1.148470793178636
Energy: 1.1813859811700458
Energy: 1.1484707931800298
Energy: 1.181385981169349
Energy: 1.148470793178636
Energy: 1.181385981168652
Energy: 0.9038045177135666
Energy: 0.869407582542767
Energy: 0.9038045177142635
Energy: 0.869407582542767
Energy: 0.9038045177142635
Energy: 0.8694075825434641
Energy: 1.0286531189415007
Energy: 0.91753140920575
Energy: 1.0286531189421975
Energy: 0.9175314092071439
Energy: 1.0286531189408037
Energy: 0.91753140920575
Energy: 1.1507387709868102
Energy: 1.1537088116002343
Energy: 1.150738770987507
Energy: 1.1537088116002343
Energy: 1.150738770988204
Energy: 1.1537088116002343
Energy: 0.946093400786894
Energy: 1.1808276324251268
Energy: 0.946093400786197
Energy: 1.1808276324251268
Energy: 0.9460934007875909
Energy: 1.1808276324251268
Energy: 1.0289931807229193
Energy: 1.030769636580709
Energy: 1.0289931807222223
Energy: 1.030769636580709
Energy: 1.0289931807229193
Energy: 1.030769636580709
Energy: 1.0290627758298174
Energy: 1.0597411740613023
Energy: 1.0290627758298174
Energy: 1.0597411740613023
Energy: 1.0290627758291204
Energy: 1.0597411740613023
Energy: 1.0100342486267857
Energy: 1.1981938286252518
Energy: 1.0100342486267857
Energy: 1.198193828624555
Energy: 1.0100342486274825
Energy: 1.1981938286252518
Energy: 1.0582222526257279
Energy: 1.0515944011089056
Energy: 1.0582222526264247
Energy: 1.0515944011089056
Energy: 1.0582222526257279
Energy: 1.0515944011089056
Energy: 0.9057419511340037
Energy: 1.0269043877333954
Energy: 0.9057419511319129
Energy: 1.0269043877340922
Energy: 0.9057419511333068
Energy: 1.0269043877340922
Energy: 1.10809833894751
Energy: 1.2095092685339852
Energy: 1.108098338948904
Energy: 1.2095092685339852
Energy: 1.10809833894751
Energy: 1.2095092685346824
Energy: 0.8369801136943649
Energy: 1.0779981378098569
Energy: 0.8369801136929709
Energy: 1.07799813780916
Energy: 0.8369801136936678
Energy: 1.0779981378098569
Energy: 1.0319037848351877
Energy: 0.9911288950571608
Energy: 1.0319037848337937
Energy: 0.9911288950564637
Energy: 1.0319037848344905
Energy: 0.9911288950571608
Energy: 0.9910163833420079
Energy: 1.1776174294583561
Energy: 0.9910163833427047
Energy: 1.1776174294583561
Energy: 0.9910163833420079
Energy: 1.1776174294583561
Energy: 0.8261011585604592
Energy: 1.0817297626170859
Energy: 0.8261011585618531
Energy: 1.0817297626177829
Energy: 0.8261011585632471
Energy: 1.0817297626177829
Energy: 0.9029701597424837
Energy: 0.9458649393023609
Energy: 0.9029701597424837
Energy: 0.945864939303058
Energy: 0.9029701597417866
Energy: 0.945864939303058
Energy: 0.9296379887869678
Energy: 1.310413956060725
Energy: 0.9296379887890587
Energy: 1.310413956060725
Energy: 0.9296379887862708
Energy: 1.310413956060725
Energy: 0.9353319511429345
Energy: 1.1755520311454288
Energy: 0.9353319511415407
Energy: 1.1755520311454288
Energy: 0.9353319511422374
Energy: 1.1755520311454288
Energy: 0.8821519612687208
Energy: 0.9454834616565523
Energy: 0.8821519612673268
Energy: 0.9454834616565523
Energy: 0.8821519612680236
Energy: 0.9454834616565523
Energy: 0.8262888575949031
Energy: 1.0779458461814533
Energy: 0.8262888575969938
Energy: 1.0779458461821503
Energy: 0.8262888575955999
Energy: 1.0779458461814533

minimum gb energy = 0.8261011585604592 eV
minimum distance =  2.26555675510402 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.1219404805940514
Energy: 0.795438562608709
Energy: 1.1219404805940514
Energy: 0.7954385626082012
Energy: 1.1219404805935436
Energy: 0.7954385626082012
Energy: 0.8899530899596275
Energy: 0.9318904685771604
Energy: 0.8899530899596275
Energy: 0.9318904685776682
Energy: 0.8899530899596275
Energy: 0.9318904685776682
Energy: 0.8784738405830531
Energy: 0.9322936700011264
Energy: 0.8784738405825453
Energy: 0.9322936700011264
Energy: 0.8784738405825453
Energy: 0.9322936700006187
Energy: 1.063764076742195
Energy: 0.8514407739553793
Energy: 1.063764076742195
Energy: 0.8514407739553793
Energy: 1.0637640767427028
Energy: 0.8514407739553793
Energy: 1.0373554319448401
Energy: 0.8903893388096739
Energy: 1.0373554319448401
Energy: 0.8903893388096739
Energy: 1.0373554319448401
Energy: 0.8903893388096739
Energy: 0.8714384364582691
Energy: 0.8882668663924029
Energy: 0.8714384364572536
Energy: 0.8882668663929107
Energy: 0.8714384364572536
Energy: 0.8882668663929107
Energy: 0.9996552489662957
Energy: 0.946695336898442
Energy: 0.999655248965788
Energy: 0.946695336898442
Energy: 0.999655248965788
Energy: 0.946695336898442
Energy: 1.0866231155252244
Energy: 0.9932723516993978
Energy: 1.0866231155247166
Energy: 0.9932723516993978
Energy: 1.0866231155247166
Energy: 0.99327235169889
Energy: 0.8449364397333526
Energy: 0.8781716388942469
Energy: 0.8449364397333526
Energy: 0.8781716388942469
Energy: 0.8449364397338606
Energy: 0.8781716388942469
Energy: 0.8936575246165097
Energy: 0.7888025618947324
Energy: 0.8936575246160019
Energy: 0.7888025618952402
Energy: 0.8936575246165097
Energy: 0.7888025618952402
Energy: 0.9811839646539813
Energy: 0.9912858889951404
Energy: 0.9811839646529656
Energy: 0.9912858889951404
Energy: 0.9811839646529656
Energy: 0.9912858889951404
Energy: 0.7594685781747732
Energy: 0.877568519426331
Energy: 0.7594685781742655
Energy: 0.8775685194268387
Energy: 0.7594685781747732
Energy: 0.8775685194268387
Energy: 0.8932223757640311
Energy: 0.7556621088042772
Energy: 0.8932223757635234
Energy: 0.755662108804785
Energy: 0.8932223757640311
Energy: 0.755662108804785
Energy: 1.0069116647418275
Energy: 0.9921458870138227
Energy: 1.0069116647408118
Energy: 0.9921458870138227
Energy: 1.0069116647408118
Energy: 0.9921458870138227
Energy: 0.9087518325949672
Energy: 0.8764837839742298
Energy: 0.9087518325959828
Energy: 0.8764837839737221
Energy: 0.9087518325944595
Energy: 0.8764837839737221
Energy: 0.914571401267441
Energy: 0.8707104663343649
Energy: 0.9145714012684564
Energy: 0.8707104663343649
Energy: 0.9145714012679487
Energy: 0.8707104663343649
Energy: 1.0224644481275122
Energy: 0.9722582534344002
Energy: 1.0224644481275122
Energy: 0.9722582534338925
Energy: 1.0224644481275122
Energy: 0.9722582534338925
Energy: 0.8129173347549218
Energy: 0.877065535848648
Energy: 0.8129173347564452
Energy: 0.8770655358491557
Energy: 0.8129173347554296
Energy: 0.8770655358496636
Energy: 0.8868486894635869
Energy: 0.8834055554948288
Energy: 0.8868486894625713
Energy: 0.8834055554948288
Energy: 0.886848689463079
Energy: 0.8834055554948288
Energy: 1.0546216982740133
Energy: 1.0264468088734586
Energy: 1.0546216982740133
Energy: 1.0264468088734586
Energy: 1.0546216982740133
Energy: 1.0264468088734586
Energy: 0.8683340867373837
Energy: 1.0313758536807978
Energy: 0.868334086736876
Energy: 1.03137585368029
Energy: 0.8683340867373837
Energy: 1.0313758536807978
Energy: 0.9415795633828098
Energy: 0.9042740470813053
Energy: 0.9415795633828098
Energy: 0.9042740470823211
Energy: 0.9415795633833175
Energy: 0.9042740470807976
Energy: 0.9551629603630435
Energy: 0.8804571736059692
Energy: 0.9551629603630435
Energy: 0.8804571736059692
Energy: 0.9551629603640589
Energy: 0.8804571736059692
Energy: 0.9422528008975551
Energy: 1.0766814040712016
Energy: 0.9422528008970473
Energy: 1.0766814040712016
Energy: 0.9422528008975551
Energy: 1.0766814040712016
Energy: 0.8902351086026857
Energy: 0.8688176799739467
Energy: 0.8902351086031934
Energy: 0.8688176799739467
Energy: 0.8902351086031934
Energy: 0.8688176799744544
Energy: 0.8893042320069126
Energy: 0.851074294775648
Energy: 0.889304232005897
Energy: 0.8510742947751402
Energy: 0.8893042320064048
Energy: 0.8510742947751402
Energy: 0.8554506257069814
Energy: 1.026955685234263
Energy: 0.844893352272474
Energy: 1.0269556852337551
Energy: 0.8554506257069814
Energy: 1.0269556852337551
Energy: 0.8608244597998838
Energy: 0.8627237151251294
Energy: 0.8608244597998838
Energy: 0.8627237151251294
Energy: 0.8608244598003916
Energy: 0.8627237151251294
Energy: 0.8721668617152304
Energy: 0.8139853548734641
Energy: 0.8721668617157381
Energy: 0.813985354873972
Energy: 0.8721668617147226
Energy: 0.813985354873972
Energy: 0.7845074228664018
Energy: 0.9976535915124143
Energy: 0.7845074228669097
Energy: 0.9976535915124143
Energy: 0.7845074228669097
Energy: 0.9976535915124143
Energy: 0.8494710013945197
Energy: 1.0908782992276342
Energy: 0.8494710013955351
Energy: 1.0908782992271264
Energy: 0.8494710013945197
Energy: 1.0908782992271264
Energy: 0.8725026819381252
Energy: 0.7841493511311816
Energy: 0.8725026819381252
Energy: 0.7841493511311816
Energy: 0.8725026819381252
Energy: 0.7841493511311816
Energy: 0.756702290474714
Energy: 0.8682261393205637
Energy: 0.756702290475222
Energy: 0.8682261393098999
Energy: 0.756702290475222
Energy: 0.8682261393200558
Energy: 1.0001753966751195
Energy: 0.9901696365244551
Energy: 1.0001753966751195
Energy: 0.9901696365244551
Energy: 1.0001753966751195
Energy: 0.9901696365244551
Energy: 0.8712375839928375
Energy: 0.8793540629077702
Energy: 0.8712375839923295
Energy: 0.8793540629077702
Energy: 0.8712375839928375
Energy: 0.8793540629077702
Energy: 0.6844763281885198
Energy: 0.8671639238041838
Energy: 0.6844763281890276
Energy: 0.8671639238036759
Energy: 0.6844763281895353
Energy: 0.8671639238041838

minimum gb energy = 0.6844763281885198 eV
minimum distance =  2.2620640310781 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.8889023560180127
Energy: 0.05007056447557674
Energy: 0.8889023560180127
Energy: 0.05007056447557674
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.8888882738611007
Energy: 0.050070549050777666
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8889023560180127
Energy: 0.05007056447371099
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.8888882738611007
Energy: 0.05007054905260102
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525
Energy: 0.048945959284412845
Energy: 0.10198550533158525

minimum gb energy = 0.048945959284412845 eV
minimum distance =  2.46592278669241 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.9492880426386638
Energy: 0.7948129183558734
Energy: 0.9492880426392223
Energy: 0.7948129183558734
Energy: 0.9492880426392223
Energy: 0.7948129183558734
Energy: 0.7898405980485769
Energy: 0.8742509173581852
Energy: 0.7898405980485769
Energy: 0.8742509173581852
Energy: 0.7898405980485769
Energy: 0.8742509173576268
Energy: 0.8144120992828145
Energy: 0.9021060667744101
Energy: 0.8144120992816979
Energy: 0.9021060667744101
Energy: 0.8144120992828145
Energy: 0.9021060667744101
Energy: 0.8849658097398925
Energy: 0.841630448412212
Energy: 0.8849658097404508
Energy: 0.841630448412212
Energy: 0.8849658097404508
Energy: 0.841630448412212
Energy: 0.6860401922515312
Energy: 0.8414082474561693
Energy: 0.6860401922509729
Energy: 0.8414082474561693
Energy: 0.6860401922504146
Energy: 0.8414082474561693
Energy: 0.8214735886943125
Energy: 0.8502052393024866
Energy: 0.8214735886943125
Energy: 0.8502052393019282
Energy: 0.8214735886937542
Energy: 0.8502052393019282
Energy: 0.8364215829474944
Energy: 0.9001497084835853
Energy: 0.8364215829474944
Energy: 0.900149708483027
Energy: 0.8364215829474944
Energy: 0.900149708483027
Energy: 0.6860368114477748
Energy: 0.8406315522105475
Energy: 0.6860368114477748
Energy: 0.8406315522088724
Energy: 0.6860368114477748
Energy: 0.8406315522116643
Energy: 0.834067153619529
Energy: 0.8379799767346164
Energy: 0.8340671536200872
Energy: 0.8379799767351747
Energy: 0.8340671536200872
Energy: 0.8379799767351747
Energy: 0.8195506289641415
Energy: 0.8333069744416888
Energy: 0.8195506289641415
Energy: 0.833306974442247
Energy: 0.8195506289652583
Energy: 0.833306974442247
Energy: 0.7399825197182889
Energy: 0.8147768278651928
Energy: 0.7399825197194057
Energy: 0.8147768278651928
Energy: 0.7399825197188472
Energy: 0.8147768278651928
Energy: 0.8599831464807313
Energy: 0.8689543312426622
Energy: 0.8599831464812896
Energy: 0.8689543312426622
Energy: 0.8599831464807313
Energy: 0.8689543312426622
Energy: 0.8428677153895366
Energy: 0.6907487402121495
Energy: 0.8428677153895366
Energy: 0.6907487402121495
Energy: 0.842867715390095
Energy: 0.6907487402121495
Energy: 0.8676451166961088
Energy: 0.8472006611297545
Energy: 0.8676451166961088
Energy: 0.8472006611303128
Energy: 0.8676451166961088
Energy: 0.8472006611297545
Energy: 0.8671522174499758
Energy: 0.8385669222532308
Energy: 0.8671522174505342
Energy: 0.8385669222532308
Energy: 0.8671522174499758
Energy: 0.8385669222532308
Energy: 0.8440196549785929
Energy: 0.6822821637103827
Energy: 0.8440196549774763
Energy: 0.6822821637109412
Energy: 0.8440196549785929
Energy: 0.6822821637109412
Energy: 0.8775765715667992
Energy: 0.8715996154883864
Energy: 0.877576571566241
Energy: 0.8715996154883864
Energy: 0.877576571566241
Energy: 0.8715996154883864
Energy: 0.869034988109277
Energy: 0.8116995302153918
Energy: 0.8690349881098355
Energy: 0.8116995302148333
Energy: 0.869034988109277
Energy: 0.8116995302148333
Energy: 0.8936232481525415
Energy: 0.9171166902028394
Energy: 0.8936232481519831
Energy: 0.9171166902028394
Energy: 0.8936232481525415
Energy: 0.9171166902028394
Energy: 0.7849607500548644
Energy: 0.926378540946185
Energy: 0.7849607500554228
Energy: 0.926378540946185
Energy: 0.7849607500548644
Energy: 0.926378540946185
Energy: 0.8879100496644786
Energy: 0.7959097141284313
Energy: 0.8879100496639203
Energy: 0.7959097141284313
Energy: 0.8879100496639203
Energy: 0.7959097141284313
Energy: 0.9431828022224903
Energy: 0.791555612509058
Energy: 0.9431828022224903
Energy: 0.7915556125084998
Energy: 0.9431828022224903
Energy: 0.7915556125084998
Energy: 0.8121781009015837
Energy: 0.9040091685047261
Energy: 0.8121781009010255
Energy: 0.9040091685047261
Energy: 0.8121781009010255
Energy: 0.9040091685047261
Energy: 0.9153189107035321
Energy: 0.7751685630397367
Energy: 0.9153189107035321
Energy: 0.7751685630397367
Energy: 0.9153189107035321
Energy: 0.7751685630397367
Energy: 0.865722677402392
Energy: 0.8156658062135668
Energy: 0.8657226774018334
Energy: 0.8156658062135668
Energy: 0.865722677402392
Energy: 0.8156658062135668
Energy: 0.7789328461744657
Energy: 0.8609874883225057
Energy: 0.7789328461733491
Energy: 0.8609874883225057
Energy: 0.7789328461744657
Energy: 0.8609874883225057
Energy: 0.9354931389643648
Energy: 0.7865153901957136
Energy: 0.9354931389643648
Energy: 0.7865153901957136
Energy: 0.9354931389649233
Energy: 0.7865153901957136
Energy: 0.8364000409729831
Energy: 0.8330892478293797
Energy: 0.8364000409729831
Energy: 0.8330892478299379
Energy: 0.8364000409724247
Energy: 0.8330892478293797
Energy: 0.7527227736205199
Energy: 0.8410857626797094
Energy: 0.7527227736205199
Energy: 0.8410857626802675
Energy: 0.7527227736205199
Energy: 0.8410857626797094
Energy: 0.9505385740672437
Energy: 0.9070295764823407
Energy: 0.9505385740678021
Energy: 0.9070295764823407
Energy: 0.9505385740678021
Energy: 0.9070295764823407
Energy: 0.8321019192364704
Energy: 0.8617785606289606
Energy: 0.8321019192364704
Energy: 0.8617785606289606
Energy: 0.8321019192364704
Energy: 0.861778560629519
Energy: 0.8289033369040676
Energy: 0.8338424022777441
Energy: 0.8289033369040676
Energy: 0.8338424022771858
Energy: 0.8289033369035093
Energy: 0.8338424022771858
Energy: 0.8359585746648043
Energy: 0.9186817258961142
Energy: 0.8359585746648043
Energy: 0.9186817258961142
Energy: 0.8359585746642461
Energy: 0.9186817258961142

minimum gb energy = 0.6822821637103827 eV
minimum distance =  2.33545123418185 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.0913434358813157
Energy: 0.9883628030966705
Energy: 1.0913434358813157
Energy: 0.988362803095875
Energy: 1.0913434358813157
Energy: 0.9883628030966705
Energy: 0.9675212863390605
Energy: 1.0437378546734402
Energy: 0.967521286338265
Energy: 1.0437378546742355
Energy: 0.9675212863390605
Energy: 1.0437378546742355
Energy: 1.0253522488052307
Energy: 1.0588202985599502
Energy: 1.025352248804435
Energy: 1.058820298560746
Energy: 1.025352248804435
Energy: 1.058820298560746
Energy: 1.0438105246149318
Energy: 0.9735974074929733
Energy: 1.0438105246149318
Energy: 0.9735974074929733
Energy: 1.0438105246149318
Energy: 0.9735974074929733
Energy: 0.9427453545303511
Energy: 0.9558923087942917
Energy: 0.9427453545303511
Energy: 0.9558923087942917
Energy: 0.9427453545311466
Energy: 0.9558923087942917
Energy: 1.0280159489720437
Energy: 1.020599507912677
Energy: 1.0280159489720437
Energy: 1.020599507912677
Energy: 1.0280159489712482
Energy: 1.020599507912677
Energy: 0.9674899046094473
Energy: 1.0676522190943247
Energy: 0.9674899046094473
Energy: 1.0676522190943247
Energy: 0.9674899046094473
Energy: 1.0676522190943247
Energy: 1.101322792290218
Energy: 0.9554767539797314
Energy: 1.101322792290218
Energy: 0.9554767539797314
Energy: 1.1013227922894224
Energy: 0.9554767539797314
Energy: 1.04570029750431
Energy: 1.0651790930212937
Energy: 1.0457002975051055
Energy: 1.0651790930212937
Energy: 1.04570029750431
Energy: 1.0651790930212937
Energy: 1.0210999944001866
Energy: 0.8925287183074033
Energy: 1.0210999944001866
Energy: 0.8925287183074033
Energy: 1.0210999944001866
Energy: 0.8925287183066078
Energy: 1.0345355893996449
Energy: 1.0198794584538091
Energy: 1.0345355893996449
Energy: 1.0198794584538091
Energy: 1.0345355893996449
Energy: 1.0198794584530135
Energy: 1.0050117906124576
Energy: 1.0127873799752483
Energy: 1.005011790611662
Energy: 1.0127873799752483
Energy: 1.0050117906124576
Energy: 1.0127873799752483
Energy: 0.993095357967163
Energy: 1.1233023114208136
Energy: 0.9930953579679587
Energy: 1.1233023114208136
Energy: 0.993095357967163
Energy: 1.1233023114208136
Energy: 0.9936649019148115
Energy: 1.0506560599801862
Energy: 0.9936649019171981
Energy: 1.0506560599801862
Energy: 0.9936649019164027
Energy: 1.0506560599801862
Energy: 0.9805574391137675
Energy: 0.9682375614519391
Energy: 0.9805574391137675
Energy: 0.9682375614519391
Energy: 0.9805574391137675
Energy: 0.9682375614519391
Energy: 1.0861760801575853
Energy: 0.991381310292679
Energy: 1.0861760801575853
Energy: 0.991381310292679
Energy: 1.0861760801575853
Energy: 0.991381310292679
Energy: 1.0064449204939125
Energy: 1.0398893309449426
Energy: 1.0064449204931172
Energy: 1.0398893309449426
Energy: 1.0064449204939125
Energy: 1.0398893309449426
Energy: 1.0019741095849908
Energy: 0.9500209290879996
Energy: 1.0019741095857864
Energy: 0.9500209290879996
Energy: 1.0019741095849908
Energy: 0.9500209290879996
Energy: 1.017491087521476
Energy: 1.0284765305872567
Energy: 1.0174910875222716
Energy: 1.028476530586461
Energy: 1.017491087521476
Energy: 1.028476530586461
Energy: 1.1391044990199253
Energy: 1.0442283695836363
Energy: 1.1391044990199253
Energy: 1.0442283695844317
Energy: 1.13910449901913
Energy: 1.0442283695844317
Energy: 1.126725773029226
Energy: 0.9669617312047728
Energy: 1.1267257730284304
Energy: 0.9669617312047728
Energy: 1.126725773029226
Energy: 0.9669617312047728
Energy: 1.0474703694447545
Energy: 1.0885426374578329
Energy: 1.04747036944555
Energy: 1.0885426374578329
Energy: 1.04747036944555
Energy: 1.0885426374578329
Energy: 1.0136058451364403
Energy: 1.0437540940773455
Energy: 1.0136058451364403
Energy: 1.0437540940773455
Energy: 1.0136058451364403
Energy: 1.0437540940773455

minimum gb energy = 0.8925287183066078 eV
minimum distance =  2.32119999432845 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.2038206194033056
Energy: 1.0799271123605232
Energy: 1.203820619402801
Energy: 1.0799271123615324
Energy: 1.2038206194033056
Energy: 1.0799271123610277
Energy: 1.0804119851225709
Energy: 1.1528779358420322
Energy: 1.0804119851215614
Energy: 1.1528779358410228
Energy: 1.08041198512358
Energy: 1.1528779358415275
Energy: 1.1524501263640936
Energy: 1.1536852956305086
Energy: 1.1524501263630842
Energy: 1.1536852956305086
Energy: 1.1524501263640936
Energy: 1.1536852956305086
Energy: 1.1532727735878072
Energy: 1.0887247877703088
Energy: 1.1532727735867976
Energy: 1.088724787769804
Energy: 1.1532727735878072
Energy: 1.088724787769804
Energy: 1.0936713474249415
Energy: 1.213746541119619
Energy: 1.093671347425951
Energy: 1.2137465411201238
Energy: 1.0936713474254462
Energy: 1.2137465411201238
Energy: 1.3363324106646535
Energy: 1.1819268490664108
Energy: 1.3363324106646535
Energy: 1.1819268490669155
Energy: 1.3363324106646535
Energy: 1.181926849065906
Energy: 1.0868989587052296
Energy: 1.1455290861772096
Energy: 1.0868989587062388
Energy: 1.145529086176705
Energy: 1.0868989587062388
Energy: 1.1455290861777143
Energy: 1.1628700795709994
Energy: 1.1442731195718745
Energy: 1.1628700795689808
Energy: 1.1442731195718745
Energy: 1.162870079570495
Energy: 1.1442731195718745
Energy: 1.1338665430527242
Energy: 1.154343776676324
Energy: 1.1338665430532289
Energy: 1.1543437766768285
Energy: 1.1338665430537336
Energy: 1.1543437766768285
Energy: 1.2114613964457681
Energy: 1.1640851977786146
Energy: 1.2114613964513197
Energy: 1.16408519777811
Energy: 1.2114613964513197
Energy: 1.16408519777811
Energy: 1.1555573984961398
Energy: 1.1573999887923718
Energy: 1.1555573984951302
Energy: 1.1573999887923718
Energy: 1.1555573984946255
Energy: 1.1573999887918671
Energy: 1.0797106807126722
Energy: 1.087730140667518
Energy: 1.0797106807116628
Energy: 1.087730140667518
Energy: 1.0797106807131767
Energy: 1.087730140667518
Energy: 1.195921183165001
Energy: 1.1046846825185408
Energy: 1.1959211831655057
Energy: 1.104684682518036
Energy: 1.1959211831655057
Energy: 1.1046846825185408
Energy: 1.0912563097958317
Energy: 1.1519769459627285
Energy: 1.0912563097963364
Energy: 1.1519769459622238
Energy: 1.0912563097958317
Energy: 1.1519769459622238
Energy: 1.1205413581536872
Energy: 1.1143270736126663
Energy: 1.1205413581531825
Energy: 1.1143270736121613
Energy: 1.1205413581531825
Energy: 1.1143270736126663
Energy: 1.1530968246331024
Energy: 1.2254280830492168
Energy: 1.1530968246331024
Energy: 1.2254280830492168
Energy: 1.1530968246331024
Energy: 1.2254280830497215
Energy: 1.0772702473474354
Energy: 1.1553577472672463
Energy: 1.07727024734794
Energy: 1.1553577472682557
Energy: 1.0772702473474354
Energy: 1.155357747267751
Energy: 1.1789724896181184
Energy: 1.2665068291159247
Energy: 1.1789724896176137
Energy: 1.2665068291159247
Energy: 1.178972489617109
Energy: 1.2665068291159247
Energy: 1.0770870989507433
Energy: 1.1826785988571094
Energy: 1.0770870989502386
Energy: 1.1826785988571094
Energy: 1.0770870989517527
Energy: 1.1826785988571094
Energy: 1.2347383044922944
Energy: 1.2047718477926213
Energy: 1.2347383044922944
Energy: 1.2047718477926213
Energy: 1.2347383044922944
Energy: 1.2047718477926213
Energy: 1.1579352890964014
Energy: 1.167115058502307
Energy: 1.1579352890969064
Energy: 1.167115058502307
Energy: 1.1579352890958967
Energy: 1.167115058502307
Energy: 1.1192185393409015
Energy: 1.064843055577359
Energy: 1.119218539341911
Energy: 1.064843055577359
Energy: 1.1192185393409015
Energy: 1.0648430555778634
Energy: 1.110405816469151
Energy: 1.157300268581284
Energy: 1.1104058164686463
Energy: 1.1573002685817886
Energy: 1.1104058164681416
Energy: 1.1573002685817886
Energy: 1.2181182577263376
Energy: 1.089443087734643
Energy: 1.2181182577268423
Energy: 1.089443087734643
Energy: 1.2181182577263376
Energy: 1.089443087734643
Energy: 1.0791995180121443
Energy: 1.0895941345042
Energy: 1.079199518012649
Energy: 1.0895941345047044
Energy: 1.079199518012649
Energy: 1.0895941345047044
Energy: 1.1109101410157343
Energy: 1.15517689208043
Energy: 1.1109101410157343
Energy: 1.15517689208043
Energy: 1.1109101410157343
Energy: 1.15517689208043
Energy: 1.0866177676688054
Energy: 1.0631327238913384
Energy: 1.0866177676688054
Energy: 1.0631327238913384
Energy: 1.08661776766931
Energy: 1.0631327238908337
Energy: 1.1809442413398874
Energy: 1.2135664169549916
Energy: 1.180944241340392
Energy: 1.2135664169549916
Energy: 1.180944241340392
Energy: 1.2135664169549916
Energy: 1.233987998823331
Energy: 1.1933853294406447
Energy: 1.233987998823331
Energy: 1.1933853294406447
Energy: 1.2339879988228266
Energy: 1.19338532944014
Energy: 1.0762104720958834
Energy: 1.0547031804717162
Energy: 1.0762104720958834
Energy: 1.0547031804717162
Energy: 1.0762104720953787
Energy: 1.0547031804717162
Energy: 1.224116618535624
Energy: 1.2116822587573142
Energy: 1.224116618535624
Energy: 1.2116822587573142
Energy: 1.2241166185351193
Energy: 1.2116822587573142
Energy: 1.0963909533628653
Energy: 1.1525143913097649
Energy: 1.0963909533618559
Energy: 1.1525143913102693
Energy: 1.0963909533628653
Energy: 1.1525143913092601
Energy: 1.1498933526079254
Energy: 1.2255188322496584
Energy: 1.1498933526089345
Energy: 1.2255188322496584
Energy: 1.14989335260843
Energy: 1.2255188322496584
Energy: 1.1181594342403485
Energy: 1.2050935370874787
Energy: 1.1181594342393393
Energy: 1.2050935370874787
Energy: 1.118159434239844
Energy: 1.2050935370874787
Energy: 1.090699944088454
Energy: 1.1537831652953991
Energy: 1.0906999440879492
Energy: 1.1537831652948944
Energy: 1.0906999440869398
Energy: 1.1537831652948944
Energy: 1.20711300207335
Energy: 1.1037715988246337
Energy: 1.2071130020718361
Energy: 1.1037715988241288
Energy: 1.2071130020728453
Energy: 1.1037715988241288
Energy: 1.0813073115689136
Energy: 1.109650963778683
Energy: 1.0813073115694183
Energy: 1.109650963778683
Energy: 1.0813073115694183
Energy: 1.109650963778683

minimum gb energy = 1.0547031804717162 eV
minimum distance =  2.30774748980673 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.336809040539963
Energy: 1.2870515150575017
Energy: 1.3368090405385853
Energy: 1.2870515150588169
Energy: 1.3368090405385853
Energy: 1.2870515150588169
Energy: 1.2510515452197155
Energy: 1.331705576808472
Energy: 1.2510515452197155
Energy: 1.331705576808472
Energy: 1.2510515452197155
Energy: 1.331705576808472
Energy: 1.4979770660960814
Energy: 1.3292623546122782
Energy: 1.4979770660960814
Energy: 1.3292623546122782
Energy: 1.4979770660974596
Energy: 1.3292623546122782
Energy: 1.3868014706994634
Energy: 1.3474376073859158
Energy: 1.3868014706994634
Energy: 1.3474376073859158
Energy: 1.3868014706994634
Energy: 1.3474376073859158
Energy: 1.360324249908536
Energy: 1.3368462461183386
Energy: 1.3603242499071582
Energy: 1.3368462461197161
Energy: 1.360324249908536
Energy: 1.3368462461183386
Energy: 1.478982479529713
Energy: 1.3808001613882028
Energy: 1.478982479531091
Energy: 1.3808001613882028
Energy: 1.478982479531091
Energy: 1.3808001613895808
Energy: 1.4527590820305554
Energy: 1.2415954058904983
Energy: 1.4527590820305554
Energy: 1.2415954058904983
Energy: 1.4527590820305554
Energy: 1.2415954058904983
Energy: 1.3258269271059595
Energy: 1.2983345057573636
Energy: 1.3258269271059595
Energy: 1.2983345057573636
Energy: 1.3258269271059595
Energy: 1.2983345057573636
Energy: 1.2572342899486928
Energy: 1.2444887143945935
Energy: 1.2572342899473148
Energy: 1.2444887143945935
Energy: 1.2572342899486928
Energy: 1.2444887143945935
Energy: 1.3397093213257476
Energy: 1.3182568252041622
Energy: 1.3397093213243696
Energy: 1.3182568252041622
Energy: 1.3397093213257476
Energy: 1.3182568252041622
Energy: 1.254001345617255
Energy: 1.3295914667999882
Energy: 1.254001345617255
Energy: 1.3295914667999882
Energy: 1.254001345617255
Energy: 1.3295914667999882
Energy: 1.3305524396258535
Energy: 1.331472369286109
Energy: 1.3305524396258535
Energy: 1.331472369287487
Energy: 1.3305524396258535
Energy: 1.331472369286109
Energy: 1.3628060883855118
Energy: 1.3454629442712915
Energy: 1.3628060883855118
Energy: 1.3454629442712915
Energy: 1.3628060883855118
Energy: 1.3454629442712915
Energy: 1.3460881923298347
Energy: 1.331668121315796
Energy: 1.3460881923298347
Energy: 1.331668121315796
Energy: 1.3460881923298347
Energy: 1.331668121315796

minimum gb energy = 1.2415954058904983 eV
minimum distance =  2.26697167208001 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.5927585672175975
Energy: 1.5712777052899223
Energy: 1.5927585672169922
Energy: 1.5712777052899223
Energy: 1.5927585672175975
Energy: 1.5712777052899223
Energy: 1.371321170719416
Energy: 1.5427893382510487
Energy: 1.3713211707200212
Energy: 1.5427893382510487
Energy: 1.3713211707200212
Energy: 1.5427893382510487
Energy: 1.5018263763635669
Energy: 1.4603889621856874
Energy: 1.5018263763635669
Energy: 1.4603889621856874
Energy: 1.5018263763635669
Energy: 1.4603889621856874
Energy: 1.457624413961211
Energy: 1.374208904024497
Energy: 1.4576244139606056
Energy: 1.374208904024497
Energy: 1.457624413961211
Energy: 1.374208904024497
Energy: 1.5077478725543927
Energy: 1.4486938555366389
Energy: 1.5077478725549978
Energy: 1.4486938555366389
Energy: 1.5077478725543927
Energy: 1.4486938555366389
Energy: 1.457813513085127
Energy: 1.4926368355329962
Energy: 1.457813513085127
Energy: 1.4926368355329962
Energy: 1.4578135130845218
Energy: 1.4926368355329962
Energy: 1.4472486013264307
Energy: 1.4484270840104556
Energy: 1.4472486013264307
Energy: 1.4484270840104556
Energy: 1.447248601327036
Energy: 1.4484270840098503
Energy: 1.4408976549791193
Energy: 1.4562195296260252
Energy: 1.4408976549791193
Energy: 1.4562195296260252
Energy: 1.4408976549785142
Energy: 1.4562195296260252
Energy: 1.4594319618336056
Energy: 1.458996143582361
Energy: 1.4594319618342106
Energy: 1.458996143582361
Energy: 1.4594319618342106
Energy: 1.458996143582361
Energy: 1.4473491761163317
Energy: 1.4509156181057477
Energy: 1.4473491761163317
Energy: 1.4509156181039315
Energy: 1.4473491761163317
Energy: 1.4509156181051421
Energy: 1.3954960723821503
Energy: 1.520292870864483
Energy: 1.3954960723821503
Energy: 1.5202928708650882
Energy: 1.3954960723821503
Energy: 1.520292870864483
Energy: 1.473648153241192
Energy: 1.5097147211852455
Energy: 1.4736481532417975
Energy: 1.509714721185851
Energy: 1.4736481532417975
Energy: 1.509714721185851
Energy: 1.4688258335237288
Energy: 1.450401858723456
Energy: 1.4688258335237288
Energy: 1.450401858723456
Energy: 1.4688258335243343
Energy: 1.450401858723456
Energy: 1.4747594074248178
Energy: 1.4843006868536484
Energy: 1.474759407425423
Energy: 1.4843006868536484
Energy: 1.4747594074248178
Energy: 1.4843006868536484
Energy: 1.4113770869398032
Energy: 1.4410798873448796
Energy: 1.4113770869398032
Energy: 1.4410798873448796
Energy: 1.4113770869398032
Energy: 1.4410798873442743
Energy: 1.517405564712328
Energy: 1.4556644918844233
Energy: 1.517405564712328
Energy: 1.4556644918844233
Energy: 1.5174055647117226
Energy: 1.4556644918850286
Energy: 1.4075937175872977
Energy: 1.4899218915909642
Energy: 1.4075937175879032
Energy: 1.489921891590359
Energy: 1.4075937175879032
Energy: 1.489921891590359
Energy: 1.5343768383608039
Energy: 1.5542917656531114
Energy: 1.5343768383608039
Energy: 1.5542917656525064
Energy: 1.534376838361409
Energy: 1.5542917656525064
Energy: 1.4312784785010555
Energy: 1.4011945156060468
Energy: 1.4312784785010555
Energy: 1.4011945156060468
Energy: 1.4312784785004502
Energy: 1.4011945156060468
Energy: 1.4619102578970626
Energy: 1.5067927963087306
Energy: 1.4619102578970626
Energy: 1.5067927963087306
Energy: 1.4619102578970626
Energy: 1.5067927963087306
Energy: 1.395400793852114
Energy: 1.4116561713694613
Energy: 1.3954007938527195
Energy: 1.4116561713694613
Energy: 1.395400793852114
Energy: 1.4116561713700666
Energy: 1.5406976681784312
Energy: 1.5704862454699777
Energy: 1.5406976681784312
Energy: 1.5704862454699777
Energy: 1.5406976681790365
Energy: 1.5704862454699777
Energy: 1.4572306846726641
Energy: 1.4661529957221264
Energy: 1.4572306846726641
Energy: 1.4661529957215211
Energy: 1.4572306846726641
Energy: 1.4661529957221264
Energy: 1.5017868362185822
Energy: 1.5053249805583329
Energy: 1.5017868362185822
Energy: 1.5053249805583329
Energy: 1.5017868362185822
Energy: 1.5053249805583329
Energy: 1.454063401178406
Energy: 1.4477403290598385
Energy: 1.4540634011790112
Energy: 1.4477403290598385
Energy: 1.4540634011790112
Energy: 1.4477403290598385
Energy: 1.4012143099651424
Energy: 1.5076363657303107
Energy: 1.4012143099651424
Energy: 1.5076363657303107
Energy: 1.4012143099651424
Energy: 1.5076363657303107
Energy: 1.4426838829115187
Energy: 1.5356050705495032
Energy: 1.4426838829115187
Energy: 1.5356050705495032
Energy: 1.442683882912124
Energy: 1.5356050705495032
Energy: 1.4690562334560207
Energy: 1.406922098656274
Energy: 1.4690562334554154
Energy: 1.406922098656274
Energy: 1.4690562334554154
Energy: 1.4069220986568796
Energy: 1.4648602339455568
Energy: 1.476452835796525
Energy: 1.4648602339455568
Energy: 1.4764528357971303
Energy: 1.4648602339455568
Energy: 1.4764528357971303
Energy: 1.4152057416432182
Energy: 1.3693401984649063
Energy: 1.4152057416438235
Energy: 1.369340198464301
Energy: 1.4152057416432182
Energy: 1.369340198464301
Energy: 1.4479062690826414
Energy: 1.5227010814237432
Energy: 1.4479062690826414
Energy: 1.5227010814231376
Energy: 1.4479062690820363
Energy: 1.5227010814237432

minimum gb energy = 1.369340198464301 eV
minimum distance =  2.24477908796355 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.3844392774500525
Energy: 1.3221598311957905
Energy: 1.3844392774489753
Energy: 1.3221598311957905
Energy: 1.3844392774500525
Energy: 1.3221598311957905
Energy: 1.4950760201929605
Energy: 1.527865117570514
Energy: 1.4950760201918831
Energy: 1.527865117570514
Energy: 1.4950760201929605
Energy: 1.527865117570514
Energy: 1.5280026382428764
Energy: 1.4081475132930934
Energy: 1.5280026382428764
Energy: 1.4081475132930934
Energy: 1.5280026382428764
Energy: 1.4081475132930934
Energy: 1.4006705180801202
Energy: 1.6010789213675571
Energy: 1.4006705180801202
Energy: 1.6010789213675571
Energy: 1.4006705180801202
Energy: 1.6010789213675571
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.4951048014769903
Energy: 1.4601142682756318
Energy: 1.4951048014780675
Energy: 1.4601142682756318
Energy: 1.4951048014780675
Energy: 1.4601142682777861
Energy: 1.3844392774500525
Energy: 1.3221598311957905
Energy: 1.3844392774500525
Energy: 1.3221598311957905
Energy: 1.3844392774500525
Energy: 1.3221598311957905
Energy: 1.4950760201929605
Energy: 1.527865117570514
Energy: 1.4950760201940374
Energy: 1.527865117570514
Energy: 1.4950760201918831
Energy: 1.5278651175715914
Energy: 1.5280026382417995
Energy: 1.4081475132920163
Energy: 1.5280026382417995
Energy: 1.4081475132930934
Energy: 1.5280026382407221
Energy: 1.4081475132920163
Energy: 1.4006705180790429
Energy: 1.4177207357495971
Energy: 1.4006705180790429
Energy: 1.4177207357495971
Energy: 1.4006705180790429
Energy: 1.4177207357495971
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.5277576165633333
Energy: 1.4080392573617206
Energy: 1.4951048014769903
Energy: 1.4601142682756318
Energy: 1.4951048014780675
Energy: 1.4601142682756318
Energy: 1.4951048014780675
Energy: 1.4601142682767088
Energy: 1.3844392774489753
Energy: 1.3221598311957905
Energy: 1.3844392774489753
Energy: 1.3221598311957905
Energy: 1.3844392774500525
Energy: 1.3221598311957905
Energy: 1.4950760201929605
Energy: 1.527865117569437
Energy: 1.4950760201940374
Energy: 1.527865117569437
Energy: 1.4950760201908062
Energy: 1.527865117570514
Energy: 1.5280026382428764
Energy: 1.4081475132930934
Energy: 1.5280026382428764
Energy: 1.4081475132930934
Energy: 1.5280026382428764
Energy: 1.4081475132930934
Energy: 1.4006705180801202
Energy: 1.4177207357495971
Energy: 1.4006705180801202
Energy: 1.4177207357495971
Energy: 1.4006705180801202
Energy: 1.4177207357495971
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.5277576165644102
Energy: 1.4080392573617206
Energy: 1.5277576165644102
Energy: 1.4080392573617206

minimum gb energy = 1.3221598311957905 eV
minimum distance =  2.27736173233026 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.5531815094929682
Energy: 1.5927289171283483
Energy: 1.5531815094929682
Energy: 1.5927289171283483
Energy: 1.5531815094929682
Energy: 1.5927289171283483
Energy: 1.4662012762244727
Energy: 1.4678606785945358
Energy: 1.4662012762244727
Energy: 1.4678606785945358
Energy: 1.4662012762244727
Energy: 1.4678606785945358
Energy: 1.5502022247470877
Energy: 1.4865422911820354
Energy: 1.5048911552587305
Energy: 1.4865422911820354
Energy: 1.5048911552587305
Energy: 1.4865422911820354
Energy: 1.468497573406167
Energy: 1.556806475404861
Energy: 1.4684975734052876
Energy: 1.556806475404861
Energy: 1.468497573406167
Energy: 1.556806475404861
Energy: 1.4789988242554677
Energy: 1.5258568149659149
Energy: 1.4789988242554677
Energy: 1.5258568149659149
Energy: 1.4789988242554677
Energy: 1.5258568149659149
Energy: 1.4883674196785681
Energy: 1.5106022519228945
Energy: 1.4883674196785681
Energy: 1.5106022519228945
Energy: 1.4883674196785681
Energy: 1.5106022519228945
Energy: 1.4828168512363935
Energy: 1.5154865870912952
Energy: 1.4828168512363935
Energy: 1.5154865870921748
Energy: 1.4828168512363935
Energy: 1.5154865870921748
Energy: 1.4513627743365416
Energy: 1.5195669982416875
Energy: 1.4513627743365416
Energy: 1.5195669982416875
Energy: 1.4513627743365416
Energy: 1.5195669982416875
Energy: 1.5585561239478913
Energy: 1.5145857740875521
Energy: 1.5585561239487706
Energy: 1.5145857740884314
Energy: 1.5585561239487706
Energy: 1.5145857740875521
Energy: 1.4799014360624727
Energy: 1.5060773960870648
Energy: 1.4799014360633524
Energy: 1.5060773960870648
Energy: 1.4799014360633524
Energy: 1.5060773960870648
Energy: 1.4960488972667823
Energy: 1.4707338294662171
Energy: 1.4960488972659027
Energy: 1.4707338294662171
Energy: 1.4960488972659027
Energy: 1.4707338294662171
Energy: 1.5316119839559694
Energy: 1.5063657324387034
Energy: 1.5316119839542106
Energy: 1.506365732437824
Energy: 1.5316119839550901
Energy: 1.5063657324387034
Energy: 1.4538273332346046
Energy: 1.4989854015968214
Energy: 1.4538273332337253
Energy: 1.4989854015977009
Energy: 1.4538273332337253
Energy: 1.4989854015977009
Energy: 1.4609313975367908
Energy: 1.4761366766111665
Energy: 1.4609313975367908
Energy: 1.4761366766111665
Energy: 1.460931397535911
Energy: 1.4761366766111665
Energy: 1.5698157530558803
Energy: 1.4882668033840323
Energy: 1.5698157530550005
Energy: 1.4882668033840323
Energy: 1.5698157530558803
Energy: 1.4882668033840323
Energy: 1.567584282890066
Energy: 1.5605649543931757
Energy: 1.567584282890066
Energy: 1.5605649543931757
Energy: 1.567584282890066
Energy: 1.5605649543931757
Energy: 1.5852509359450195
Energy: 1.5768342270235283
Energy: 1.5852509359450195
Energy: 1.5768342270244078
Energy: 1.5852509359450195
Energy: 1.5768342270252873
Energy: 1.6178103302630003
Energy: 1.5004212714043674
Energy: 1.6178103302630003
Energy: 1.5004212714043674
Energy: 1.6178103302630003
Energy: 1.5004212714043674
Energy: 1.462062236515481
Energy: 1.4805844303700637
Energy: 1.4620622365146014
Energy: 1.4805844303700637
Energy: 1.462062236515481
Energy: 1.4805844303700637
Energy: 1.4748754506629644
Energy: 1.5171571937258794
Energy: 1.4748754506629644
Energy: 1.5171571937258794
Energy: 1.4748754506629644
Energy: 1.5171571937258794
Energy: 1.5307160588525106
Energy: 1.4915966507921563
Energy: 1.5307160588525106
Energy: 1.4915966507921563
Energy: 1.5307160588525106
Energy: 1.4915966507921563

minimum gb energy = 1.4513627743365416 eV
minimum distance =  2.24140607610089 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.5301417700867475
Energy: 1.4797831771929852
Energy: 1.5301417700867475
Energy: 1.4797831771937267
Energy: 1.5301417700867475
Energy: 1.4797831771929852
Energy: 1.4603355342352584
Energy: 1.4786648515181313
Energy: 1.4603355342345172
Energy: 1.4786648515181313
Energy: 1.4603355342345172
Energy: 1.4786648515181313
Energy: 1.4482272754055685
Energy: 1.4985766183519014
Energy: 1.4482272754048269
Energy: 1.4985766183526428
Energy: 1.4482272754048269
Energy: 1.4985766183519014
Energy: 1.439933689205534
Energy: 1.438551991156318
Energy: 1.439933689205534
Energy: 1.4385519911555769
Energy: 1.4399336892047927
Energy: 1.4385519911555769
Energy: 1.4448176647396893
Energy: 1.3526165576503382
Energy: 1.4448176647396893
Energy: 1.3526165576503382
Energy: 1.4448176647404305
Energy: 1.3526165576503382
Energy: 1.3470864735095032
Energy: 1.473609416580721
Energy: 1.3470864735102446
Energy: 1.473609416580721
Energy: 1.3470864735095032
Energy: 1.473609416580721
Energy: 1.4962804278392883
Energy: 1.440383197431943
Energy: 1.4962804278400295
Energy: 1.440383197431943
Energy: 1.4962804278400295
Energy: 1.440383197431943
Energy: 1.4958974506332912
Energy: 1.5336592892468368
Energy: 1.4958974506332912
Energy: 1.5336592892468368
Energy: 1.4958974506332912
Energy: 1.5336592892468368
Energy: 1.4297148660142749
Energy: 1.473471151170724
Energy: 1.429714866015016
Energy: 1.473471151170724
Energy: 1.429714866015016
Energy: 1.473471151170724
Energy: 1.4396244093755284
Energy: 1.4412599070930059
Energy: 1.4396244093747872
Energy: 1.4412599070922645
Energy: 1.4396244093747872
Energy: 1.4412599070922645
Energy: 1.4384935702987471
Energy: 1.4528503909478219
Energy: 1.4384935702987471
Energy: 1.4528503909478219
Energy: 1.4384935702987471
Energy: 1.4528503909478219
Energy: 1.44209001676684
Energy: 1.4963648035118076
Energy: 1.44209001676684
Energy: 1.4963648035118076
Energy: 1.44209001676684
Energy: 1.4963648035118076
Energy: 1.52216736682754
Energy: 1.4908666641618369
Energy: 1.52216736682754
Energy: 1.4908666641618369
Energy: 1.52216736682754
Energy: 1.4908666641618369
Energy: 1.4700619834064752
Energy: 1.3990328183754204
Energy: 1.4700619834057675
Energy: 1.3990328183754204
Energy: 1.4700619834064752
Energy: 1.3990328183754204
Energy: 1.3478656060412677
Energy: 1.4738898597961305
Energy: 1.3478656060405263
Energy: 1.4738898597961305
Energy: 1.3478656060412677
Energy: 1.4738898597961305
Energy: 1.4575170419072387
Energy: 1.4320208433466721
Energy: 1.4575170419072387
Energy: 1.4320208433466721
Energy: 1.4575170419064973
Energy: 1.4320208433466721
Energy: 1.4390310069925674
Energy: 1.4484748547657136
Energy: 1.4390310069925674
Energy: 1.4484748547657136
Energy: 1.4390310069925674
Energy: 1.4484748547649722
Energy: 1.4369654041162354
Energy: 1.4996059863249114
Energy: 1.4369654041162354
Energy: 1.4996059863249114
Energy: 1.4369654041162354
Energy: 1.4996059863249114
Energy: 1.4127453021081455
Energy: 1.438675439931389
Energy: 1.4127453021074041
Energy: 1.4386754399321307
Energy: 1.4127453021081455
Energy: 1.4386754399321307
Energy: 1.5301417700874886
Energy: 1.4797831771929852
Energy: 1.5301417700874886
Energy: 1.4797831771929852
Energy: 1.53014177008823
Energy: 1.4797831771929852
Energy: 1.4603355342337756
Energy: 1.4786648515203553
Energy: 1.4603355342337756
Energy: 1.4786648515203553
Energy: 1.4603355342337756
Energy: 1.4786648515196141
Energy: 1.4482272754055685
Energy: 1.4985766183526428
Energy: 1.4482272754055685
Energy: 1.4985766183526428
Energy: 1.4482272754048269
Energy: 1.4985766183526428
Energy: 1.439933689205534
Energy: 1.4385519911548355
Energy: 1.4399336892047927
Energy: 1.438551991154094
Energy: 1.4399336892047927
Energy: 1.4385519911548355
Energy: 1.4448176647404305
Energy: 1.3526165576495968
Energy: 1.4448176647404305
Energy: 1.3526165576495968
Energy: 1.4448176647404305
Energy: 1.3526165576495968
Energy: 1.3470864735095032
Energy: 1.4736094165814624
Energy: 1.3470864735087955
Energy: 1.473609416580721
Energy: 1.3470864735095032
Energy: 1.473609416580721

minimum gb energy = 1.3470864735087955 eV
minimum distance =  2.30159956837687 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.459951247529373
Energy: 1.5055521297322458
Energy: 1.4599512475300132
Energy: 1.5055521297322458
Energy: 1.459951247529373
Energy: 1.5055521297322458
Energy: 1.4148522557706733
Energy: 1.4270300226115247
Energy: 1.4148522557706733
Energy: 1.4270300226115247
Energy: 1.4148522557700334
Energy: 1.4270300226115247
Energy: 1.5761536531760623
Energy: 1.3939893775889851
Energy: 1.5761536531767018
Energy: 1.3939893775889851
Energy: 1.5761536531760623
Energy: 1.3939893775889851
Energy: 1.4046416318081505
Energy: 1.4125345604653434
Energy: 1.4046416318081505
Energy: 1.4125345604653434
Energy: 1.4046416318081505
Energy: 1.4125345604653434
Energy: 1.418783122246383
Energy: 1.4877827165427253
Energy: 1.418783122246383
Energy: 1.4877827165427253
Energy: 1.418783122246383
Energy: 1.4877827165427253
Energy: 1.418680932541379
Energy: 1.4163226468283445
Energy: 1.418680932541379
Energy: 1.4163226468283445
Energy: 1.4186809325420189
Energy: 1.4163226468283445
Energy: 1.3854476654240961
Energy: 1.551413012408081
Energy: 1.385447665424736
Energy: 1.551413012408081
Energy: 1.3854476654240961
Energy: 1.551413012408081
Energy: 1.4272288897709773
Energy: 1.5852952490047563
Energy: 1.4272288897709773
Energy: 1.5852952490047563
Energy: 1.427228889771617
Energy: 1.5852952490047563
Energy: 1.528054851280569
Energy: 1.3856027265175503
Energy: 1.528054851280569
Energy: 1.3856027265175503
Energy: 1.5280548512799288
Energy: 1.3856027265175503
Energy: 1.478520321340819
Energy: 1.4095275912101815
Energy: 1.478520321340179
Energy: 1.4095275912101815
Energy: 1.478520321340819
Energy: 1.4095275912095415
Energy: 1.3873977711621446
Energy: 1.5523371163401722
Energy: 1.3873977711621446
Energy: 1.5523371163401722
Energy: 1.3873977711621446
Energy: 1.5523371163401722
Energy: 1.4736421273635638
Energy: 1.4017348611735683
Energy: 1.4736421273642037
Energy: 1.4017348611735683
Energy: 1.4736421273642037
Energy: 1.4017348611742084
Energy: 1.4508224187270058
Energy: 1.4347317935640096
Energy: 1.4508224187282857
Energy: 1.4347317935640096
Energy: 1.4508224187276457
Energy: 1.4347317935640096
Energy: 1.4153963711679123
Energy: 1.4101830595336717
Energy: 1.4153963711685524
Energy: 1.4101830595336717
Energy: 1.4153963711685524
Energy: 1.410183059533032
Energy: 1.4439418749740054
Energy: 1.370144144785564
Energy: 1.4439418749733655
Energy: 1.370144144785564
Energy: 1.4439418749733655
Energy: 1.370144144785564
Energy: 1.5372088810729132
Energy: 1.390196562083382
Energy: 1.537208881073553
Energy: 1.390196562083382
Energy: 1.5372088810729132
Energy: 1.390196562083382
Energy: 1.4228151617352958
Energy: 1.4254010916983102
Energy: 1.4228151617352958
Energy: 1.4254010916983102
Energy: 1.4228151617352958
Energy: 1.4254010916983102
Energy: 1.454578200034413
Energy: 1.5786087544990628
Energy: 1.4545782000350527
Energy: 1.5786087544990628
Energy: 1.4545782000350527
Energy: 1.5786087544990628
Energy: 1.476852954963424
Energy: 1.4151895950972162
Energy: 1.476852954963424
Energy: 1.4151895950972162
Energy: 1.476852954963424
Energy: 1.4151895950972162
Energy: 1.3990100525594604
Energy: 1.445622306354092
Energy: 1.3990100525601006
Energy: 1.4456223063547322
Energy: 1.3990100525601006
Energy: 1.445622306354092
Energy: 1.3639045875645706
Energy: 1.571089511971792
Energy: 1.3639045875645706
Energy: 1.571089511971792
Energy: 1.3639045875639304
Energy: 1.571089511971792
Energy: 1.5302206146610127
Energy: 1.3974577979246483
Energy: 1.5302206146610127
Energy: 1.3974577979240086
Energy: 1.5302206146616526
Energy: 1.3974577979240086
Energy: 1.5243440981497491
Energy: 1.4222289730443924
Energy: 1.524344098149109
Energy: 1.4222289730443924
Energy: 1.5243440981497491
Energy: 1.4222289730443924
Energy: 1.4507096904540158
Energy: 1.5173714561569982
Energy: 1.4507096904527357
Energy: 1.5173714561569982
Energy: 1.4507096904546557
Energy: 1.5173714561569982
Energy: 1.4369825843971011
Energy: 1.4136185692435663
Energy: 1.4369825843971011
Energy: 1.4136185692442065
Energy: 1.436982584397741
Energy: 1.4136185692442065
Energy: 1.456356604374072
Energy: 1.3980898828788688
Energy: 1.456356604374072
Energy: 1.3980898828788688
Energy: 1.456356604374072
Energy: 1.3980898828795087
Energy: 1.3796983667325873
Energy: 1.4213716649003343
Energy: 1.379698366733227
Energy: 1.4213716649003343
Energy: 1.3796983667325873
Energy: 1.4213716649003343
Energy: 1.4851978305857882
Energy: 1.4063339051240815
Energy: 1.4851978305857882
Energy: 1.4063339051247212
Energy: 1.4851978305857882
Energy: 1.4063339051247212
Energy: 1.437990648584736
Energy: 1.4082058485890412
Energy: 1.437990648584736
Energy: 1.4082058485890412
Energy: 1.437990648584736
Energy: 1.4082058485890412

minimum gb energy = 1.3639045875639304 eV
minimum distance =  2.26732873454655 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.3596386994758394
Energy: 1.4211434473605917
Energy: 1.359638699475277
Energy: 1.4211434473605917
Energy: 1.3596386994758394
Energy: 1.4211434473605917
Energy: 1.4714970359232749
Energy: 1.355546348830715
Energy: 1.4714970359222008
Energy: 1.3555463488301525
Energy: 1.4714970359222008
Energy: 1.355546348830715
Energy: 1.3850579512078407
Energy: 1.3350204749985417
Energy: 1.385057951208966
Energy: 1.3350204749985417
Energy: 1.3850579512084034
Energy: 1.3350204749985417
Energy: 1.2990724509899108
Energy: 1.5143544848398116
Energy: 1.2990724509899108
Energy: 1.5467359135959193
Energy: 1.299072450989348
Energy: 1.5143544848398116
Energy: 1.4101671561062998
Energy: 1.3913108460363817
Energy: 1.410167156107425
Energy: 1.3913108460369439
Energy: 1.4101671561062998
Energy: 1.3913108460363817
Energy: 1.412777755258845
Energy: 1.3179998206788515
Energy: 1.412777755258845
Energy: 1.3179998206782888
Energy: 1.41277775525997
Energy: 1.3179998206788515
Energy: 1.3652485214600736
Energy: 1.4648034161847525
Energy: 1.3652485214611987
Energy: 1.4648034161847525
Energy: 1.3652485214611987
Energy: 1.4648034161853152
Energy: 1.3206866735278067
Energy: 1.4507459324996201
Energy: 1.320686673527244
Energy: 1.4507459324984948
Energy: 1.320686673528369
Energy: 1.4507459324990573
Energy: 1.4224672943591206
Energy: 1.3193497194287087
Energy: 1.4224672943591206
Energy: 1.3193497194287087
Energy: 1.4224672943591206
Energy: 1.3193497194287087
Energy: 1.4073927758411258
Energy: 1.388689699093212
Energy: 1.4073927758411258
Energy: 1.3886896990937747
Energy: 1.4073927758411258
Energy: 1.3886896990937747
Energy: 1.2971919853105123
Energy: 1.6070927916508828
Energy: 1.2971919853099498
Energy: 1.6070927916514455
Energy: 1.2971919853105123
Energy: 1.6070927916514455
Energy: 1.470231884517475
Energy: 1.3566072423264621
Energy: 1.4702318845152251
Energy: 1.3566072423264621
Energy: 1.4702318845146625
Energy: 1.3566072423264621
Energy: 1.3851350048659514
Energy: 1.319445431820789
Energy: 1.3851350048659514
Energy: 1.3194454318202267
Energy: 1.3851350048653888
Energy: 1.3194454318202267
Energy: 1.360280878327806
Energy: 1.454235498572175
Energy: 1.3602808783283684
Energy: 1.4542354985727375
Energy: 1.3602808783283684
Energy: 1.454235498572175
Energy: 1.4584046574649066
Energy: 1.3668707641974474
Energy: 1.4584046574660317
Energy: 1.36687076419801
Energy: 1.4584046574649066
Energy: 1.36687076419801
Energy: 1.3849585003344038
Energy: 1.3380359694975419
Energy: 1.3849585003344038
Energy: 1.3380359694975419
Energy: 1.3849585003344038
Energy: 1.3380359694975419
Energy: 1.2991583810821026
Energy: 1.477939139306493
Energy: 1.2991583810815404
Energy: 1.4779391393070556
Energy: 1.2991583810821026
Energy: 1.4779391393070556
Energy: 1.308744613756314
Energy: 1.3895865145560922
Energy: 1.3087446137557512
Energy: 1.3895865145555297
Energy: 1.3087446137557512
Energy: 1.3895865145560922
Energy: 1.4117400784507252
Energy: 1.3193851088611288
Energy: 1.411740078451288
Energy: 1.3193851088611288
Energy: 1.4117400784507252
Energy: 1.3193851088611288
Energy: 1.3898691035784432
Energy: 1.432832131086686
Energy: 1.389869103579006
Energy: 1.432832131086686
Energy: 1.3898691035784432
Energy: 1.4328321310878114
Energy: 1.3177520639921996
Energy: 1.591331047716975
Energy: 1.3177520639927625
Energy: 1.591331047716975
Energy: 1.3177520639927625
Energy: 1.591331047716975
Energy: 1.4471660850591057
Energy: 1.3178299261657367
Energy: 1.4471660850613046
Energy: 1.3178299261657367
Energy: 1.4471660850613046
Energy: 1.3178299261657367
Energy: 1.4764009621175136
Energy: 1.3124207831665242
Energy: 1.476400962116951
Energy: 1.3124207831665242
Energy: 1.476400962116951
Energy: 1.3124207831665242
Energy: 1.298984188402071
Energy: 1.4714697468152638
Energy: 1.2989841884015085
Energy: 1.4714697468158262
Energy: 1.298984188402071
Energy: 1.4714697468158262
Energy: 1.59528256979773
Energy: 1.3652440429072124
Energy: 1.59528256979773
Energy: 1.365244042907775
Energy: 1.59528256979773
Energy: 1.3652440429072124
Energy: 1.3884933475308048
Energy: 1.3377985180064036
Energy: 1.3884933475308048
Energy: 1.3377985180064036
Energy: 1.3884933475313672
Energy: 1.3377985180064036
Energy: 1.3600916870885693
Energy: 1.4460156651941802
Energy: 1.3600916870885693
Energy: 1.4460156651941802
Energy: 1.3600916870885693
Energy: 1.4460156651941802
Energy: 1.3604730058447458
Energy: 1.3626264519738398
Energy: 1.3604730058447458
Energy: 1.3626264519738398
Energy: 1.3604730058447458
Energy: 1.3626264519744025
Energy: 1.4756159222903484
Energy: 1.3349137695391162
Energy: 1.4756159222903484
Energy: 1.3349137695391162
Energy: 1.4756159222897856
Energy: 1.3349137695391162
Energy: 1.3315713838538636
Energy: 1.4459812349311096
Energy: 1.3315713838538636
Energy: 1.4459812349316723
Energy: 1.3315713838544263
Energy: 1.4459812349311096
Energy: 1.2972942634305542
Energy: 1.4142513254360534
Energy: 1.2972942634305542
Energy: 1.4142513254366158
Energy: 1.2972942634305542
Energy: 1.4142513254360534
Energy: 1.5110259726112139
Energy: 1.3176474549745518
Energy: 1.5110259726112139
Energy: 1.3176474549751145
Energy: 1.5110259726112139
Energy: 1.3176474549751145
Energy: 1.4713938379333904
Energy: 1.3449988003062228
Energy: 1.4713938379333904
Energy: 1.3449988003067854
Energy: 1.4713938379333904
Energy: 1.3449988003062228

minimum gb energy = 1.2971919853099498 eV
minimum distance =  2.2924002192872 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.02051692725922478
Energy: 1.1180116595953722
Energy: 0.02051692725969218
Energy: 1.1180116595953722
Energy: 0.02051692725969218
Energy: 1.1180116595963068
Energy: 0.021419582749011047
Energy: 0.43500192468833154
Energy: 0.021419582749011047
Energy: 0.4350019246887989
Energy: 0.02141958274947845
Energy: 0.4350019246887989
Energy: 1.847153630571425
Energy: 0.43516643905363184
Energy: 1.84715363057049
Energy: 0.4351664496251686
Energy: 1.8471536307039074
Energy: 0.4351664334759711
Energy: 0.021419582749011047
Energy: 0.43500192468786403
Energy: 0.02141958274947845
Energy: 0.43500192468786403
Energy: 0.021419582749011047
Energy: 0.43500192468786403

minimum gb energy = 0.02051692725922478 eV
minimum distance =  2.48408830019026 Angstroms
sigma value = 1