Model name: model_name=MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049999177455902
cohesive_energy=3.3532637165796375
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01033917345796577
Energy: 0.011903874831828747
Energy: 0.3489677582382305
Energy: 0.011903874831828747
Energy: 0.011903874831828747
Energy: 0.5764762510171548
Energy: 0.011903874831828747
Energy: 0.5764762510171548
Energy: 0.3489677582382305
Energy: 0.011903874831828747
Energy: 0.01033917345796577
Energy: 0.011903874831356792
Energy: 0.011903874831828747
Energy: 0.5764762510171548
Energy: 0.011903874831356792
Energy: 0.5764762510166551

minimum gb energy = 0.01033917345796577 eV
minimum distance =  2.67397307909705 Angstroms
sigma value = 1


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

Energy: 0.6195213792646856
Energy: 0.5893918724263044
Energy: 0.6806650685212117
Energy: 0.5893918724269103
Energy: 0.6073463992811737
Energy: 0.6154489640371611
Energy: 0.5857099922153027
Energy: 0.6154489640371611
Energy: 0.6022302422326523
Energy: 0.5796255366688798
Energy: 0.6083697278131128
Energy: 0.5796255366688798
Energy: 0.5717642625891508
Energy: 0.6100335914267456
Energy: 0.5877258770949289
Energy: 0.6100335914267456
Energy: 0.592777406102608
Energy: 0.5936618984073911
Energy: 0.610005999441387
Energy: 0.5936618984067851
Energy: 0.5839884308917871
Energy: 0.6587393077348792
Energy: 0.5770506218421476
Energy: 0.6587393077354854
Energy: 0.595748044960754
Energy: 0.5829728393298786
Energy: 0.584673202459802
Energy: 0.5829728393298786
Energy: 0.5563252627006521
Energy: 0.5936985872201702
Energy: 0.5929802380974322
Energy: 0.5936985872201702
Energy: 0.5874049925586415
Energy: 0.7260156344742679
Energy: 0.6428402698099535
Energy: 0.7260156344742679
Energy: 0.5755455424229949
Energy: 0.57887821119982
Energy: 0.5471040897100563
Energy: 0.57887821119982
Energy: 0.5776035816542866
Energy: 0.6039805401587441
Energy: 0.5874171534553652
Energy: 0.6039805401593502
Energy: 0.6205455061244249
Energy: 0.5936041277627816
Energy: 0.581645504745894
Energy: 0.5936041277627816
Energy: 0.584140498266808
Energy: 0.5981162986289077
Energy: 0.5943631005375488
Energy: 0.5981162986283015
Energy: 0.6702372554593147
Energy: 0.5881861862225922
Energy: 0.5852220667730014
Energy: 0.5881861862225922
Energy: 0.6034947424197178
Energy: 0.5951437514265044
Energy: 0.6267244002174304
Energy: 0.5951437514265044
Energy: 0.6021173834319935
Energy: 0.5896736005471613
Energy: 0.6125713482163413
Energy: 0.5896736005471613
Energy: 0.6083600416878819
Energy: 0.5795094445010767
Energy: 0.5670541964514348
Energy: 0.5795094445010767
Energy: 0.585805596635825
Energy: 0.5984502715367973
Energy: 0.5946294872888824
Energy: 0.5984502715361912
Energy: 0.5574555023438109
Energy: 0.5918214192733503
Energy: 0.5819461474009515
Energy: 0.5918214192733503
Energy: 0.6250281592438078
Energy: 0.7259433331812479
Energy: 0.588402706786039
Energy: 0.7259433331818539
Energy: 0.5789402327961072
Energy: 0.5795007449905674
Energy: 0.5548661421280867
Energy: 0.5795007449911734
Energy: 0.5877156597759656
Energy: 0.6611558899106754
Energy: 0.6089519113793579
Energy: 0.6611558899106754
Energy: 0.6254156567017248
Energy: 0.593879408541122
Energy: 0.5718799013071386
Energy: 0.5938794085423341
Energy: 0.610131669761422
Energy: 0.5801149703955227
Energy: 0.5840716414702479
Energy: 0.5801149703955227
Energy: 0.5848321632844603
Energy: 0.6574190877118845
Energy: 0.6175147096436506
Energy: 0.6574190877118845
Energy: 0.5946670422024704
Energy: 0.5936544922796949
Energy: 0.5572104859592272
Energy: 0.5936544922803009
Energy: 0.5896651821735057
Energy: 0.6818678505279425
Energy: 0.5874463092053102
Energy: 0.6818678505279425
Energy: 0.6019274110648948
Energy: 0.5778443696793433
Energy: 0.6070207817960688
Energy: 0.5778443696799493
Energy: 0.6070731691043001
Energy: 0.6152251370270846
Energy: 0.5819136166168342
Energy: 0.6152251370270846
Energy: 0.6194966239958559
Energy: 0.5899832034251853
Energy: 0.644298511002739
Energy: 0.5899832034257912
Energy: 0.6087958115865965
Energy: 0.6053559531189486
Energy: 0.5844188041087903
Energy: 0.6053559531189486
Energy: 0.6073608250333019
Energy: 0.5821757051474631
Energy: 0.6094232267597521
Energy: 0.5821757051474631
Energy: 0.5927333129619048
Energy: 0.6019137162189562
Energy: 0.5893218471817497
Energy: 0.6019137162189562

minimum gb energy = 0.5471040897100563 eV
minimum distance =  2.53999934251637 Angstroms
sigma value = 1


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

Energy: 0.6487204644626307
Energy: 0.6356401552023557
Energy: 0.667080549112324
Energy: 0.6356401552030152
Energy: 0.6206929631220073
Energy: 0.6520630910154449
Energy: 0.6016343007938979
Energy: 0.652063091014754
Energy: 0.5727924477281013
Energy: 0.6363029573728273
Energy: 0.641788693726151
Energy: 0.6363029573742093
Energy: 0.6034543747531854
Energy: 0.630186131940144
Energy: 0.6096050349255904
Energy: 0.630186131940144
Energy: 0.6028940797017482
Energy: 0.6178372583517459
Energy: 0.6472915764883521
Energy: 0.6178372583517459
Energy: 0.6617359001608814
Energy: 0.6178300023272247
Energy: 0.657963464539077
Energy: 0.6178300023258426
Energy: 0.6453974112529236
Energy: 0.6387648494108566
Energy: 0.6146734414693177
Energy: 0.6387648494226037
Energy: 0.5727181730592472
Energy: 0.6362184514829494
Energy: 0.6269340965255016
Energy: 0.6362184514836404
Energy: 0.6027047967603195
Energy: 0.7745477943062324
Energy: 0.5876895505945378
Energy: 0.7745477943055415
Energy: 0.6067370790189655
Energy: 0.6381341496102626
Energy: 0.6140405008894869
Energy: 0.6381341496088806
Energy: 0.6604614977354429
Energy: 0.6268588682580739
Energy: 0.604617820198817
Energy: 0.6268588682587649
Energy: 0.5878945115834909
Energy: 0.626402234427015
Energy: 0.6420041777238102
Energy: 0.626402234428397
Energy: 0.6129885908128987
Energy: 0.6151540098085239
Energy: 0.6086201772928179
Energy: 0.615154009807142
Energy: 0.6130315512566187
Energy: 0.6152550435082594
Energy: 0.6181411145589851
Energy: 0.6152550435103326
Energy: 0.5877630916974086
Energy: 0.6263988649443696
Energy: 0.6238161158591977
Energy: 0.6263988649450605
Energy: 0.6606066085002946
Energy: 0.6268866866337621
Energy: 0.6086023186936329
Energy: 0.6268866866351441
Energy: 0.6069602562691673
Energy: 0.6381251580061303
Energy: 0.5872697264384419
Energy: 0.6381251580068215
Energy: 0.6028125074001911
Energy: 0.7745116379928089
Energy: 0.5875377636900759
Energy: 0.7745116379928089
Energy: 0.5727920371581512
Energy: 0.6360635904854659
Energy: 0.6095042959433224
Energy: 0.636063590484084
Energy: 0.6452703868191803
Energy: 0.6397172780743631
Energy: 0.6095425018354814
Energy: 0.6397172780757451
Energy: 0.6616288213165027
Energy: 0.6177353904324162
Energy: 0.6000659080527597
Energy: 0.6177353904317252
Energy: 0.6028878578385606
Energy: 0.6178226187388994
Energy: 0.6190517743267696
Energy: 0.6178226187388994
Energy: 0.6031034646798203
Energy: 0.6301582918676529
Energy: 0.6089503799000439
Energy: 0.6301582918669619
Energy: 0.5727345225046565
Energy: 0.6379809370473657
Energy: 0.6239733354433079
Energy: 0.6379809370466747
Energy: 0.6208097226750776
Energy: 0.6522248720474068
Energy: 0.6085309703421883
Energy: 0.6522248720460248
Energy: 0.6487204644633217
Energy: 0.6356401552023557
Energy: 0.6737522731636825
Energy: 0.6356401552023557
Energy: 0.6206929631220073
Energy: 0.6520630910154449
Energy: 0.6016343007938979
Energy: 0.652063091014754
Energy: 0.5727924477274102
Energy: 0.6363029573728273
Energy: 0.6262855826003066
Energy: 0.6363029573742093
Energy: 0.6034543747531854
Energy: 0.630186131940144
Energy: 0.6038453718898638
Energy: 0.630186131940835

minimum gb energy = 0.5727181730592472 eV
minimum distance =  2.4167897365345 Angstroms
sigma value = 25


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

Energy: 0.659290240264842
Energy: 0.6593834760779366
Energy: 0.7341165890609791
Energy: 0.6593834760779366
Energy: 0.6342044546997947
Energy: 0.662915211983334
Energy: 0.6841991998466695
Energy: 0.662915211983334
Energy: 0.6010137768282172
Energy: 0.6894115813722085
Energy: 0.6671409285902118
Energy: 0.6894115813730118
Energy: 0.6373349282947764
Energy: 0.6747281253978595
Energy: 0.6334639597118755
Energy: 0.6747281253978595
Energy: 0.624561933158147
Energy: 0.6608175563250319
Energy: 0.6990327979531125
Energy: 0.6608175563250319
Energy: 0.7041158650145685
Energy: 0.6904107419213257
Energy: 0.6982407448449197
Energy: 0.6904107419221289
Energy: 0.6951134154272868
Energy: 0.671660165742123
Energy: 0.6497037381097907
Energy: 0.671660165742123
Energy: 0.7630985027286169
Energy: 0.6609605686069532
Energy: 0.6193951180943872
Energy: 0.6609605686069532
Energy: 0.6498023997324357
Energy: 0.649228440625927
Energy: 0.7335549153922778
Energy: 0.649228440625927
Energy: 0.6455979273501903
Energy: 0.690705071862806
Energy: 0.6196856974064182
Energy: 0.6907050718620027
Energy: 0.6216439507756909
Energy: 0.6587767526475452
Energy: 0.6237131343824044
Energy: 0.6587767526475452
Energy: 0.6191922420182013
Energy: 0.6592990046032886
Energy: 0.6361359086160231
Energy: 0.6592990046032886
Energy: 0.6671598721746724
Energy: 0.6767766524988633
Energy: 0.6188608180595372
Energy: 0.6767766524988633
Energy: 0.6500675747004159
Energy: 0.6654139049788241
Energy: 0.6342708482098228
Energy: 0.6654139049788241
Energy: 0.624139103221648
Energy: 0.6616572311582172
Energy: 0.6091891921844117
Energy: 0.6616572311582172
Energy: 0.6243644569443354
Energy: 0.7371655164840691
Energy: 0.6350084783911921
Energy: 0.7371655164840691
Energy: 0.6146479376154685
Energy: 0.6894243078557809
Energy: 0.6007716389260257
Energy: 0.6894243078565842
Energy: 0.6332043827324356
Energy: 0.6557722663044862
Energy: 0.6911276517834419
Energy: 0.6557722663044862
Energy: 0.620598429344542
Energy: 0.6753137644217627
Energy: 0.6245449033910623
Energy: 0.6753137644217627
Energy: 0.6976957227249906
Energy: 0.6906648977554409
Energy: 0.6375180205654566
Energy: 0.6906648977554409
Energy: 0.6422348671977574
Energy: 0.6545125042563774
Energy: 0.6367681039447438
Energy: 0.6545125042555741
Energy: 0.6600887039456668
Energy: 0.6605316303216425
Energy: 0.7017696037843428
Energy: 0.6605316303216425
Energy: 0.6329573903162151
Energy: 0.6566510330873434
Energy: 0.6839912433630043
Energy: 0.6566510330873434
Energy: 0.6008513593528896
Energy: 0.6886242959167956
Energy: 0.6456043847777289
Energy: 0.6886242959167956
Energy: 0.7220440001398967
Energy: 0.6749241051866133
Energy: 0.6331276623482164
Energy: 0.6749241051866133

minimum gb energy = 0.6007716389260257 eV
minimum distance =  2.43433077008239 Angstroms
sigma value = 9


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

Energy: 0.6629563042265315
Energy: 0.7161536037053555
Energy: 0.7895259552555788
Energy: 0.7161536037063138
Energy: 0.6678451130972504
Energy: 0.6839076856861714
Energy: 0.6450834985947773
Energy: 0.6839076856861714
Energy: 0.6705751849056103
Energy: 0.7177038005783013
Energy: 0.6446503887121285
Energy: 0.7177038005792596
Energy: 0.8018980747283145
Energy: 0.7358054481784139
Energy: 0.6571505220434011
Energy: 0.7358054481784139
Energy: 0.7412146800889247
Energy: 0.683483696494058
Energy: 0.7588107441291466
Energy: 0.683483696494058
Energy: 0.6274040049483904
Energy: 0.7152571754697588
Energy: 0.6895467285687782
Energy: 0.7152571754688005
Energy: 0.8292766255592411
Energy: 0.6777370041902393
Energy: 0.6670161317111101
Energy: 0.677737004189281
Energy: 0.7252635812452777
Energy: 0.7151232018342998
Energy: 0.6419560769202635
Energy: 0.7151232018342998
Energy: 0.6440883882094014
Energy: 0.6837912936735421
Energy: 0.7009189285907372
Energy: 0.6837912936745003
Energy: 0.6948726382767099
Energy: 0.7142820231312295
Energy: 0.653715713952248
Energy: 0.7142820231302712
Energy: 0.6362579071606325
Energy: 0.7002661833909546
Energy: 0.6571384272065601
Energy: 0.7002661833909546
Energy: 0.7632863266102201
Energy: 0.7140947204239474
Energy: 0.6573231603660488
Energy: 0.7140947204239474
Energy: 0.627400523118242
Energy: 0.7173636593851839
Energy: 0.6543747578873691
Energy: 0.7173636593861422
Energy: 0.6975901028752678
Energy: 0.6486415529776662
Energy: 0.7572280480436797
Energy: 0.6486415529776662
Energy: 0.627411783970857
Energy: 0.7173727737531598
Energy: 0.6838642544200914
Energy: 0.7173727737531598
Energy: 0.7632406923242359
Energy: 0.7140748682296759
Energy: 0.6572612091346596
Energy: 0.7140748682287397
Energy: 0.6363635117040262
Energy: 0.7002646649769722
Energy: 0.6405304492815103
Energy: 0.7002646649760139
Energy: 0.6948972560870518
Energy: 0.7142438026387485
Energy: 0.653617479797673
Energy: 0.7142438026377903
Energy: 0.6451225240505276
Energy: 0.6838161717125893
Energy: 0.7041232117543678
Energy: 0.6838161717125893
Energy: 0.7253775755682034
Energy: 0.7150954896557662
Energy: 0.6420537030408723
Energy: 0.7150954896557662
Energy: 0.8293013975099626
Energy: 0.6777087529619877
Energy: 0.6671183158456582
Energy: 0.677708752962946

minimum gb energy = 0.627400523118242 eV
minimum distance =  2.50912231716022 Angstroms
sigma value = 25


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

Energy: 0.6806662496773545
Energy: 0.7303260568220717
Energy: 0.870619309151266
Energy: 0.7303260568220717
Energy: 0.6697274075248798
Energy: 0.7435704209576965
Energy: 0.6599651868765374
Energy: 0.7435704209576965
Energy: 0.7686575574702579
Energy: 0.7586252051315331
Energy: 0.6605196391376824
Energy: 0.7586252051315331
Energy: 0.796426946235634
Energy: 0.7312316254708123
Energy: 0.7708139666944808
Energy: 0.7312316254708123
Energy: 0.7717037338384471
Energy: 0.701067518022975
Energy: 0.6598724575019551
Energy: 0.701067518022975
Energy: 0.6596116113746078
Energy: 0.7616759952265514
Energy: 0.7821852583711332
Energy: 0.7616759952265514
Energy: 0.6594353239808226
Energy: 0.7002012413144667
Energy: 0.67079642209791
Energy: 0.7002012413144667
Energy: 0.7692590735741728
Energy: 0.7320661345445514
Energy: 0.6726044074659111
Energy: 0.7320661345445514
Energy: 0.6612559973630571
Energy: 0.7009072584637873
Energy: 0.6600613678936169
Energy: 0.7009072584637873
Energy: 0.7862146636615973
Energy: 0.7233571951878865
Energy: 0.7706611014171197
Energy: 0.7233571951867015
Energy: 0.6812179817529476
Energy: 0.7301126510719644
Energy: 0.8695489774600355
Energy: 0.7301126510719644
Energy: 0.660354047392417
Energy: 0.673452685084608
Energy: 0.7876818020991063
Energy: 0.673452685084608
Energy: 0.7720029480203922
Energy: 0.7587096089933915
Energy: 0.6456881889513608
Energy: 0.7587096089922064
Energy: 0.6734097180088969
Energy: 0.7297607638865476
Energy: 0.6724648565304567
Energy: 0.7297607638865476
Energy: 0.6703572286048693
Energy: 0.7298695924365537
Energy: 0.7713373803248649
Energy: 0.7298695924365537
Energy: 0.6618556846969598
Energy: 0.7237122426396705
Energy: 0.6598000960451867
Energy: 0.7237122426396705
Energy: 0.6615034942901059
Energy: 0.7335186451761087
Energy: 0.7871313399025294
Energy: 0.7335186451761087

minimum gb energy = 0.6456881889513608 eV
minimum distance =  2.54195067172654 Angstroms
sigma value = 17


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

Energy: 0.7175325880306944
Energy: 0.7213654019053716
Energy: 0.9042620379478868
Energy: 0.7213654019047004
Energy: 0.7511167242763528
Energy: 0.7075532987038896
Energy: 0.6563565302566938
Energy: 0.7075532987038896
Energy: 0.8115767944256553
Energy: 0.7098668284051123
Energy: 0.6600737364537308
Energy: 0.7098668284051123
Energy: 0.6978390049950234
Energy: 0.7193983456263817
Energy: 0.7055724735909351
Energy: 0.7193983456263817
Energy: 0.8066004406478126
Energy: 0.7186838129213984
Energy: 0.7669264868314595
Energy: 0.7186838129220695
Energy: 0.6635994195312989
Energy: 0.7389587737690376
Energy: 0.7556497422025924
Energy: 0.7389587737690376
Energy: 0.6940195095902348
Energy: 0.6991353345629683
Energy: 0.6761457613592312
Energy: 0.6991353345636396
Energy: 0.7763850208396934
Energy: 0.7506695143388779
Energy: 0.6645032013373484
Energy: 0.7506695143388779
Energy: 0.7013712021157592
Energy: 0.7151781631843265
Energy: 0.7572095431339809
Energy: 0.7151781631843265
Energy: 0.8571119470284655
Energy: 0.706089484600533
Energy: 0.6582395318311138
Energy: 0.7060894846012042
Energy: 0.6564717300881512
Energy: 0.7163415948574273
Energy: 0.857568465140626
Energy: 0.7163415948574273
Energy: 0.6646064089611983
Energy: 0.698622619316822
Energy: 0.6796730993760293
Energy: 0.6986226193174931
Energy: 0.8207214902537604
Energy: 0.7158765094917666
Energy: 0.732658722609529
Energy: 0.7158765094917666
Energy: 0.6586973908331315
Energy: 0.7461698647535525
Energy: 0.7496059666564349
Energy: 0.7461698647535525
Energy: 0.7110565582223514
Energy: 0.725501867982137
Energy: 0.7159454938650271
Energy: 0.7255018679814659
Energy: 0.746133959226544
Energy: 0.74993703412097
Energy: 0.7491124118209396
Energy: 0.74993703412097
Energy: 0.6767222806047088
Energy: 0.7129700549255881
Energy: 0.8112118919133116
Energy: 0.7129700549262593
Energy: 0.7360002490398007
Energy: 0.7102505115658712
Energy: 0.6635458067079322
Energy: 0.7102505115658712
Energy: 0.6967041788352506
Energy: 0.7160408649267954
Energy: 0.7092355519643296
Energy: 0.7160408649267954
Energy: 0.6767062758874044
Energy: 0.7392844974978448
Energy: 0.7533704202075165
Energy: 0.7392844974978448
Energy: 0.7034475046482429
Energy: 0.7098057534965114
Energy: 0.7765966116023951
Energy: 0.7098057534965114
Energy: 0.6766132224266977
Energy: 0.7332002580556631
Energy: 0.859109440341019
Energy: 0.7332002580556631
Energy: 0.7804525765897389
Energy: 0.7208523498641022
Energy: 0.65948021503451
Energy: 0.7208523498641022
Energy: 0.6976829560914511
Energy: 0.7238264154224097
Energy: 0.7457802028970161
Energy: 0.7238264154230807
Energy: 0.6994148884918928
Energy: 0.7399641505178612
Energy: 0.7470687137022379
Energy: 0.7399641505185325
Energy: 0.7522956128221773
Energy: 0.7183513941440062
Energy: 0.6556863968127836
Energy: 0.7183513941440062
Energy: 0.6669926432324219
Energy: 0.7643063015378287
Energy: 0.8720966570214842
Energy: 0.7643063015378287
Energy: 0.7353122739195099
Energy: 0.7373816570935284
Energy: 0.7772661851693122
Energy: 0.7373816570935284
Energy: 0.7765658899099108
Energy: 0.739773610391689
Energy: 0.7048984851108835
Energy: 0.739773610391018
Energy: 0.6643398471611569
Energy: 0.7153165745605315
Energy: 0.750716325930705
Energy: 0.7153165745612029

minimum gb energy = 0.6556863968127836 eV
minimum distance =  2.42270911991806 Angstroms
sigma value = 53


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

Energy: 0.5953986022689032
Energy: 0.5956977083297632
Energy: 0.9255540622973772
Energy: 0.5956977083297632
Energy: 0.7584822086889461
Energy: 0.6579771762912469
Energy: 0.6972490378032381
Energy: 0.6579771762912469
Energy: 0.7594979341941742
Energy: 0.5962795621140458
Energy: 0.7402201514951382
Energy: 0.5962795621140458
Energy: 0.7600128418963249
Energy: 0.5963814672100028
Energy: 0.6927746004475293
Energy: 0.5963814672100028
Energy: 0.7584760508820774
Energy: 0.6579535773931434
Energy: 0.6499173187184997
Energy: 0.6579535773931434
Energy: 0.5953986022704483
Energy: 0.5956977083297632
Energy: 0.8447361792949963
Energy: 0.5956977083297632
Energy: 0.7584822173285611
Energy: 0.6579771762912469
Energy: 0.6972490378032381
Energy: 0.6579771762912469
Energy: 0.7596628452999109
Energy: 0.5962795621140458
Energy: 0.7402201514951382
Energy: 0.5962795621140458
Energy: 0.7598939604161069
Energy: 0.5963814672100028
Energy: 0.6972616568889554
Energy: 0.5963814672100028
Energy: 0.7584760171514893
Energy: 0.6579535773931434
Energy: 0.7300282997057869
Energy: 0.6579535773931434
Energy: 0.5953986022689032
Energy: 0.5956977083297632
Energy: 0.8447474684065295
Energy: 0.5956977083297632
Energy: 0.7584821866667717
Energy: 0.6579771762912469
Energy: 0.6973301817330848
Energy: 0.6579771762912469
Energy: 0.7595632508381328
Energy: 0.5962795621140458
Energy: 0.7402201515074992
Energy: 0.5962795621140458

minimum gb energy = 0.5953986022689032 eV
minimum distance =  2.53304744321368 Angstroms
sigma value = 9


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

Energy: 0.6699978858518232
Energy: 0.7186517947315644
Energy: 0.87666456963619
Energy: 0.7186517947321361
Energy: 0.8014880814152886
Energy: 0.6989783022225692
Energy: 0.6884863668679788
Energy: 0.6989783022225692
Energy: 0.7409053730167474
Energy: 0.7087368909248308
Energy: 0.7020718622287268
Energy: 0.7087368909248308
Energy: 0.7965621719104757
Energy: 0.7163903356122858
Energy: 0.7015212361192088
Energy: 0.7163903356122858
Energy: 0.8313873238529773
Energy: 0.7070366956193969
Energy: 0.7019778763011928
Energy: 0.7070366956193969
Energy: 0.6629625324769295
Energy: 0.6934873518674826
Energy: 0.8145508242815875
Energy: 0.6934873518680545
Energy: 0.8723470562592697
Energy: 0.7023935263319545
Energy: 0.6972683679334747
Energy: 0.7023935263319545
Energy: 0.6915400129113556
Energy: 0.7267531364711889
Energy: 0.7290027155112432
Energy: 0.726753136470617
Energy: 0.7554655763210103
Energy: 0.737435432580313
Energy: 0.6745636797803757
Energy: 0.737435432580313
Energy: 0.7405863135448124
Energy: 0.6985044505429474
Energy: 0.6761046246053721
Energy: 0.6985044505429474
Energy: 0.6894638173473879
Energy: 0.7188958520450813
Energy: 0.8485920021491052
Energy: 0.7188958520450813
Energy: 0.78035416293728
Energy: 0.7617677240116714
Energy: 0.6970783041526988
Energy: 0.7617677240116714
Energy: 0.6867929125389898
Energy: 0.7015171380223812
Energy: 0.7929926579235739
Energy: 0.7015171380218094
Energy: 0.787202270841114
Energy: 0.7266979552054916
Energy: 0.6878556962807668
Energy: 0.7266979552054916
Energy: 0.6972336981713444
Energy: 0.7180415392659002
Energy: 0.7227715180163472
Energy: 0.7180415392664721
Energy: 0.687324649796963
Energy: 0.7482700738698379
Energy: 0.7268547454249085
Energy: 0.7482700738698379
Energy: 0.7144806794613289
Energy: 0.718160175634629
Energy: 0.6980691962362201
Energy: 0.718160175634629
Energy: 0.6996460828363321
Energy: 0.7018868519420737
Energy: 0.852276677920025
Energy: 0.7018868519426457
Energy: 0.8418752706788202
Energy: 0.7143266890160966
Energy: 0.6706158444637368
Energy: 0.7143266890166685
Energy: 0.6872180721214062
Energy: 0.7066184407048325
Energy: 0.7667698973705447
Energy: 0.7066184407048325
Energy: 0.7534260755911493
Energy: 0.7258445330052634
Energy: 0.7525251814530252
Energy: 0.7258445330058352
Energy: 0.7216255714581734
Energy: 0.7229319137478084
Energy: 0.6740552232635431
Energy: 0.7229319137478084
Energy: 0.6822427861211828
Energy: 0.7150361503234332
Energy: 0.7552730764882619
Energy: 0.7150361503234332
Energy: 0.8200465897997566
Energy: 0.7291286642445424
Energy: 0.689274977816612
Energy: 0.7291286642451142
Energy: 0.6899239645385645
Energy: 0.765294105674214
Energy: 0.8460874400898665
Energy: 0.7652941056736422
Energy: 0.708350017725748
Energy: 0.6939754217426735
Energy: 0.6865432504956351
Energy: 0.6939754217426735
Energy: 0.7161452084552536
Energy: 0.7094744518651345
Energy: 0.7558898812595286
Energy: 0.7094744518657063
Energy: 0.6915650089041409
Energy: 0.7310736051724037
Energy: 0.7450614628557033
Energy: 0.7310736051724037
Energy: 0.7116827022195186
Energy: 0.6938138170814415
Energy: 0.6734016239104708
Energy: 0.6938138170808696
Energy: 0.6888498177283183
Energy: 0.7641501968254137
Energy: 0.8290037686880873
Energy: 0.7641501968254137
Energy: 0.8164846827804916
Energy: 0.726490719385833
Energy: 0.7037448200797833
Energy: 0.726490719385261
Energy: 0.6846768793000253
Energy: 0.7031048489623349
Energy: 0.7542026462459832
Energy: 0.7031048489623349
Energy: 0.6848652392130762
Energy: 0.7145668667123274
Energy: 0.7407262972168688
Energy: 0.7145668667117555
Energy: 0.7549862990794657
Energy: 0.7327328361404813
Energy: 0.7533893223102452
Energy: 0.7327328361410532
Energy: 0.7043465182663242
Energy: 0.7436457426487914
Energy: 0.8676002820353207
Energy: 0.7436457426487914

minimum gb energy = 0.6629625324769295 eV
minimum distance =  2.47260661543261 Angstroms
sigma value = 73


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

Energy: 0.6652546584844871
Energy: 0.7084596767844684
Energy: 0.824484230453246
Energy: 0.7084596767844684
Energy: 0.7514550504653289
Energy: 0.7098526132644416
Energy: 0.7017022106828122
Energy: 0.7098526132644416
Energy: 0.6898493321171403
Energy: 0.6927984116754046
Energy: 0.7017723901783285
Energy: 0.6927984116763118
Energy: 0.7042923244655788
Energy: 0.7128102728857701
Energy: 0.7071895610833745
Energy: 0.7128102728848629
Energy: 0.6826790159113875
Energy: 0.7100451680143713
Energy: 0.6802994350973864
Energy: 0.7100451680143713
Energy: 0.7098908189778511
Energy: 0.7196666416990143
Energy: 0.8304847131583638
Energy: 0.7196666416981069
Energy: 0.8595331411271917
Energy: 0.69351764319208
Energy: 0.70206133861407
Energy: 0.6935176431929873
Energy: 0.6842068860339641
Energy: 0.6871852291403228
Energy: 0.7931793999595699
Energy: 0.6871852291403228
Energy: 0.8506616883866366
Energy: 0.7015030466144672
Energy: 0.6771285065109836
Energy: 0.7015030466153744
Energy: 0.7098561429825302
Energy: 0.6961467883685516
Energy: 0.6896624991284102
Energy: 0.6961467883685516
Energy: 0.7029187451067235
Energy: 0.7295813690727229
Energy: 0.8488448026731087
Energy: 0.7295813690727229
Energy: 0.7611903492444866
Energy: 0.7124358268982877
Energy: 0.6840451794559747
Energy: 0.7124358268982877
Energy: 0.7086279684993929
Energy: 0.7004864429859
Energy: 0.9010902935740178
Energy: 0.7004864429849926
Energy: 0.8091734026063251
Energy: 0.7013914544227344
Energy: 0.7099209173967521
Energy: 0.7013914544227344
Energy: 0.6705482095306365
Energy: 0.7191278234550864
Energy: 0.7593840812409225
Energy: 0.7191278234550864
Energy: 0.7671430954837651
Energy: 0.7278182637113364
Energy: 0.7023911034783029
Energy: 0.7278182637113364
Energy: 0.6757102438695977
Energy: 0.6927996896175034
Energy: 0.6901196013662473
Energy: 0.6927996896175034
Energy: 0.6756831041375385
Energy: 0.6926205383368791
Energy: 0.688777404091067
Energy: 0.6926205383377864
Energy: 0.7008208303694151
Energy: 0.7019670074550142
Energy: 0.6828517583054879
Energy: 0.7019670074550142
Energy: 0.701819184093677
Energy: 0.7199128704776745
Energy: 0.8584723527350072
Energy: 0.7199128704776745
Energy: 0.8109519447180503
Energy: 0.6929356176904726
Energy: 0.7319413692688693
Energy: 0.6929356176904726
Energy: 0.7070449980102377
Energy: 0.7014881996588783
Energy: 0.9007629684091931
Energy: 0.7014881996588783

minimum gb energy = 0.6652546584844871 eV
minimum distance =  2.45826082247969 Angstroms
sigma value = 7


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

Energy: 0.6834918487127611
Energy: 0.7182422013697753
Energy: 0.812287474586321
Energy: 0.7182422013697753
Energy: 0.784384283886117
Energy: 0.6972252843547149
Energy: 0.7285674647918562
Energy: 0.6972252843559981
Energy: 0.7066572028698124
Energy: 0.7056252895938636
Energy: 0.7141390663468794
Energy: 0.7056252895957884
Energy: 0.8327996846404849
Energy: 0.7081800375682579
Energy: 0.7029603846511686
Energy: 0.7081800375682579
Energy: 0.7061265582080836
Energy: 0.7020113906966765
Energy: 0.7157810665959351
Energy: 0.7020113906966765
Energy: 0.6996473593200513
Energy: 0.7066671059046856
Energy: 0.824796097646751
Energy: 0.7066671059034024
Energy: 0.7881005253288065
Energy: 0.7738752847950163
Energy: 0.7350843542803149
Energy: 0.7738752847962993
Energy: 0.6983634891053074
Energy: 0.7151150422276208
Energy: 0.8433643165032789
Energy: 0.7151150422276208
Energy: 0.8704503184014524
Energy: 0.7036690656594917
Energy: 0.70271016711001
Energy: 0.7036690656601333
Energy: 0.7042238600873431
Energy: 0.7161856524990429
Energy: 0.7778516951042983
Energy: 0.7161856524990429
Energy: 0.7212804667056187
Energy: 0.7225659263455856
Energy: 0.723101003755939
Energy: 0.7225659263455856
Energy: 0.6998552661233403
Energy: 0.7051912463247699
Energy: 0.7100465802650628
Energy: 0.7051912463254115
Energy: 0.6940650354484826
Energy: 0.7003624835409309
Energy: 0.8328402999840718
Energy: 0.7003624835402893
Energy: 0.7105231427588866
Energy: 0.7025270805987675
Energy: 0.7399164029577802
Energy: 0.702527080599409
Energy: 0.704056711495235
Energy: 0.7057392863336268
Energy: 0.7920990451017994
Energy: 0.7057392863336268
Energy: 0.8035405752068477
Energy: 0.7027426807696721
Energy: 0.683600693096435
Energy: 0.7027426807703137
Energy: 0.6983690832734498
Energy: 0.6986211986157967
Energy: 0.8499426267698965
Energy: 0.6986211986157967
Energy: 0.7073446505541592
Energy: 0.7704205246049197
Energy: 0.7318725419161762
Energy: 0.7704205246055613
Energy: 0.6985213634813248
Energy: 0.697161874804739
Energy: 0.831392694424296
Energy: 0.6971618748034557
Energy: 0.7015276055245967
Energy: 0.7045640077658305
Energy: 0.7208262206148479
Energy: 0.7045640077658305
Energy: 0.8430581365818344
Energy: 0.6969903124917595
Energy: 0.7028334336992756
Energy: 0.6969903124943256
Energy: 0.7243718901524999
Energy: 0.7209872815629215
Energy: 0.7555581566551975
Energy: 0.7209872815616385
Energy: 0.8077376673431912
Energy: 0.7091244187529984
Energy: 0.7260982881484362
Energy: 0.7091244187529984
Energy: 0.6892188459018589
Energy: 0.7189440391955666
Energy: 0.8122415787709989
Energy: 0.7189440391942833
Energy: 0.7484045532439604
Energy: 0.7020865103886936
Energy: 0.7174191139883634
Energy: 0.7020865103899769
Energy: 0.722833115989618
Energy: 0.7326490664866028
Energy: 0.7098817312353498
Energy: 0.7326490664859612
Energy: 0.7060655091166087
Energy: 0.7153576477582521
Energy: 0.7702436409015933
Energy: 0.715357647756969
Energy: 0.728400690044034
Energy: 0.7004187620138934
Energy: 0.7029631653959809
Energy: 0.7004187620138934
Energy: 0.6779308872743004
Energy: 0.7114948055744027
Energy: 0.8033067416274502
Energy: 0.7114948055756857
Energy: 0.7466147388208144
Energy: 0.7010980420734425
Energy: 0.7283537629735484
Energy: 0.7010980420734425
Energy: 0.6779321387936488
Energy: 0.7114158845380493
Energy: 0.763646612281495
Energy: 0.7114158845386909

minimum gb energy = 0.6779308872743004 eV
minimum distance =  2.45510580522137 Angstroms
sigma value = 29


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

Energy: 0.6539329773042694
Energy: 0.637963238992495
Energy: 0.6956975046165322
Energy: 0.6379632389922715
Energy: 0.6783203812468643
Energy: 0.6690864214463609
Energy: 0.6739757875433934
Energy: 0.6690864214465595
Energy: 0.6876486995704794
Energy: 0.6559039431687458
Energy: 0.6500431116298739
Energy: 0.6559039431694162
Energy: 0.6535112046948132
Energy: 0.6337690305606237
Energy: 0.6737561371610777
Energy: 0.6337690303389313
Energy: 0.6541503429715848
Energy: 0.6375501570309409
Energy: 0.6814381541475658
Energy: 0.6375501570311644
Energy: 0.678013712449862
Energy: 0.6618016487339031
Energy: 0.6780071255308648
Energy: 0.6618016487336796
Energy: 0.6884753679262138
Energy: 0.6375310165315184
Energy: 0.6541571391976329
Energy: 0.637531016531742
Energy: 0.6737285801106321
Energy: 0.6337853369987759
Energy: 0.653536474476078
Energy: 0.6337853370026993
Energy: 0.6501335318323823
Energy: 0.6553720943137422
Energy: 0.6814063607698841
Energy: 0.6553720943137422

minimum gb energy = 0.6337690303389313 eV
minimum distance =  2.52186993793502 Angstroms
sigma value = 5


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

Energy: 0.6473488768927629
Energy: 0.6725861910283238
Energy: 0.7864582868423304
Energy: 0.6725861910283238
Energy: 0.6444055121962037
Energy: 0.7027760533826248
Energy: 0.6286787271154561
Energy: 0.7027760533832309
Energy: 0.6248511555262564
Energy: 0.7156435521556088
Energy: 0.7421598467185336
Energy: 0.7156435521568209
Energy: 0.7234860698653383
Energy: 0.6788919759704958
Energy: 0.6431108776499085
Energy: 0.6788919759698897
Energy: 0.6294386662537957
Energy: 0.6989981594935677
Energy: 0.7324310585934888
Energy: 0.6989981594935677
Energy: 0.6773838982206253
Energy: 0.6940214485889512
Energy: 0.6357228400543351
Energy: 0.6940214485889512
Energy: 0.6308064767348558
Energy: 0.6659649518220803
Energy: 0.6274900829522858
Energy: 0.6659649518220803
Energy: 0.6295264000915655
Energy: 0.6871071773744594
Energy: 0.7467918884255725
Energy: 0.6871071773732474
Energy: 0.6361010208431512
Energy: 0.7297252705830091
Energy: 0.631861586523156
Energy: 0.729725270582403
Energy: 0.6357311035373904
Energy: 0.6958033167407647
Energy: 0.6476221528772317
Energy: 0.6958033167419767
Energy: 0.6328560451186622
Energy: 0.6968641447223002
Energy: 0.6273311938610275
Energy: 0.6968641447223002
Energy: 0.6249815497302436
Energy: 0.7096007662166025
Energy: 0.7116435833637121
Energy: 0.7096007662159963
Energy: 0.7782286569912221
Energy: 0.6412800602402777
Energy: 0.6439630309743696
Energy: 0.6412800602420959
Energy: 0.6298313792338572
Energy: 0.6428017858506909
Energy: 0.7081379730624757
Energy: 0.642801785851903
Energy: 0.7629321874878262
Energy: 0.7184347056661662
Energy: 0.627753383448356
Energy: 0.7184347056661662
Energy: 0.6351066217273436
Energy: 0.7336427697196303
Energy: 0.7777863146528061
Energy: 0.7336427697184181
Energy: 0.6545045213675562
Energy: 0.684625469352531
Energy: 0.6315878218789771
Energy: 0.6846254693531372
Energy: 0.6324131669185606
Energy: 0.693685100441024
Energy: 0.7818849190250299
Energy: 0.6936851004416302
Energy: 0.6373501223683349
Energy: 0.6661542437415136
Energy: 0.6274573098254097
Energy: 0.6661542437415136
Energy: 0.6238506451121213
Energy: 0.6727414850850543
Energy: 0.6371325789597682
Energy: 0.6727414850856605
Energy: 0.6844610815993937
Energy: 0.722881712849126
Energy: 0.6349569507734363
Energy: 0.7228817128515502
Energy: 0.6358567641334268
Energy: 0.6612877696047635
Energy: 0.6361010722302248
Energy: 0.6612877696053696
Energy: 0.6214368254284831
Energy: 0.6956685494338083
Energy: 0.6211982608846484
Energy: 0.6956685494338083
Energy: 0.6945231891549928
Energy: 0.6914085692767236
Energy: 0.6238814967613313
Energy: 0.6914085692773297
Energy: 0.6982839105137837
Energy: 0.6954123557763714
Energy: 0.6281688513155212
Energy: 0.6954123557769775
Energy: 0.6430334128634305
Energy: 0.6940288473843106
Energy: 0.6296215140353056
Energy: 0.6940288473849165
Energy: 0.6288954807362772
Energy: 0.6746685195371378
Energy: 0.7076061004960567
Energy: 0.674668519537744
Energy: 0.7084228067675873
Energy: 0.754545223025846
Energy: 0.633861137622589
Energy: 0.754545223025846
Energy: 0.625873469103859
Energy: 0.7227762559544549
Energy: 0.6621576031289693
Energy: 0.7227762559538489
Energy: 0.8380203703637393
Energy: 0.6408362565430276
Energy: 0.6346460791496692
Energy: 0.6408362565424216
Energy: 0.6309330913837669
Energy: 0.6374007272217371
Energy: 0.7688780255969206
Energy: 0.6374007272229493
Energy: 0.7049965039334029
Energy: 0.7219352710498232
Energy: 0.6247467842918762
Energy: 0.7219352710492172
Energy: 0.6375116953220659
Energy: 0.7229405856355247
Energy: 0.7072820592570035
Energy: 0.7229405856337066

minimum gb energy = 0.6211982608846484 eV
minimum distance =  2.44810386623184 Angstroms
sigma value = 1


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

Energy: 0.6103825522887945
Energy: 0.6108120721214717
Energy: 0.7020939200013192
Energy: 0.6108120721223096
Energy: 0.7214617495994914
Energy: 0.712027821077162
Energy: 0.6058380239061046
Energy: 0.7120278210763239
Energy: 0.5916330123507455
Energy: 0.6108391591464233
Energy: 0.7690478715050588
Energy: 0.6108391591464233
Energy: 0.6912451509927068
Energy: 0.6556093306366395
Energy: 0.5976282347643099
Energy: 0.6556093306425052
Energy: 0.5918988081459409
Energy: 0.6734288480060922
Energy: 0.6675944851075204
Energy: 0.6734288480069303
Energy: 0.7598582963798455
Energy: 0.7091396513569099
Energy: 0.599026080655824
Energy: 0.7091396513560719
Energy: 0.5902173058446378
Energy: 0.6503315276688737
Energy: 0.6392098228985229
Energy: 0.6503315276688737
Energy: 0.5898995325709456
Energy: 0.6762314040052952
Energy: 0.6397447448100263
Energy: 0.6762314040061332
Energy: 0.6104367299395198
Energy: 0.6124327017861197
Energy: 0.6160873642461515
Energy: 0.6124327017852819
Energy: 0.6103818692861441
Energy: 0.612405314988191
Energy: 0.6407609125887093
Energy: 0.6124053149873531
Energy: 0.590064145399649
Energy: 0.6762355627951874
Energy: 0.6050631753452801
Energy: 0.6762355627968444
Energy: 0.5901721602932212
Energy: 0.65054216626913
Energy: 0.6390175183418606
Energy: 0.650542166268292
Energy: 0.7605739434729281
Energy: 0.7091048435617029
Energy: 0.599197801073704
Energy: 0.7091048435617029
Energy: 0.5920122135513074
Energy: 0.6733343513054585
Energy: 0.6802538272430483
Energy: 0.6733343513046205
Energy: 0.6911780514995781
Energy: 0.6557207287267894
Energy: 0.5976174452802276
Energy: 0.6557207287267894
Energy: 0.5916222335987219
Energy: 0.6110083512725426
Energy: 0.6193788089701326
Energy: 0.6110083512725426
Energy: 0.7216111666511273
Energy: 0.7119889380308789
Energy: 0.6058550500388868
Energy: 0.7119889380317169
Energy: 0.6103825522887945
Energy: 0.6108120721223096
Energy: 0.8297620775892275
Energy: 0.6108120721223096
Energy: 0.7217539184696623
Energy: 0.712027821077162
Energy: 0.6058380239052666
Energy: 0.7120278210763239
Energy: 0.5916330123507455
Energy: 0.6108391591455853
Energy: 0.7690478715058968
Energy: 0.6108391591464233
Energy: 0.6912458949946068
Energy: 0.6556093306399914
Energy: 0.5976282347651479
Energy: 0.6556093306408294
Energy: 0.5918988081459409
Energy: 0.6734288480060922
Energy: 0.6675944851041684
Energy: 0.6734288480069303
Energy: 0.7602385320194817
Energy: 0.7091396513569099
Energy: 0.599026080656662
Energy: 0.7091396513560719
Energy: 0.5902173058446378
Energy: 0.6503315276688737
Energy: 0.6307462965123666
Energy: 0.6503315276688737

minimum gb energy = 0.5898995325709456 eV
minimum distance =  2.49968137253759 Angstroms
sigma value = 17


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

Energy: 0.6033517209167509
Energy: 0.603782297063167
Energy: 0.8096121687222321
Energy: 0.603782297063167
Energy: 0.691137644414011
Energy: 0.6458521834014775
Energy: 0.5945362662920946
Energy: 0.6458521834014775
Energy: 0.5925768248239001
Energy: 0.5976228207718578
Energy: 0.6751209289240578
Energy: 0.5976228207723756
Energy: 0.8034038856818413
Energy: 0.6323567117713841
Energy: 0.591367093563362
Energy: 0.6323567117719019
Energy: 0.5887301851729936
Energy: 0.6762686722003062
Energy: 0.7513379319745574
Energy: 0.6762686722003062
Energy: 0.7435621994001923
Energy: 0.6910144832131403
Energy: 0.5982497806863849
Energy: 0.6910144832126224
Energy: 0.6052612105296519
Energy: 0.66596200200108
Energy: 0.6352026848227668
Energy: 0.66596200200108
Energy: 0.6587494221159907
Energy: 0.6817054045125185
Energy: 0.5910469525142351
Energy: 0.6817054045130363
Energy: 0.6045810675166019
Energy: 0.6818474644487131
Energy: 0.5984862708466764
Energy: 0.6818474644487131
Energy: 0.6066051626037517
Energy: 0.6959260426435195
Energy: 0.5923454461898386
Energy: 0.6959260426440375
Energy: 0.5912091981842897
Energy: 0.6826960198055059
Energy: 0.6518775326904677
Energy: 0.6826960198055059
Energy: 0.5931482317843444
Energy: 0.619163777906354
Energy: 0.5957870975831554
Energy: 0.6191637779068719
Energy: 0.5864986430593946
Energy: 0.7204915806134056
Energy: 0.5871271903984593
Energy: 0.7204915806134056
Energy: 0.6037376254341869
Energy: 0.6289704321264155
Energy: 0.6046411739559364
Energy: 0.6289704321258975
Energy: 0.5958705199169589
Energy: 0.6855603687513554
Energy: 0.6089385516195422
Energy: 0.6855603687513554
Energy: 0.591312021170223
Energy: 0.6654079226055529
Energy: 0.7495603481051281
Energy: 0.6654079226055529
Energy: 0.7097235772606331
Energy: 0.6367512630710772
Energy: 0.5965595699438572
Energy: 0.6367512630705593
Energy: 0.5882775982559547
Energy: 0.6045381790534463
Energy: 0.7019186115789251
Energy: 0.6045381790529283
Energy: 0.6963365981825038
Energy: 0.7079682406655918
Energy: 0.5939455318494063
Energy: 0.7079682406655918
Energy: 0.5951478089584957
Energy: 0.5967166307301651
Energy: 0.728206564598653
Energy: 0.5967166307301651
Energy: 0.606266727436922
Energy: 0.6410140684194461
Energy: 0.588816700965859
Energy: 0.6410140684189282
Energy: 0.5884712973636963
Energy: 0.6671849227126692
Energy: 0.6072148306035624
Energy: 0.6671849227131871
Energy: 0.7436704145544533
Energy: 0.6401876410577783
Energy: 0.5963593910295363
Energy: 0.6401876410588141
Energy: 0.591086763703387
Energy: 0.6658767512751883
Energy: 0.6905830823997655
Energy: 0.6658767512751883
Energy: 0.7004323034045167
Energy: 0.6055298963881657
Energy: 0.5894276310816788
Energy: 0.6055298963881657
Energy: 0.586956295131261
Energy: 0.6298351568911198
Energy: 0.7084358403844008
Energy: 0.6298351568911198
Energy: 0.6819254143118714
Energy: 0.6920100989029722
Energy: 0.5920209948493472
Energy: 0.6920100989029722
Energy: 0.6119486074991853
Energy: 0.7098047849442548
Energy: 0.5953987250550559
Energy: 0.709804784943219
Energy: 0.6036334508639215
Energy: 0.6281864516491783
Energy: 0.6052562987155208
Energy: 0.6281864516491783
Energy: 0.6584887611979927
Energy: 0.7215924411235969
Energy: 0.709313791976846
Energy: 0.721592441123079
Energy: 0.5930445810096655
Energy: 0.6278845618122314
Energy: 0.5955854501529593
Energy: 0.6278845618117134
Energy: 0.7378950741030819
Energy: 0.6825742751882108
Energy: 0.589785240990758
Energy: 0.6825742751887286
Energy: 0.5915286526421245
Energy: 0.6949290366018412
Energy: 0.6913323556377844
Energy: 0.6949290366018412
Energy: 0.6262277672736086
Energy: 0.6819697883622763
Energy: 0.6018927523633845
Energy: 0.6819697883596866
Energy: 0.590629665019623
Energy: 0.6731459763031737
Energy: 0.6155057537562855
Energy: 0.6731459763031737
Energy: 0.7214302998442621
Energy: 0.6661376159214392
Energy: 0.6044696423850894
Energy: 0.6661376159214392
Energy: 0.5964273767170724
Energy: 0.691831352442596
Energy: 0.744227313143955
Energy: 0.6918313524431139
Energy: 0.7268834381352935
Energy: 0.6764527913319442
Energy: 0.6085409443975686
Energy: 0.6764527913319442

minimum gb energy = 0.5864986430593946 eV
minimum distance =  2.45394037275825 Angstroms
sigma value = 89


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

Energy: 0.5268308356100916
Energy: 0.527031939957877
Energy: 0.73167895646193
Energy: 0.527031939957877
Energy: 0.6680589415186129
Energy: 0.5446926307087605
Energy: 0.5379029421474201
Energy: 0.5446926307087605
Energy: 0.5360347229862985
Energy: 0.6547805083125867
Energy: 0.7781329637902392
Energy: 0.654780508313942
Energy: 0.7770306114235256
Energy: 0.54467833952254
Energy: 0.5377707948039552
Energy: 0.54467833952254
Energy: 0.5358484408032732
Energy: 0.6063166480808678
Energy: 0.6919188964151841
Energy: 0.6063166480822229
Energy: 0.528436516981838
Energy: 0.5275687071437923
Energy: 0.5296143640782816
Energy: 0.5275687071437923
Energy: 0.5360861785564132
Energy: 0.6052076283855433
Energy: 0.6708282810715865
Energy: 0.6052076283855433
Energy: 0.6632487813079171
Energy: 0.6547944275461641
Energy: 0.5379163331264657
Energy: 0.6547944275461641
Energy: 0.5359146927431715
Energy: 0.6064098960719247
Energy: 0.6478777988006342
Energy: 0.6064098960719247
Energy: 0.6768479905669276
Energy: 0.6064555904913126
Energy: 0.6537601891864547
Energy: 0.6064555904913126
Energy: 0.5268675202681473
Energy: 0.6247943570382627
Energy: 0.5358685355408053
Energy: 0.6247943570382627
Energy: 0.5269406785944913
Energy: 0.6033917651303906
Energy: 0.5379023014992529
Energy: 0.6033917651317456
Energy: 0.6543468117829824
Energy: 0.606669288170531
Energy: 0.5342388995449388
Energy: 0.606669288170531
Energy: 0.6544390403814432
Energy: 0.5608174707497274
Energy: 0.6545210804261921
Energy: 0.5608174707497274
Energy: 0.5279344359412513
Energy: 0.606662208357775
Energy: 0.6543441576664412
Energy: 0.606662208357775

minimum gb energy = 0.5268308356100916 eV
minimum distance =  2.49855546611685 Angstroms
sigma value = 13


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

Energy: 0.5774807103821445
Energy: 0.6700061205088463
Energy: 0.8248536796032483
Energy: 0.6700061205099823
Energy: 0.6177657539361986
Energy: 0.6498927395111178
Energy: 0.5317170463651382
Energy: 0.6498927395128218
Energy: 0.5353545775628258
Energy: 0.6790283949670606
Energy: 0.6102194731516982
Energy: 0.6790283949676287
Energy: 0.683972149106641
Energy: 0.6210742441093091
Energy: 0.5295367747162604
Energy: 0.6210742441093091
Energy: 0.5398101549983687
Energy: 0.6727906380942403
Energy: 0.5658015842680273
Energy: 0.6727906380948084
Energy: 0.5433806483576228
Energy: 0.6218463368707473
Energy: 0.5660832383029449
Energy: 0.6218463368701792
Energy: 0.5398321189276485
Energy: 0.6867140650666733
Energy: 0.7736777152964694
Energy: 0.6867140650649693
Energy: 0.5300544089786678
Energy: 0.6906576590499569
Energy: 0.5660879257572639
Energy: 0.6906576590493889
Energy: 0.5417727040868611
Energy: 0.6299520625877506
Energy: 0.7496180871116426
Energy: 0.6299520625871826
Energy: 0.6200520287324791
Energy: 0.6846145071671267
Energy: 0.5296947226602163
Energy: 0.6846145071676947
Energy: 0.5404879857626685
Energy: 0.6318757814125848
Energy: 0.6750662738905591
Energy: 0.631875781412017
Energy: 0.7243446149897864
Energy: 0.6849335186576687
Energy: 0.5332370213324117
Energy: 0.6849335186571006
Energy: 0.5445623581761727
Energy: 0.6352643230733583
Energy: 0.5403072113359164
Energy: 0.6352643230733583
Energy: 0.681796609673875
Energy: 0.6567673227720716
Energy: 0.533216530611993
Energy: 0.6567673227720716
Energy: 0.5405891409064346
Energy: 0.6313488688351518
Energy: 0.5298897901313558
Energy: 0.6313488688351518
Energy: 0.5573174296675737
Energy: 0.6060996838848617
Energy: 0.5269997308066273
Energy: 0.6060996838842937
Energy: 0.5300244975551683
Energy: 0.6638595957224169
Energy: 0.5272504487038465
Energy: 0.6638595957224169
Energy: 0.5256631129996672
Energy: 0.6631329202643478
Energy: 0.5644884587582434
Energy: 0.6631329202632118
Energy: 0.5259683448930295
Energy: 0.6756427545778354
Energy: 0.5643764675286925
Energy: 0.6756427545795395
Energy: 0.5265226072963571
Energy: 0.6702361998281635
Energy: 0.5644327864767834
Energy: 0.6702361998287316
Energy: 0.5309252958915996
Energy: 0.6267961675099587
Energy: 0.5644985912192215
Energy: 0.6267961675110947
Energy: 0.5289839801543217
Energy: 0.6716435066183936
Energy: 0.527306255361591
Energy: 0.6716435066195297
Energy: 0.5630412346848791
Energy: 0.6320968339135238
Energy: 0.5272465921804627
Energy: 0.6320968339140918
Energy: 0.5402820372843434
Energy: 0.6361004210398773
Energy: 0.6670694240831598
Energy: 0.6361004210398773
Energy: 0.7269876004287216
Energy: 0.6684478892433166
Energy: 0.5332122708053115
Energy: 0.6684478892450206
Energy: 0.5847885485114824
Energy: 0.6751387195497931
Energy: 0.53139487316502
Energy: 0.6751387195497931
Energy: 0.6852403901729849
Energy: 0.684471394547124
Energy: 0.5340110898374485
Energy: 0.68447139454826
Energy: 0.5402804376868288
Energy: 0.605699122807023
Energy: 0.6294400194410782
Energy: 0.6056991228087271
Energy: 0.5676058516998332
Energy: 0.6902931685577802
Energy: 0.5279015273331226
Energy: 0.6902931685566441
Energy: 0.5399809285605828
Energy: 0.6687070629883966
Energy: 0.7574729704435855
Energy: 0.6687070629866926
Energy: 0.5293048805314308
Energy: 0.677140853839908
Energy: 0.5661322133767045
Energy: 0.677140853838204
Energy: 0.5398800975236837
Energy: 0.6770214962230308
Energy: 0.7415546173439226
Energy: 0.6770214962235988
Energy: 0.6682375691083687
Energy: 0.5964941953338997
Energy: 0.566074531006304
Energy: 0.5964941953384437
Energy: 0.5383580719104013
Energy: 0.6797659866457678
Energy: 0.6602851452272555
Energy: 0.6797659866474718
Energy: 0.6729157831492061
Energy: 0.6492702640154226
Energy: 0.527727919868901
Energy: 0.6492702640171267

minimum gb energy = 0.5256631129996672 eV
minimum distance =  2.30021544204408 Angstroms
sigma value = 37


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

Energy: 0.5717242233835691
Energy: 0.5632668909120364
Energy: 0.6508858705874907
Energy: 0.5632668909120364
Energy: 0.6174082816580901
Energy: 0.5932795245365823
Energy: 0.4901864352373363
Energy: 0.5932795245365823
Energy: 0.4994265339697058
Energy: 0.6838481155660705
Energy: 0.6614426985903116
Energy: 0.6838481155660705
Energy: 0.5451185086371237
Energy: 0.5489464672006875
Energy: 0.49051110691778793
Energy: 0.5489464672006875
Energy: 0.48976320940902446
Energy: 0.5933329733104221
Energy: 0.5417175004316105
Energy: 0.5933329733104221
Energy: 0.48599480346607266
Energy: 0.6390626481653157
Energy: 0.5464257339780433
Energy: 0.6390626481653157
Energy: 0.4967806672989203
Energy: 0.7022087511975503
Energy: 0.617883277337114
Energy: 0.7022087511975503
Energy: 0.48065588659747877
Energy: 0.500203475078681
Energy: 0.5022027451235751
Energy: 0.500203475078681
Energy: 0.49048111673135397
Energy: 0.5934563441499373
Energy: 0.595030776033016
Energy: 0.5934563441499373
Energy: 0.6617053266369928
Energy: 0.6838211016008033
Energy: 0.5465184182312682
Energy: 0.6838211016017806
Energy: 0.5018822829482023
Energy: 0.680196933432183
Energy: 0.5445637858457909
Energy: 0.680196933432183
Energy: 0.5005177043595163
Energy: 0.5875268321549917
Energy: 0.4904887225566784
Energy: 0.5875268321549917
Energy: 0.5444012161507062
Energy: 0.638861541304241
Energy: 0.7446584157093334
Energy: 0.638861541304241
Energy: 0.6664802718347115
Energy: 0.7119631424707017
Energy: 0.48041446252990383
Energy: 0.7119631424707017
Energy: 0.5716138479184961
Energy: 0.5733313620316377
Energy: 0.4805483451035276
Energy: 0.5733313620316377
Energy: 0.571919849992668
Energy: 0.588559325509442
Energy: 0.48994050501922615
Energy: 0.5885593255084648
Energy: 0.5444183466242074
Energy: 0.6800840793307871
Energy: 0.4914565442975849
Energy: 0.6800840793307871
Energy: 0.5449021078045069
Energy: 0.6933661570637369
Energy: 0.489363199416187
Energy: 0.6933661570646918
Energy: 0.4893510165488061
Energy: 0.5876256848100984
Energy: 0.48971366114140263
Energy: 0.5876256848100984
Energy: 0.48946188047555583
Energy: 0.6542712526347987
Energy: 0.544567209046259
Energy: 0.6542712526338215

minimum gb energy = 0.48041446252990383 eV
minimum distance =  2.41287776511938 Angstroms
sigma value = 25


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

Energy: 0.4667751531997259
Energy: 0.5884606193574415
Energy: 0.7988797750226424
Energy: 0.5884606193574415
Energy: 0.5863421125825519
Energy: 0.5991025672862813
Energy: 0.44433303104195027
Energy: 0.5991025672862813
Energy: 0.441044185959164
Energy: 0.4411663479089707
Energy: 0.7863882307435486
Energy: 0.4411663479089707
Energy: 0.4835876129252053
Energy: 0.6002647995869238
Energy: 0.444374902072167
Energy: 0.6002647995876867
Energy: 0.4452933252446605
Energy: 0.6009993351399644
Energy: 0.6192675279063294
Energy: 0.6009993351399644
Energy: 0.6178939560012786
Energy: 0.6002216087183644
Energy: 0.446125087562589
Energy: 0.6002216087183644
Energy: 0.44557102970315915
Energy: 0.5186875275670557
Energy: 0.48553685481165987
Energy: 0.5186875275670557
Energy: 0.63059346578126
Energy: 0.5420929264635744
Energy: 0.4421904221273575
Energy: 0.5420929264628115
Energy: 0.44531015245367245
Energy: 0.5991431964619452
Energy: 0.5890097349350302
Energy: 0.5991431964619452
Energy: 0.4300515283589569
Energy: 0.588648114218857
Energy: 0.4676648743935526
Energy: 0.5886481142180939
Energy: 0.445632156382114
Energy: 0.5180120314551037
Energy: 0.5863100122747699
Energy: 0.5180120314558667
Energy: 0.7523455358055207
Energy: 0.6474892068885163
Energy: 0.44213068914110576
Energy: 0.6474892068885163
Energy: 0.44522796501224965
Energy: 0.5989820728920967
Energy: 0.5332920676592108
Energy: 0.5989820728920967
Energy: 0.7460845060780834
Energy: 0.6265549372453759
Energy: 0.44612027880005983
Energy: 0.6265549372453759
Energy: 0.44561181560008695
Energy: 0.5179644011307807
Energy: 0.4307857037970649
Energy: 0.5179644011307807
Energy: 0.5565195439976246
Energy: 0.6486325260534671
Energy: 0.4449874143462934
Energy: 0.6486325260534671
Energy: 0.44537339683228805
Energy: 0.5414521536724498
Energy: 0.44300024581397646
Energy: 0.5414521536724498
Energy: 0.5464045997455944
Energy: 0.5992250593651822
Energy: 0.44621805104829015
Energy: 0.5992250593651822
Energy: 0.47062553977882393
Energy: 0.5891335824900327
Energy: 0.4326167708342978
Energy: 0.5891335824900327
Energy: 0.6239458049110489
Energy: 0.6209474813954883
Energy: 0.44484081908805656
Energy: 0.6209474813954883
Energy: 0.4453231633255315
Energy: 0.6472903058400574
Energy: 0.43435591023651504
Energy: 0.6472903058400574
Energy: 0.4416319047748604
Energy: 0.5993241698262985
Energy: 0.4444287198599303
Energy: 0.5993241698262985
Energy: 0.44584053929073497
Energy: 0.6263688524458914
Energy: 0.5726932836885752
Energy: 0.6263688524458914
Energy: 0.4295655811264981
Energy: 0.6205860298989243
Energy: 0.444934095271862
Energy: 0.6205860298989243
Energy: 0.4449922721197681
Energy: 0.6483207862116425
Energy: 0.5316466555161469
Energy: 0.6483207862124055
Energy: 0.43246978994044166
Energy: 0.541154370210679
Energy: 0.441167092274317
Energy: 0.541154370209916

minimum gb energy = 0.4295655811264981 eV
minimum distance =  2.32611789431817 Angstroms
sigma value = 41


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

Energy: 0.5660468782723881
Energy: 0.5341123061371122
Energy: 0.7786237249803127
Energy: 0.5341123061371122
Energy: 0.6008007208609419
Energy: 0.529640366311958
Energy: 0.40025161316990887
Energy: 0.529640366311958
Energy: 0.41137543230524737
Energy: 0.522250565633496
Energy: 0.7464389641054539
Energy: 0.5222505656328703
Energy: 0.6020924407797419
Energy: 0.5292237599188256
Energy: 0.40025481276571595
Energy: 0.5292237599194511
Energy: 0.3972019498793691
Energy: 0.5458191504302337
Energy: 0.4173663330071078
Energy: 0.5458191504308592
Energy: 0.4336183210472876
Energy: 0.5299148463061283
Energy: 0.40023172843798965
Energy: 0.5299148463061283
Energy: 0.39965711762877804
Energy: 0.5306339619732376
Energy: 0.4356882539454525
Energy: 0.5306339619732376
Energy: 0.5942272617937011
Energy: 0.4751488879038033
Energy: 0.39789123691282763
Energy: 0.4751488879031776
Energy: 0.40204822328977446
Energy: 0.5914382655852944
Energy: 0.6021356085404544
Energy: 0.59143826558592
Energy: 0.603792823783611
Energy: 0.5223055998602926
Energy: 0.41209858605473504
Energy: 0.5223055998602926
Energy: 0.39965380246145493
Energy: 0.5296942059927637
Energy: 0.6007786464466894
Energy: 0.5296942059927637
Energy: 0.3911418259696304
Energy: 0.5342183124557662
Energy: 0.5667074853817884
Energy: 0.5342183124551407
Energy: 0.4021083812525127
Energy: 0.5734026540316759
Energy: 0.6403079984103194
Energy: 0.5734026540316759
Energy: 0.7453973522842003
Energy: 0.6717656184250362
Energy: 0.4119715810002246
Energy: 0.6717656184262876
Energy: 0.3997229972511099
Energy: 0.5281155777669798
Energy: 0.6009040647231779
Energy: 0.5281155777669798
Energy: 0.7030813051518607
Energy: 0.5746341569326151
Energy: 0.39788746872807335
Energy: 0.5746341569332407
Energy: 0.4020022580254272
Energy: 0.5732640227995028
Energy: 0.43380987192931025
Energy: 0.5732640227995028
Energy: 0.4925572074831663
Energy: 0.6244662745365243
Energy: 0.4002827029473792
Energy: 0.6244662745365243
Energy: 0.39963728990159325
Energy: 0.4744456304284828
Energy: 0.3928453430115161
Energy: 0.4744456304284828
Energy: 0.5006420411349044
Energy: 0.5733024459275539
Energy: 0.40458861238903815
Energy: 0.5733024459875834
Energy: 0.4138747256416672
Energy: 0.5739235520000021
Energy: 0.6140318825612804
Energy: 0.5739235520000021
Energy: 0.640945402114935
Energy: 0.6364044185503162
Energy: 0.40025540703242923
Energy: 0.6364044185503162
Energy: 0.5684668806705077
Energy: 0.5340774470098711
Energy: 0.3917951008603094
Energy: 0.534077447009274
Energy: 0.5566570671473821
Energy: 0.5809559659950666
Energy: 0.40281018383861006
Energy: 0.5809559659950666
Energy: 0.4138252824757455
Energy: 0.6239192864520032
Energy: 0.3936367664494681
Energy: 0.6239192864520032
Energy: 0.5472635330879431
Energy: 0.6205263001179749
Energy: 0.40033224181504307
Energy: 0.6205263001173493
Energy: 0.39966651210653686
Energy: 0.5755428765916154
Energy: 0.5092429722348446
Energy: 0.5755428765916154
Energy: 0.39781810701074477
Energy: 0.5809232937049411
Energy: 0.40458218131014223
Energy: 0.5809232937049411
Energy: 0.4020179933906581
Energy: 0.6266506670509554
Energy: 0.49868945403660514
Energy: 0.6266506670509554
Energy: 0.3919706381150976
Energy: 0.5993731554338251
Energy: 0.4024893526144792
Energy: 0.5993731554331994
Energy: 0.40239254885104764
Energy: 0.5730424701217008
Energy: 0.4797965128457167
Energy: 0.5730424701217008
Energy: 0.39362840666125487
Energy: 0.5798480613741781
Energy: 0.4166359116459137
Energy: 0.5798480613741781

minimum gb energy = 0.3911418259696304 eV
minimum distance =  2.32456134647121 Angstroms
sigma value = 15


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

Energy: 0.5651504728685036
Energy: 0.5934999442324788
Energy: 0.7589286106056148
Energy: 0.5934999442314188
Energy: 0.6285422982017889
Energy: 0.5321118276226743
Energy: 0.3745739196266106
Energy: 0.5321118276226743
Energy: 0.4219736464038369
Energy: 0.5144472571480463
Energy: 0.5107241834887121
Energy: 0.5144472571475164
Energy: 0.6586439063872717
Energy: 0.5148886519633139
Energy: 0.37448415696729576
Energy: 0.5148886519627839
Energy: 0.4081184292732657
Energy: 0.5993090629487668
Energy: 0.38570436075364173
Energy: 0.5993090629492969
Energy: 0.5016606522754424
Energy: 0.5157471061044555
Energy: 0.3748637839290145
Energy: 0.5157471061049854
Energy: 0.377561612773544
Energy: 0.48793738773577916
Energy: 0.4307165968320176
Energy: 0.48793738773471923
Energy: 0.4309790450335975
Energy: 0.48962796481015614
Energy: 0.3784125421417273
Energy: 0.48962796480962617
Energy: 0.3756652550067067
Energy: 0.5786731770497934
Energy: 0.5024973808180692
Energy: 0.5786731770487334
Energy: 0.6052087638284492
Energy: 0.5453001689574032
Energy: 0.40854830744902965
Energy: 0.5453001689574032
Energy: 0.3741209450232778
Energy: 0.5320657095311603
Energy: 0.6787531405166527
Energy: 0.5320657095316904
Energy: 0.5675129468433172
Energy: 0.5150249440856635
Energy: 0.4221895990202204
Energy: 0.5150249440851333
Energy: 0.3757243412677041
Energy: 0.5704989014599945
Energy: 0.7038374557129108
Energy: 0.5704989014594646
Energy: 0.36340837138595394
Energy: 0.5658920687192517
Energy: 0.5151742035506401
Energy: 0.5658920687187217
Energy: 0.374177056951103
Energy: 0.5166704369002965
Energy: 0.6297470530595322
Energy: 0.5166704369002965
Energy: 0.5097295008695976
Energy: 0.5151489228786204
Energy: 0.4224143843660265
Energy: 0.5151489228796804
Energy: 0.37568632414841996
Energy: 0.5537416786035517
Energy: 0.600902277685696
Energy: 0.5537416786051417
Energy: 0.4627898797509718
Energy: 0.5990203729411326
Energy: 0.4085425172641857
Energy: 0.5990203729390129
Energy: 0.37524926871538217
Energy: 0.5168985452153251
Energy: 0.5308539401200941
Energy: 0.5168985452153251
Energy: 0.43160865362243844
Energy: 0.5181924888306467
Energy: 0.3784327972689797
Energy: 0.5181924888306467
Energy: 0.3797972248531179
Energy: 0.5278180831859763
Energy: 0.4588087632217632
Energy: 0.5278180831843864
Energy: 0.49345641893984377
Energy: 0.5697932814034142
Energy: 0.3774818323809598
Energy: 0.5697932814039441
Energy: 0.40977989867031306
Energy: 0.5392343769811608
Energy: 0.605400788359813
Energy: 0.5392343769816909
Energy: 0.6122480788886107
Energy: 0.5175656700960201
Energy: 0.37458229118850955
Energy: 0.5175656700944302
Energy: 0.4234220390804816
Energy: 0.5572165951187987
Energy: 0.5729040278693156
Energy: 0.5572165951177388
Energy: 0.6239987405932973
Energy: 0.5672793694863053
Energy: 0.3774233698669892
Energy: 0.5672793694863053
Energy: 0.5667924053436623
Energy: 0.5814188249110416
Energy: 0.3611834331321358
Energy: 0.5814188249099815
Energy: 0.7388623867395817
Energy: 0.5153995070298026
Energy: 0.3745559908790706
Energy: 0.5153995070298026
Energy: 0.4234233400650373
Energy: 0.5817417628435991
Energy: 0.3665058805666577
Energy: 0.5817417628430693
Energy: 0.6404898277411522
Energy: 0.550384322828455
Energy: 0.37754659774957733
Energy: 0.5503843228295149
Energy: 0.4097832390097334
Energy: 0.56970708901616
Energy: 0.46247475984862196
Energy: 0.5697070890150999
Energy: 0.5366350602138374
Energy: 0.515725825365383
Energy: 0.3763937363874006
Energy: 0.515725825366443
Energy: 0.3799805243150085
Energy: 0.5818231836032448
Energy: 0.4921760598241381
Energy: 0.5818231836037746
Energy: 0.4000821824624687
Energy: 0.5354258355093605
Energy: 0.38204080894631554
Energy: 0.5354258355098904
Energy: 0.37001001827872465
Energy: 0.569402821810191
Energy: 0.48948352417832464
Energy: 0.569402821810191
Energy: 0.397152932790708
Energy: 0.5297695338643976
Energy: 0.4114727862772064
Energy: 0.5297695338638677
Energy: 0.3755354629529079
Energy: 0.5817665189801725
Energy: 0.6137542090873481
Energy: 0.5817665189796425

minimum gb energy = 0.3611834331321358 eV
minimum distance =  2.34902483938163 Angstroms
sigma value = 85


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

Energy: 0.4841657265577868
Energy: 0.5287625192177677
Energy: 0.5351079605946938
Energy: 0.5287625192177677
Energy: 0.7771120565952139
Energy: 0.47984567981814646
Energy: 0.3429300157431043
Energy: 0.47984567981814646
Energy: 0.4649468155338571
Energy: 0.4454683682895102
Energy: 0.6610546006277678
Energy: 0.4454683682895102
Energy: 0.6300562353729311
Energy: 0.47941007976589034
Energy: 0.3429146717360029
Energy: 0.47941007976635
Energy: 0.3579758592352201
Energy: 0.4306737274862933
Energy: 0.5366196625774772
Energy: 0.4306737274862933
Energy: 0.5060847216843399
Energy: 0.48851557032673343
Energy: 0.3429607667971096
Energy: 0.48851557032673343
Energy: 0.34092415665342807
Energy: 0.4558392681501185
Energy: 0.38630869290475933
Energy: 0.4558392681505781
Energy: 0.44619246938437546
Energy: 0.4796292655054232
Energy: 0.3429135467827879
Energy: 0.4796292655054232
Energy: 0.3424859557640096
Energy: 0.43807572773599535
Energy: 0.44679138742776536
Energy: 0.43807572773599535
Energy: 0.38624904352054834
Energy: 0.45538127196576983
Energy: 0.34133032407196257
Energy: 0.4553812719653102
Energy: 0.3440828147493397
Energy: 0.4885929349524729
Energy: 0.5062405032560496
Energy: 0.4885929349524729
Energy: 0.5388982860742202
Energy: 0.4794348213071048
Energy: 0.35848448374326747
Energy: 0.47943482130848375
Energy: 0.3425192619443182
Energy: 0.4378375547944594
Energy: 0.6298577499581819
Energy: 0.4378375547944594
Energy: 0.3266396778995513
Energy: 0.4454634111428733
Energy: 0.46524207487635477
Energy: 0.4454634111428733
Energy: 0.3439649887494944
Energy: 0.47939605121660156
Energy: 0.5890697383923562
Energy: 0.4793960512161419
Energy: 0.3246463394569777
Energy: 0.5212063093707758
Energy: 0.4845482016155053
Energy: 0.5212063093707758
Energy: 0.3424733579166338
Energy: 0.4379731763939069
Energy: 0.5889956294621607
Energy: 0.4379731763939069
Energy: 0.6614088503892014
Energy: 0.4455001650606359
Energy: 0.4652590757593583
Energy: 0.4455001650606359
Energy: 0.3438925109847242
Energy: 0.4791820614002315
Energy: 0.6300159482933412
Energy: 0.47918206140069125
Energy: 0.6239525261085325
Energy: 0.5454990898598127
Energy: 0.3584253181338994
Energy: 0.5454990898598127
Energy: 0.34247604567922824
Energy: 0.4378458211742505
Energy: 0.5061437311550246
Energy: 0.4378458211742505
Energy: 0.38737323256729256
Energy: 0.4752397807425201
Energy: 0.341263922139769
Energy: 0.4752397807425201
Energy: 0.34373982100219574
Energy: 0.4792602742066781
Energy: 0.44651105773395844
Energy: 0.4792602742066781
Energy: 0.41295193518245993
Energy: 0.5310485453573203
Energy: 0.3428638478932846
Energy: 0.5310485453573203
Energy: 0.34244595227738894
Energy: 0.40286623143473715
Energy: 0.38704044744865035
Energy: 0.40286623143473715
Energy: 0.539267333637916
Energy: 0.48000712138000784
Energy: 0.34357842108153136
Energy: 0.48000712138046747
Energy: 0.35964396734442544
Energy: 0.4796978641243663
Energy: 0.3245945657311533
Energy: 0.479697864124826
Energy: 0.5076209009547524
Energy: 0.5298323691718935
Energy: 0.3429498692940161
Energy: 0.5298323691718935
Energy: 0.46651768151697004
Energy: 0.4454142178811592
Energy: 0.32654840007244107
Energy: 0.4454142178811592
Energy: 0.5894033376009737
Energy: 0.4752021955162126
Energy: 0.3437131490953332
Energy: 0.4752021955162126
Energy: 0.4856145133033746
Energy: 0.5208484290698367
Energy: 0.3246394002227952
Energy: 0.5208484290698367
Energy: 0.5742808625342403
Energy: 0.5298473776647872
Energy: 0.34291970651253734
Energy: 0.5298473776643277
Energy: 0.46642313928464
Energy: 0.44541231680273646
Energy: 0.5370491857867674
Energy: 0.44541231680273646
Energy: 0.6705736854356757
Energy: 0.4751146628657644
Energy: 0.3434885247522194
Energy: 0.4751146628657644
Energy: 0.35964327986239913
Energy: 0.5325085575572914
Energy: 0.6244106542923932
Energy: 0.5325085575572914
Energy: 0.44460213998599707
Energy: 0.5208923200651143
Energy: 0.3429035988816632
Energy: 0.5208923200651143
Energy: 0.34256948774856355
Energy: 0.474972608407457
Energy: 0.40906356671379185
Energy: 0.474972608407457
Energy: 0.4365951095619717
Energy: 0.47525333130090086
Energy: 0.3435517962235374
Energy: 0.47525333130044123
Energy: 0.3440212728015749
Energy: 0.532013461694005
Energy: 0.4111669409645686
Energy: 0.5320134616944647
Energy: 0.3312721772126239
Energy: 0.499092421113338
Energy: 0.3442574402988397
Energy: 0.4990924211128783
Energy: 0.34263447095195615
Energy: 0.47492183988358827
Energy: 0.5157682292457365
Energy: 0.47492183988358827
Energy: 0.32579040032305934
Energy: 0.4791987522626343
Energy: 0.3614919016590142
Energy: 0.4791987522621746
Energy: 0.34397372073034843
Energy: 0.5319093051064838
Energy: 0.5070856993055729
Energy: 0.5319093051064838

minimum gb energy = 0.3245945657311533 eV
minimum distance =  2.35047674365686 Angstroms
sigma value = 113


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

Energy: 0.011681506250850841
Energy: 0.01240154893241277
Energy: 0.6190991353072485
Energy: 0.01240154893241277
Energy: 0.5040853827425419
Energy: 0.17462271272150773
Energy: 0.17405533822833952
Energy: 0.17462271272186106
Energy: 0.011681506250850841
Energy: 0.01240154893241277
Energy: 0.8520097618270672
Energy: 0.01240154893241277
Energy: 0.5040853827425419
Energy: 0.17462271272115434
Energy: 0.1742126279377341
Energy: 0.17462271272150773
Energy: 0.011681506250850841
Energy: 0.01240154893241277
Energy: 1.1403041928837208
Energy: 0.01240154893205942
Energy: 0.5040853827422083
Energy: 0.17462271272150773
Energy: 0.17421525651471487
Energy: 0.17462271272150773

minimum gb energy = 0.011681506250850841 eV
minimum distance =  2.83788990012898 Angstroms
sigma value = 1