Model name: model_name=EAM_IMD_BrommerGaehler_2006B_AlNiCo__MO_128037485276_003
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=6.400107890367508
cohesive_energy=0.4239253082373245
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[5.39491324907016e-21, 3.41316494870922e-21, -1.9136397716495997e-21, -3.42514922993154e-21, -3.41558423542656e-21, -2.0277467915230798e-21, 9.90556919206938e-22, 5.5207802454372e-21, 1.1061075002276518e-20, 1.70147954177532e-20, 2.30950557437832e-20, 2.9274170368130995e-20, 3.5325591514749e-20, 4.1061383864468997e-20, 4.6349047409659193e-20, 5.11075120126392e-20, 5.52832649738334e-20, 5.88497101611174e-20, 6.18001184326284e-20, 6.41397769712586e-20, 6.58821440607336e-20, 6.70520534388804e-20, 6.770862542349359e-20, 6.79149857739528e-20, 6.77044597642452e-20, 6.70474071266418e-20, 6.59028121393122e-20, 6.4224852550524e-20, 6.1961778054999e-20, 5.90504628933576e-20, 5.53882075433604e-20, 5.083738503214679e-20, 4.5283599948049195e-20, 3.91277168848944e-20, 3.2304046600688395e-20, 2.4468601772111396e-20, 1.5239279293720737e-20, 4.17195580257162e-21, -9.390789839565179e-21, -2.62098473379426e-20, -4.66816592788776e-20, -7.09237132749414e-20, -9.75679106983614e-20, -1.2321939947935499e-19, -1.435156128612036e-19, -1.567749062488608e-19, -1.65442361403474e-19, -1.7229326869045797e-19, -1.7092821419829e-19, -1.6135200445687198e-19, -1.6748193225855598e-19, -2.1142322862264e-19, -3.28050472341402e-19, -6.94114187501088e-19]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -3.6476901029332 eV

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

Energy: 0.000521593801025673
Energy: 0.23062941425952146
Energy: 0.8128598019305912
Energy: 0.23062941425952146
Energy: 0.23062941425952146
Energy: 0.759698184110685
Energy: 0.23062941425952146
Energy: 0.759698184110685
Energy: 0.8128598019305912
Energy: 0.23062941425952146
Energy: 0.000521593801025673
Energy: 0.23062941425952146
Energy: 0.23062941425952146
Energy: 0.759698184110685
Energy: 0.23062941425952146
Energy: 0.759698184110685

minimum gb energy = 0.000521593801025673 eV
minimum distance =  2.2627798448022 Angstroms
sigma value = 1


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

Energy: 0.24881413923441784
Energy: 0.47958345511563977
Energy: 0.3801841698522281
Energy: 0.47958345511563977
Energy: 0.4800123687729815
Energy: 0.44425962418914
Energy: 0.6122866000733901
Energy: 0.44425962418914
Energy: 0.38223429760878896
Energy: 0.593597746487324
Energy: 0.32996740219957305
Energy: 0.593597746487324
Energy: 0.5042017604542922
Energy: 0.4194387059623147
Energy: 0.5798025734940867
Energy: 0.4194387059623147
Energy: 0.246966088632296
Energy: 0.4832289546625619
Energy: 0.35665187982987995
Energy: 0.4832289546625619
Energy: 0.4647522502638525
Energy: 0.3818832043896304
Energy: 0.4014239597735137
Energy: 0.3818832043896304
Energy: 0.35569674927846034
Energy: 0.3885136729177006
Energy: 0.3303324801072279
Energy: 0.388513672917458
Energy: 0.33774169888749733
Energy: 0.36676447852891414
Energy: 0.3787561693230137
Energy: 0.36676447852891414
Energy: 0.26877441612884206
Energy: 0.3382726120756604
Energy: 0.3961570548906531
Energy: 0.3382726120756604
Energy: 0.3424396418762155
Energy: 0.3632238091601214
Energy: 0.3233373074004142
Energy: 0.3632238091601214
Energy: 0.3411014676350407
Energy: 0.33830479324398455
Energy: 0.37347519051256967
Energy: 0.33830479324398455
Energy: 0.3643930305054767
Energy: 0.3708813759574114
Energy: 0.3568635223652576
Energy: 0.3708813759574114
Energy: 0.33218046563465575
Energy: 0.39114128841503604
Energy: 0.4503027172090851
Energy: 0.39114128841503604
Energy: 0.4183989654384272
Energy: 0.38924095066803965
Energy: 0.34197769440414405
Energy: 0.38924095066803965
Energy: 0.3179442011240739
Energy: 0.47998381971264303
Energy: 0.3493547419367548
Energy: 0.47998381971264303
Energy: 0.43776822846182734
Energy: 0.4220515533049095
Energy: 0.5083944660514037
Energy: 0.4220515533049095
Energy: 0.37548238701870246
Energy: 0.5891991956121178
Energy: 0.45375331471621777
Energy: 0.5891991956121178
Energy: 0.5281687468497298
Energy: 0.44957179165900163
Energy: 0.5478636061978976
Energy: 0.44957179165900163
Energy: 0.32832541512326224
Energy: 0.5920790913949371
Energy: 0.3800837004704676
Energy: 0.5920790913946944
Energy: 0.4127667257481652
Energy: 0.43023088721868946
Energy: 0.4448682293788448
Energy: 0.43023088721868946
Energy: 0.35482418740549987
Energy: 0.4869357555166494
Energy: 0.24698810738563962
Energy: 0.4869357555164068
Energy: 0.36527669583029626
Energy: 0.38596362720283695
Energy: 0.5314107298168165
Energy: 0.38596362720283695
Energy: 0.32962074613632886
Energy: 0.3945032547340507
Energy: 0.35134456544969556
Energy: 0.3945032547340507
Energy: 0.4143652246148043
Energy: 0.3668832302723117
Energy: 0.32408651816417683
Energy: 0.3668832302723117
Energy: 0.38920317057940296
Energy: 0.3433967809055271
Energy: 0.26625027614534746
Energy: 0.3433967809055271
Energy: 0.33076593958023814
Energy: 0.3608354533871984
Energy: 0.3504866194235121
Energy: 0.3608354533871984
Energy: 0.36801707645259585
Energy: 0.3391923162808824
Energy: 0.33794101050011155
Energy: 0.3391923162808824
Energy: 0.3355146202771716
Energy: 0.3715765735507453
Energy: 0.39200046336243133
Energy: 0.3715765735507453
Energy: 0.44250421986863436
Energy: 0.3849834098103118
Energy: 0.32255361481850187
Energy: 0.3849834098103118
Energy: 0.36609488337431734
Energy: 0.3925146194296853
Energy: 0.37307846517133364
Energy: 0.3925146194296853
Energy: 0.3376046238373421
Energy: 0.46595598904640306
Energy: 0.3145510655197753
Energy: 0.46595598904640306
Energy: 0.438230536536578
Energy: 0.4314498443239969
Energy: 0.48250341331962276
Energy: 0.4314498443239969
Energy: 0.44235709944550355
Energy: 0.5704833806337041
Energy: 0.3644493731707837
Energy: 0.5704833806337041

minimum gb energy = 0.246966088632296 eV
minimum distance =  1.64889470279637 Angstroms
sigma value = 1


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

Energy: 0.39237006085193915
Energy: 0.46459637370823037
Energy: 0.38243497172307683
Energy: 0.46459637370823037
Energy: 0.46316650689962785
Energy: 0.4484886848129255
Energy: 0.6206667969337002
Energy: 0.44848868481264875
Energy: 0.38493731061677994
Energy: 0.5956800170918852
Energy: 0.27575215723171137
Energy: 0.5956800170916084
Energy: 0.49175170829359194
Energy: 0.42029260896104137
Energy: 0.5799085533655401
Energy: 0.42029260896104137
Energy: 0.39388715452025314
Energy: 0.47012251663774784
Energy: 0.36248719294442555
Energy: 0.47012251663802457
Energy: 0.44892310954663384
Energy: 0.3807577347040669
Energy: 0.3880075278901438
Energy: 0.3807577347040669
Energy: 0.37931128783371526
Energy: 0.37478230816398295
Energy: 0.2835213667827723
Energy: 0.37478230816398295
Energy: 0.3300018811789476
Energy: 0.370215517602928
Energy: 0.3694986552960518
Energy: 0.370215517602928
Energy: 0.42748799413593447
Energy: 0.34100052995121755
Energy: 0.30441147476969227
Energy: 0.34100052995121755
Energy: 0.3529155458170281
Energy: 0.37176715491752427
Energy: 0.3542787599682956
Energy: 0.37176715491752427
Energy: 0.3935204263058317
Energy: 0.376206755492956
Energy: 0.34555129339599355
Energy: 0.3762067554932311
Energy: 0.31439517340496137
Energy: 0.39184865494713467
Energy: 0.40445624367940597
Energy: 0.39184865494713467
Energy: 0.3482139248343768
Energy: 0.4682611486917999
Energy: 0.26478776202503906
Energy: 0.4682611486917999
Energy: 0.49870251598701165
Energy: 0.42438732494414183
Energy: 0.4181208401498206
Energy: 0.42438732494414183
Energy: 0.38860629804952307
Energy: 0.5883052351574367
Energy: 0.37660550573601304
Energy: 0.58830523515716
Energy: 0.5361992372711125
Energy: 0.456239591774498
Energy: 0.523597377945031
Energy: 0.456239591774498
Energy: 0.38207534958590633
Energy: 0.5939558945855465
Energy: 0.2746242635911521
Energy: 0.5939558945855465
Energy: 0.43088763090792054
Energy: 0.4327587727167197
Energy: 0.39043038660440804
Energy: 0.4327587727167197
Energy: 0.3928308877843958
Energy: 0.47539272853087683
Energy: 0.35927593682007386
Energy: 0.47539272853087683
Energy: 0.5186118263363175
Energy: 0.38568573483416824
Energy: 0.35335714645824606
Energy: 0.38568573483416824
Energy: 0.3716942926403946
Energy: 0.38247583811509306
Energy: 0.28168104460963367
Energy: 0.38247583811509306
Energy: 0.32821978534800733
Energy: 0.36823017749858816
Energy: 0.3993388044686403
Energy: 0.36823017749858816
Energy: 0.422418520741309
Energy: 0.3450357558347774
Energy: 0.30307321510381047
Energy: 0.3450357558347774
Energy: 0.3434740482901536
Energy: 0.37117198217505093
Energy: 0.3756111972225681
Energy: 0.3711719821753277
Energy: 0.38720004820246673
Energy: 0.3712090173742254
Energy: 0.33548291655452206
Energy: 0.3712090173742254
Energy: 0.33500026873878425
Energy: 0.3951486079376913
Energy: 0.3600809945074409
Energy: 0.3951486079376913
Energy: 0.3334055362895514
Energy: 0.45225440887220664
Energy: 0.26541099631734444
Energy: 0.45225440887220664
Energy: 0.42386469802993176
Energy: 0.4345565502739556
Energy: 0.4595933191336544
Energy: 0.4345565502739556
Energy: 0.37738955867375185
Energy: 0.5644739792482639
Energy: 0.363701326211211
Energy: 0.5644739792482639

minimum gb energy = 0.26478776202503906 eV
minimum distance =  1.6634203473118 Angstroms
sigma value = 25


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

Energy: 0.3170591558109801
Energy: 0.4484059815192914
Energy: 0.38734089063534155
Energy: 0.4484059815192914
Energy: 0.44784599490850124
Energy: 0.4547173906857392
Energy: 0.6254069047786985
Energy: 0.4547173906857392
Energy: 0.38700950953210933
Energy: 0.5953661839384089
Energy: 0.23617661433626172
Energy: 0.5953661839387295
Energy: 0.48356290355470793
Energy: 0.4206873535961124
Energy: 0.573748394905849
Energy: 0.4206873535961124
Energy: 0.3254347305681638
Energy: 0.4580815231243091
Energy: 0.3784111929608457
Energy: 0.4580815231243091
Energy: 0.43663203617560165
Energy: 0.38197530112827977
Energy: 0.3697276751341047
Energy: 0.38197530112827977
Energy: 0.42490989536852813
Energy: 0.3633504270233664
Energy: 0.25537654498205975
Energy: 0.3633504270233664
Energy: 0.34733955064557087
Energy: 0.37738724794714124
Energy: 0.3648903405009058
Energy: 0.37738724794714124
Energy: 0.37893665679790245
Energy: 0.36904442699152173
Energy: 0.3349320595059689
Energy: 0.36904442699152173
Energy: 0.3914477625412613
Energy: 0.3936729000354034
Energy: 0.4197371560483876
Energy: 0.3936729000354034
Energy: 0.49835509629895275
Energy: 0.4507770233120617
Energy: 0.34804916926167506
Energy: 0.4507770233120617
Energy: 0.3860051894397193
Energy: 0.43070209976516205
Energy: 0.48750103090602215
Energy: 0.43070209976516205
Energy: 0.37845216959792377
Energy: 0.5905837360399763
Energy: 0.31426178428784524
Energy: 0.5905837360399763
Energy: 0.516348423391283
Energy: 0.4637191749202219
Energy: 0.5263057305785405
Energy: 0.4637191749202219
Energy: 0.23570116691600715
Energy: 0.593288384513142
Energy: 0.3838882579809111
Energy: 0.593288384513142
Energy: 0.35522314992230575
Energy: 0.43738037203946756
Energy: 0.4177588394904365
Energy: 0.43738037203946756
Energy: 0.37148180965417005
Energy: 0.4658453250223349
Energy: 0.32445020470262065
Energy: 0.4658453250223349
Energy: 0.3446625259109297
Energy: 0.38542284449305125
Energy: 0.5095876981424304
Energy: 0.38542284449305125
Energy: 0.25073585357660433
Energy: 0.37195758012616476
Energy: 0.4102596514164744
Energy: 0.37195758012616476
Energy: 0.3774862742879123
Energy: 0.3755348832545863
Energy: 0.36203462285110294
Energy: 0.3755348832545863
Energy: 0.33174494479697153
Energy: 0.36697833436727983
Energy: 0.3697243638303731
Energy: 0.36697833436727983
Energy: 0.30155825299026495
Energy: 0.396467550981531
Energy: 0.3562902895814817
Energy: 0.396467550981531
Energy: 0.3295903163442869
Energy: 0.43267805173518914
Energy: 0.4813712476560374
Energy: 0.43267805173518914
Energy: 0.40369267560805944
Energy: 0.44230538490569354
Energy: 0.42449497139830045
Energy: 0.44230538490569354
Energy: 0.30560660000237216
Energy: 0.5598925559434744
Energy: 0.36286227365466367
Energy: 0.5598925559434744

minimum gb energy = 0.23570116691600715 eV
minimum distance =  1.68542483672387 Angstroms
sigma value = 9


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

Energy: 0.2422097846878076
Energy: 0.4196969742991534
Energy: 0.3933275549764217
Energy: 0.4196969742991534
Energy: 0.4156155516259068
Energy: 0.46430216854422146
Energy: 0.6441147836407078
Energy: 0.46430216854422146
Energy: 0.3915528191184505
Energy: 0.6014676045131453
Energy: 0.4254932540363792
Energy: 0.6014676045131453
Energy: 0.46295114030326384
Energy: 0.41893023868222284
Energy: 0.5766522017658915
Energy: 0.41893023868222284
Energy: 0.26311593327953775
Energy: 0.4395994319744543
Energy: 0.4138690761629924
Energy: 0.4395994319744543
Energy: 0.4162482627837447
Energy: 0.3898533923914568
Energy: 0.37266139243288354
Energy: 0.3898533923914568
Energy: 0.28987055631477765
Energy: 0.3740072783951804
Energy: 0.45971031018631864
Energy: 0.3740072783951804
Energy: 0.4002208121770546
Energy: 0.3953977552979626
Energy: 0.3908093141255412
Energy: 0.3953977552979626
Energy: 0.3526498911476934
Energy: 0.43562341096254764
Energy: 0.41189161695774573
Energy: 0.43562341096216395
Energy: 0.4665655936718927
Energy: 0.4440136385339934
Energy: 0.35253846332558963
Energy: 0.4440136385339934
Energy: 0.2405600982165945
Energy: 0.5874013494147187
Energy: 0.38142021714607416
Energy: 0.5874013494147187
Energy: 0.5002306458292923
Energy: 0.472792096437982
Energy: 0.5160155860134806
Energy: 0.472792096437982
Energy: 0.38654776653266676
Energy: 0.5988184724396748
Energy: 0.4214145688101498
Energy: 0.5988184724396748
Energy: 0.39556696014492315
Energy: 0.44552463427644684
Energy: 0.32094847361082574
Energy: 0.44552463427644684
Energy: 0.2595911489731084
Energy: 0.4507177745653016
Energy: 0.39921669220778705
Energy: 0.4507177745653016
Energy: 0.4874103497218735
Energy: 0.3872521528095721
Energy: 0.36756271913447136
Energy: 0.3872521528095721
Energy: 0.2915038048933315
Energy: 0.37903097618020104
Energy: 0.45045181481788316
Energy: 0.37903097618020104
Energy: 0.26425276704147843
Energy: 0.40112225347184555
Energy: 0.3684679578457198
Energy: 0.40112225347184555
Energy: 0.3343903361262895
Energy: 0.41491923459362134
Energy: 0.4006331820564318
Energy: 0.41491923459362134
Energy: 0.3867170754266882
Energy: 0.4529933061963201
Energy: 0.3805430585467192
Energy: 0.4529933061963201
Energy: 0.23770982921682707
Energy: 0.549175977983609
Energy: 0.3610846408342431
Energy: 0.549175977983609

minimum gb energy = 0.23770982921682707 eV
minimum distance =  1.72096109369619 Angstroms
sigma value = 25


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

Energy: 0.20595190743819675
Energy: 0.3899068178430506
Energy: 0.40264845116952924
Energy: 0.3899068178430506
Energy: 0.38523682650177227
Energy: 0.4781864827284241
Energy: 0.6597630946022072
Energy: 0.4781864827284241
Energy: 0.4043769294514656
Energy: 0.6022039595371952
Energy: 0.30402901121803877
Energy: 0.6022039595371952
Energy: 0.45521305271932666
Energy: 0.4193223375574559
Energy: 0.5670534718892203
Energy: 0.4193223375574559
Energy: 0.24919691394893376
Energy: 0.43780162097326175
Energy: 0.501207956976499
Energy: 0.43780162097326175
Energy: 0.41843688628470926
Energy: 0.40805250921187625
Energy: 0.40906709350934883
Energy: 0.40805250921187625
Energy: 0.3050014760182902
Energy: 0.42030634232192016
Energy: 0.3711545755560184
Energy: 0.42030634232192016
Energy: 0.2944823358633899
Energy: 0.45784285493076116
Energy: 0.45077176390660817
Energy: 0.45784285493076116
Energy: 0.39287034961316797
Energy: 0.5880153801556038
Energy: 0.6167662424291109
Energy: 0.5880153801556038
Energy: 0.5051321576211593
Energy: 0.4971627515885604
Energy: 0.4716237359446692
Energy: 0.4971627515885604
Energy: 0.3008758046682925
Energy: 0.6025077991948192
Energy: 0.38956207925682124
Energy: 0.6025077991948192
Energy: 0.2707771059849125
Energy: 0.44780032846779033
Energy: 0.39266985805400856
Energy: 0.44780032846779033
Energy: 0.46411813133665497
Energy: 0.4471312788523352
Energy: 0.2383024476362629
Energy: 0.4471312788523352
Energy: 0.44242092729624577
Energy: 0.41412927983928577
Energy: 0.47075374051578317
Energy: 0.41412927983928577
Energy: 0.35563747176625876
Energy: 0.4034757504094696
Energy: 0.3055988776629838
Energy: 0.4034757504094696
Energy: 0.368338583739313
Energy: 0.46748841417018777
Energy: 0.29741647853435427
Energy: 0.46748841417018777
Energy: 0.5587372319142613
Energy: 0.5342463931277812
Energy: 0.3734942617465042
Energy: 0.5342463931277812

minimum gb energy = 0.20595190743819675 eV
minimum distance =  1.78349539943367 Angstroms
sigma value = 17


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

Energy: 0.410662684276768
Energy: 0.47056854360139166
Energy: 0.3785528621879403
Energy: 0.47056854360139166
Energy: 0.4707169878296819
Energy: 0.4343202172814353
Energy: 0.5287728013065757
Energy: 0.4343202172814353
Energy: 0.36729032800800526
Energy: 0.48131014514665127
Energy: 0.41041349842164526
Energy: 0.48131014514665127
Energy: 0.3425867603290711
Energy: 0.38757418700775426
Energy: 0.4472206984527198
Energy: 0.387574187008023
Energy: 0.4382532729240075
Energy: 0.35037049324364117
Energy: 0.3203219568044423
Energy: 0.35037049324364117
Energy: 0.3746558601187805
Energy: 0.3927980587747575
Energy: 0.39281724751063135
Energy: 0.3927980587747575
Energy: 0.2785637844660185
Energy: 0.45653548915648284
Energy: 0.34158705798102595
Energy: 0.45653548915648284
Energy: 0.47826622732422824
Energy: 0.446647593582023
Energy: 0.45874402905501827
Energy: 0.446647593582023
Energy: 0.3725840232502838
Energy: 0.5834485363166432
Energy: 0.2840599888211588
Energy: 0.5834485363166432
Energy: 0.3641058140604606
Energy: 0.4534324926390759
Energy: 0.44635279359863766
Energy: 0.4534324926390759
Energy: 0.28740653603684435
Energy: 0.414630968994866
Energy: 0.3692834470554398
Energy: 0.414630968994866
Energy: 0.4437990003457208
Energy: 0.3712462830349554
Energy: 0.3487985174024356
Energy: 0.3712462830349554
Energy: 0.3752357049950017
Energy: 0.3689750464034664
Energy: 0.32883767993406365
Energy: 0.3689750464034664
Energy: 0.3948436641047374
Energy: 0.42508848972662006
Energy: 0.35782785394334615
Energy: 0.42508848972662006
Energy: 0.3500746401493656
Energy: 0.5015958489711723
Energy: 0.3617626396309102
Energy: 0.5015958489711723
Energy: 0.3696760706682363
Energy: 0.5412494658580627
Energy: 0.3785496379634173
Energy: 0.5412494658580627
Energy: 0.3729787425883996
Energy: 0.46347724135400115
Energy: 0.38477146592454425
Energy: 0.46347724135400115
Energy: 0.37796613952710584
Energy: 0.42340577510576505
Energy: 0.3307517921066672
Energy: 0.42340577510576505
Energy: 0.3759096878904915
Energy: 0.37766379006742967
Energy: 0.4014313595462234
Energy: 0.37766379006742967
Energy: 0.3031196763065422
Energy: 0.3671272042836137
Energy: 0.4066842843411685
Energy: 0.3671272042836137
Energy: 0.3283871371727279
Energy: 0.39453781860992576
Energy: 0.4098141618236107
Energy: 0.39453781860992576
Energy: 0.36215446343829577
Energy: 0.5018264807636396
Energy: 0.27606943354373764
Energy: 0.5018264807636396
Energy: 0.4359076765107307
Energy: 0.4573420584291253
Energy: 0.45528579805040215
Energy: 0.4573420584291253
Energy: 0.2856931223688409
Energy: 0.5808864942921748
Energy: 0.3724750588352027
Energy: 0.5808864942921748
Energy: 0.4720602174680741
Energy: 0.4083907849974521
Energy: 0.47113443911289293
Energy: 0.4083907849974521
Energy: 0.38801267530494704
Energy: 0.37687531430493193
Energy: 0.29715647994906347
Energy: 0.37687531430493193
Energy: 0.3255963361571468
Energy: 0.38129727698074944
Energy: 0.3763399585057641
Energy: 0.38129727698074944
Energy: 0.3614300764489557
Energy: 0.38978677388281585
Energy: 0.4090798582836234
Energy: 0.38978677388281585
Energy: 0.5155392353434226
Energy: 0.4196085023394264
Energy: 0.344703832896366
Energy: 0.4196085023394264
Energy: 0.40802105031836505
Energy: 0.5936139682253542
Energy: 0.3744081525527595
Energy: 0.5936139682253542

minimum gb energy = 0.27606943354373764 eV
minimum distance =  1.61158993654273 Angstroms
sigma value = 53


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

Energy: 0.4159783091843676
Energy: 0.31915139562130573
Energy: 0.4344776084752008
Energy: 0.31915139562130573
Energy: 0.29075433143545515
Energy: 0.507415043596202
Energy: 0.7463233740324396
Energy: 0.507415043596202
Energy: 0.4366864167616111
Energy: 0.6329192529554024
Energy: 0.26841807687331254
Energy: 0.6329192529554024
Energy: 0.41289286367062245
Energy: 0.4062975908439156
Energy: 0.6020898498561359
Energy: 0.4062975908439156
Energy: 0.48081944853473624
Energy: 0.45227405816295974
Energy: 0.31892696545684773
Energy: 0.45227405816295974
Energy: 0.4139528766878301
Energy: 0.520057382898505
Energy: 0.29902828003511145
Energy: 0.520057382898505
Energy: 0.39483679806016886
Energy: 0.5683015431601557
Energy: 0.41492585671650506
Energy: 0.5683015431601557
Energy: 0.3414127190923832
Energy: 0.5168984622521027
Energy: 0.5295814112217256
Energy: 0.5168984622521027
Energy: 0.39772492152799765
Energy: 0.636248734256992
Energy: 0.26455723899438444
Energy: 0.636248734256992
Energy: 0.4068810597650868
Energy: 0.47127159110379635
Energy: 0.8419603815116465
Energy: 0.47127159110379635
Energy: 0.46964443125589317
Energy: 0.42800090842042726
Energy: 0.3408327235066989
Energy: 0.428000908421046
Energy: 0.39083543744703214
Energy: 0.5182613975185728
Energy: 0.27941783236527984
Energy: 0.5182613975185728
Energy: 0.34591908157071866
Energy: 0.5066484041559443
Energy: 0.4256613089641052
Energy: 0.5066484041559443

minimum gb energy = 0.26455723899438444 eV
minimum distance =  1.90755469582608 Angstroms
sigma value = 9


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

Energy: 0.27595213086776177
Energy: 0.4860012462427994
Energy: 0.3434045540885275
Energy: 0.4860012462427994
Energy: 0.4925441816056838
Energy: 0.39051041032929346
Energy: 0.4220533846777144
Energy: 0.39051041032929346
Energy: 0.33371805941775234
Energy: 0.37715989109685333
Energy: 0.34795080773071857
Energy: 0.37715989109685333
Energy: 0.2840100604831773
Energy: 0.3576713859575571
Energy: 0.3617963062506045
Energy: 0.3576713859575571
Energy: 0.3066026336171883
Energy: 0.34477114072938814
Energy: 0.4542778162192992
Energy: 0.34477114072938814
Energy: 0.3888927409627862
Energy: 0.3937507289841143
Energy: 0.43080909375426957
Energy: 0.3937507289841143
Energy: 0.3557765117469678
Energy: 0.5167128909719413
Energy: 0.33676670792307206
Energy: 0.5167128909719413
Energy: 0.31610265997800663
Energy: 0.4330580143390499
Energy: 0.3200044792624602
Energy: 0.4330580143390499
Energy: 0.3413903924714281
Energy: 0.3643398228496751
Energy: 0.26697841515603243
Energy: 0.3643398228496751
Energy: 0.27756731794309847
Energy: 0.33956083718155805
Energy: 0.3735260129555625
Energy: 0.33956083718133034
Energy: 0.28907056762796546
Energy: 0.37268336750709213
Energy: 0.4937576110016502
Energy: 0.37268336750709213
Energy: 0.3297051041237579
Energy: 0.4523463278442445
Energy: 0.3485084739573257
Energy: 0.4523463278442445
Energy: 0.40919354431136035
Energy: 0.4070949047241473
Energy: 0.3773699590055634
Energy: 0.4070949047241473
Energy: 0.4685362790465629
Energy: 0.4180211962750926
Energy: 0.3120922124624771
Energy: 0.4180211962750926
Energy: 0.35226142487976014
Energy: 0.3615327609729026
Energy: 0.31468294748545406
Energy: 0.3615327609729026
Energy: 0.3570316861487415
Energy: 0.3222750669247973
Energy: 0.35031239671477843
Energy: 0.3222750669247973
Energy: 0.35222305332257337
Energy: 0.37073433199328354
Energy: 0.4488988180376482
Energy: 0.37073433199305456
Energy: 0.3317681400174601
Energy: 0.4862700719959302
Energy: 0.26623845650488287
Energy: 0.4862700719959302
Energy: 0.39146738754425037
Energy: 0.37920581481280696
Energy: 0.5433167170158275
Energy: 0.37920581481280696
Energy: 0.34864266103460334
Energy: 0.3825743815672995
Energy: 0.3290356789229288
Energy: 0.3825743815672995
Energy: 0.37794296981594233
Energy: 0.3554946574445092
Energy: 0.2863556048652407
Energy: 0.3554946574445092
Energy: 0.44009369289139244
Energy: 0.34116684676159514
Energy: 0.2992500873633281
Energy: 0.34116684676159514
Energy: 0.44648744460438167
Energy: 0.3971895357693907
Energy: 0.363958161691605
Energy: 0.3971895357693907
Energy: 0.33507111951260604
Energy: 0.5003263845799357
Energy: 0.347415926094607
Energy: 0.5003263845799357
Energy: 0.3184018822210996
Energy: 0.4512633785108122
Energy: 0.32721189735251965
Energy: 0.4512633785108122
Energy: 0.26780763908572675
Energy: 0.3688996916047199
Energy: 0.34260575487827405
Energy: 0.3688996916047199
Energy: 0.3873872329624878
Energy: 0.33236296138712695
Energy: 0.2803521696332326
Energy: 0.33236296138712695
Energy: 0.45686113216535096
Energy: 0.3686835252599979
Energy: 0.28995406689743003
Energy: 0.3686835252599979
Energy: 0.35174453461265975
Energy: 0.4554373513395416
Energy: 0.32968848179103205
Energy: 0.4554373513395416
Energy: 0.40304238504648343
Energy: 0.39707125835310664
Energy: 0.389860838972612
Energy: 0.39707125835310664
Energy: 0.31944692114103995
Energy: 0.42970780738349285
Energy: 0.2656118282892163
Energy: 0.42970780738349285
Energy: 0.30888142059095575
Energy: 0.3629438848918115
Energy: 0.36694241912066944
Energy: 0.3629438848918115
Energy: 0.35337433926875333
Energy: 0.31814746029970997
Energy: 0.35756914871627266
Energy: 0.31814746029970997
Energy: 0.44485386835322765
Energy: 0.3801522212596849
Energy: 0.32206867672475314
Energy: 0.3801522212596849
Energy: 0.2748462159295805
Energy: 0.5296028076832594
Energy: 0.3377057965715443
Energy: 0.5296028076832594

minimum gb energy = 0.2656118282892163 eV
minimum distance =  1.62462335561372 Angstroms
sigma value = 73


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

Energy: 0.27445265349170594
Energy: 0.4268314145530228
Energy: 0.33298978937656043
Energy: 0.4268314145530228
Energy: 0.4306499863978109
Energy: 0.38843661120268846
Energy: 0.4475039350651687
Energy: 0.38843661120268846
Energy: 0.3426666061509553
Energy: 0.3967035686867834
Energy: 0.268016713275961
Energy: 0.3967035686867834
Energy: 0.30079534837640853
Energy: 0.3645054181748423
Energy: 0.3740427430647379
Energy: 0.3645054181748423
Energy: 0.31126928831348966
Energy: 0.3528895330691705
Energy: 0.418458400090956
Energy: 0.3528895330691705
Energy: 0.3860158742464071
Energy: 0.40435181559316746
Energy: 0.40244282485233995
Energy: 0.40435181559316746
Energy: 0.446684845852463
Energy: 0.5063007239076684
Energy: 0.33839848573564857
Energy: 0.5063007239076684
Energy: 0.37298774193097944
Energy: 0.41887914104630614
Energy: 0.31949979974430526
Energy: 0.41887914104630614
Energy: 0.36358445286427843
Energy: 0.3602031139088218
Energy: 0.39376704300785664
Energy: 0.3602031139088218
Energy: 0.2758423247582395
Energy: 0.3513939816589349
Energy: 0.3512031839503788
Energy: 0.3513939816589349
Energy: 0.29955572826015725
Energy: 0.36544669433344246
Energy: 0.5412259837223573
Energy: 0.36544669433344246
Energy: 0.3187419523998709
Energy: 0.4251173928839975
Energy: 0.26040687492454495
Energy: 0.4251173928839975
Energy: 0.263174873401785
Energy: 0.37902686953540043
Energy: 0.3609935974426783
Energy: 0.37902686953540043
Energy: 0.27528884956846067
Energy: 0.3716818208853637
Energy: 0.3267194901078024
Energy: 0.3716818208853637
Energy: 0.36458513567254
Energy: 0.36182108571094695
Energy: 0.29822234081733573
Energy: 0.36182108571094695
Energy: 0.4415843288206652
Energy: 0.3770790905001216
Energy: 0.32735385209706613
Energy: 0.3770790905001216
Energy: 0.3655895133060586
Energy: 0.3962677505170216
Energy: 0.4856030836005102
Energy: 0.3962677505170216
Energy: 0.3476757763957485
Energy: 0.5241548995280743
Energy: 0.470360256707512
Energy: 0.5241548995280743
Energy: 0.3297619131839066
Energy: 0.3870449480607732
Energy: 0.32616374686408195
Energy: 0.3870449480607732
Energy: 0.3963913470168908
Energy: 0.3401754799483955
Energy: 0.38958094289355494
Energy: 0.3401754799483955
Energy: 0.3501792280108747
Energy: 0.3731605087087496
Energy: 0.2733392907664444
Energy: 0.3731605087087496
Energy: 0.27215774305244544
Energy: 0.4424771209896926
Energy: 0.3093364398155669
Energy: 0.4424771209896926

minimum gb energy = 0.26040687492454495 eV
minimum distance =  1.81890936854498 Angstroms
sigma value = 7


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

Energy: 0.44221212413613364
Energy: 0.47624433290236506
Energy: 0.3743043887205719
Energy: 0.4762443329026219
Energy: 0.4820870634657633
Energy: 0.4217147856198962
Energy: 0.455978406396095
Energy: 0.4217147856198962
Energy: 0.38655864373343496
Energy: 0.40155180053084294
Energy: 0.30364149679722874
Energy: 0.40155180053084294
Energy: 0.3499319410754603
Energy: 0.3903969001651808
Energy: 0.392418080268334
Energy: 0.3903969001651808
Energy: 0.32727175354855187
Energy: 0.43834322137888493
Energy: 0.29170868031380526
Energy: 0.43834322137888493
Energy: 0.3900891256696059
Energy: 0.4587228421163959
Energy: 0.28786243180829885
Energy: 0.4587228421163959
Energy: 0.4200682482709115
Energy: 0.48384843102068525
Energy: 0.35861181258095076
Energy: 0.48384843102068525
Energy: 0.3747301309385496
Energy: 0.4085098303540172
Energy: 0.32769662794664867
Energy: 0.4085098303540172
Energy: 0.45037893028491194
Energy: 0.37850899362035506
Energy: 0.33458657049571827
Energy: 0.37850899362035506
Energy: 0.4266533207145259
Energy: 0.43334811664906153
Energy: 0.36056710870691294
Energy: 0.43334811664906153
Energy: 0.40912995962192955
Energy: 0.45978377854960245
Energy: 0.46216504573117884
Energy: 0.45978377854960245
Energy: 0.3662444068048601
Energy: 0.5753257046716861
Energy: 0.30500696006568156
Energy: 0.5753257046716861
Energy: 0.39801794995758955
Energy: 0.40282053449792654
Energy: 0.46208415691641436
Energy: 0.40282053449792654
Energy: 0.44471027257737755
Energy: 0.35359326004987846
Energy: 0.3309105807927847
Energy: 0.35359326004987846
Energy: 0.45904166195479595
Energy: 0.41349138222014403
Energy: 0.30548687450670736
Energy: 0.41349138222014403
Energy: 0.4311006061454079
Energy: 0.5771878523457928
Energy: 0.3629666509744543
Energy: 0.5771878523457928
Energy: 0.3485837728708381
Energy: 0.4551000468206052
Energy: 0.3975520603957857
Energy: 0.4551000468206052
Energy: 0.36968939670859496
Energy: 0.4249827389469075
Energy: 0.2996110653863023
Energy: 0.4249827389469075
Energy: 0.36005992053784314
Energy: 0.38164071026877955
Energy: 0.43710484033208924
Energy: 0.38164071026877955
Energy: 0.3126546291142156
Energy: 0.41084044737984543
Energy: 0.49086022053897305
Energy: 0.41084044737984543
Energy: 0.36015908817499426
Energy: 0.4927586281143636
Energy: 0.2897235505454819
Energy: 0.4927586281143636
Energy: 0.39192337535649735
Energy: 0.4522237734551352
Energy: 0.39192892334330687
Energy: 0.4522237734551352
Energy: 0.4071436235141913
Energy: 0.4347235422113552
Energy: 0.3396721612101317
Energy: 0.4347235422113552
Energy: 0.39789624836232623
Energy: 0.3882048647544548
Energy: 0.3291778464452644
Energy: 0.3882048647544548
Energy: 0.4238487593205627
Energy: 0.40982520096733266
Energy: 0.3656745659019872
Energy: 0.40982520096733266
Energy: 0.3597935239599548
Energy: 0.4277989607929446
Energy: 0.610543559352424
Energy: 0.4277989607929446
Energy: 0.37516020569539005
Energy: 0.5991765336181754
Energy: 0.30842629550796574
Energy: 0.5991765336181754
Energy: 0.36710319412283643
Energy: 0.416769224905501
Energy: 0.6052342351742035
Energy: 0.416769224905501
Energy: 0.44581456190991714
Energy: 0.36400849959873416
Energy: 0.4448123750342169
Energy: 0.36400849959873416
Energy: 0.38340190267645724
Energy: 0.41023032382753905
Energy: 0.3054465188365801
Energy: 0.41023032382753905
Energy: 0.4019576346333349
Energy: 0.5246521085052019
Energy: 0.3453180141104307
Energy: 0.5246521085052019

minimum gb energy = 0.28786243180829885 eV
minimum distance =  1.7632664519182 Angstroms
sigma value = 29


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

Energy: 0.19016140310319296
Energy: 0.3752051824134939
Energy: 0.48781536508395246
Energy: 0.3752051824134939
Energy: 0.33129824893336685
Energy: 0.5335993439383298
Energy: 0.7171989957905855
Energy: 0.5335993439383298
Energy: 0.6051703257784335
Energy: 0.5391063520217538
Energy: 0.26512955824437445
Energy: 0.5391063520217538
Energy: 0.2894330318124662
Energy: 0.5056809862892947
Energy: 0.5082786007453542
Energy: 0.5056809862892947
Energy: 0.4034697208081411
Energy: 0.672469488846414
Energy: 0.24898756214236414
Energy: 0.672469488846414
Energy: 0.4615881482443939
Energy: 0.6691216705729892
Energy: 0.26222225322602793
Energy: 0.6691216705729892
Energy: 0.23772896574868427
Energy: 0.5361320562090728
Energy: 0.46442074789181714
Energy: 0.5361320562090728
Energy: 0.7835423035501867
Energy: 0.5056881105825936
Energy: 0.3337501105162822
Energy: 0.5056881105825936
Energy: 0.3287567681115161
Energy: 0.559543504802967
Energy: 0.46270862416652275
Energy: 0.559543504802967

minimum gb energy = 0.19016140310319296 eV
minimum distance =  2.20063305446711 Angstroms
sigma value = 5


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

Energy: 0.2479484537990111
Energy: 0.4804480332019535
Energy: 0.3695021952398208
Energy: 0.4804480332019535
Energy: 0.493747363335257
Energy: 0.41412004173288003
Energy: 0.3992484915059174
Energy: 0.41412004173288003
Energy: 0.43735702411385474
Energy: 0.36786072333567765
Energy: 0.45955047861593956
Energy: 0.36786072333567765
Energy: 0.32821254095890867
Energy: 0.4142778833500224
Energy: 0.38385181459297535
Energy: 0.4142778833500224
Energy: 0.3567349011196429
Energy: 0.5279211023580392
Energy: 0.31812609584181734
Energy: 0.5279211023580392
Energy: 0.3358818484903202
Energy: 0.5034803567046926
Energy: 0.31617865590567223
Energy: 0.5034803567046926
Energy: 0.3507829980293584
Energy: 0.39543736702784027
Energy: 0.41044081592219234
Energy: 0.39543736702784027
Energy: 0.3568820236092336
Energy: 0.4130118023216425
Energy: 0.45093486773288255
Energy: 0.4130118023213998
Energy: 0.5408356355557632
Energy: 0.40270981645329584
Energy: 0.3760116792089523
Energy: 0.40270981645329584
Energy: 0.2424068975916153
Energy: 0.4924187566871758
Energy: 0.3537105837504176
Energy: 0.4924187566871758
Energy: 0.4799595051219891
Energy: 0.3977150236459506
Energy: 0.3230836486884451
Energy: 0.3977150236459506
Energy: 0.30944278616417614
Energy: 0.4156761430558733
Energy: 0.31320471640090175
Energy: 0.4156761430558733
Energy: 0.3145989951832944
Energy: 0.48274267086619116
Energy: 0.354930265388103
Energy: 0.48274267086619116
Energy: 0.3789916181027611
Energy: 0.4208493565157139
Energy: 0.3189318439146994
Energy: 0.4208493565157139
Energy: 0.3757913976645078
Energy: 0.37474889089826313
Energy: 0.32255743067942694
Energy: 0.37474889089826313
Energy: 0.3518606484056635
Energy: 0.4124884238191587
Energy: 0.5253271344167095
Energy: 0.4124884238191587
Energy: 0.3665199688371206
Energy: 0.5906706240007287
Energy: 0.4702062241346109
Energy: 0.5906706240007287
Energy: 0.3804849658532759
Energy: 0.4296226652845212
Energy: 0.5637584637356182
Energy: 0.4296226652845212
Energy: 0.46508296322897896
Energy: 0.37977223586730924
Energy: 0.41486565110528123
Energy: 0.37977223586730924
Energy: 0.37394544576589606
Energy: 0.40987389329670787
Energy: 0.328553020731204
Energy: 0.40987389329670787
Energy: 0.30908383369464537
Energy: 0.4958379591834448
Energy: 0.3613503406045325
Energy: 0.4958379591834448
Energy: 0.3234670198895786
Energy: 0.5338633205927443
Energy: 0.3459001756858129
Energy: 0.5338633205927443
Energy: 0.41508548587489363
Energy: 0.40005624733278433
Energy: 0.3481472282337378
Energy: 0.40005624733278433
Energy: 0.4433874436194629
Energy: 0.39661145338142045
Energy: 0.35862148346045564
Energy: 0.39661145338142045
Energy: 0.3949339684226272
Energy: 0.40564188620462543
Energy: 0.4779529794209921
Energy: 0.40564188620462543
Energy: 0.3525651285953211
Energy: 0.49780354902510593
Energy: 0.2432305774027817
Energy: 0.49780354902510593
Energy: 0.3249845939461128
Energy: 0.3988948425575837
Energy: 0.5421395549510161
Energy: 0.3988948425575837
Energy: 0.3092626333683842
Energy: 0.4064362543947375
Energy: 0.4813459070094503
Energy: 0.4064362543947375
Energy: 0.3524372188582831
Energy: 0.49791407230271373
Energy: 0.31783105870267664
Energy: 0.49791407230271373
Energy: 0.31458606504552444
Energy: 0.41179673336285555
Energy: 0.41463783280229544
Energy: 0.41179673336285555
Energy: 0.3226526429629812
Energy: 0.376590077053681
Energy: 0.3776575175583847
Energy: 0.376590077053681
Energy: 0.45949934626434946
Energy: 0.4092378130158782
Energy: 0.3586689866972111
Energy: 0.4092378130158782
Energy: 0.458936260028114
Energy: 0.571319118875809
Energy: 0.35868882484691395
Energy: 0.571319118875809

minimum gb energy = 0.2424068975916153 eV
minimum distance =  1.64889470279638 Angstroms
sigma value = 1


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

Energy: 0.31309796710908316
Energy: 0.43657964090963086
Energy: 0.32991975478148927
Energy: 0.43657964090963086
Energy: 0.4522477075808129
Energy: 0.37684458871741855
Energy: 0.3692818382462765
Energy: 0.37684458871741855
Energy: 0.39006658757090906
Energy: 0.33880515411477
Energy: 0.41590320909840073
Energy: 0.33880515411477
Energy: 0.30449255136831915
Energy: 0.3845832800856226
Energy: 0.3611394364468913
Energy: 0.3845832800856226
Energy: 0.32941410455043774
Energy: 0.4748456798712985
Energy: 0.46000974275465445
Energy: 0.4748456798712985
Energy: 0.3134574763524521
Energy: 0.44718366805338167
Energy: 0.4424668957898123
Energy: 0.44718366805338167
Energy: 0.3069614539341086
Energy: 0.3701132970185704
Energy: 0.38960292586583506
Energy: 0.370113297018906
Energy: 0.32271969774794734
Energy: 0.3893269313503128
Energy: 0.48772345174365356
Energy: 0.3893269313503128
Energy: 0.4407028629473974
Energy: 0.3706900282396181
Energy: 0.3794094958935014
Energy: 0.3706900282396181
Energy: 0.3006246369831366
Energy: 0.41416383415207736
Energy: 0.3301992287840385
Energy: 0.41416383415207736
Energy: 0.40101912131974304
Energy: 0.36647676436560506
Energy: 0.31055707863946225
Energy: 0.36647676436560506
Energy: 0.29102172525298864
Energy: 0.3737345895695335
Energy: 0.2870856295795377
Energy: 0.3737345895695335
Energy: 0.29352140502939056
Energy: 0.4182789556426552
Energy: 0.3148999268828057
Energy: 0.4182789556426552
Energy: 0.34688009249435464
Energy: 0.3652402116143476
Energy: 0.4080933903810994
Energy: 0.3652402116143476
Energy: 0.30394586467886275
Energy: 0.3349391927924707
Energy: 0.3998582031368399
Energy: 0.3349391927924707
Energy: 0.30121787860508425
Energy: 0.38682944791343393
Energy: 0.4682538597746698
Energy: 0.38682944791343393
Energy: 0.3397544926343074
Energy: 0.5205167036443107
Energy: 0.5139106152205078
Energy: 0.5205167036443107
Energy: 0.30657539153560476
Energy: 0.3971852463895719
Energy: 0.3596111517880602
Energy: 0.3971852463895719
Energy: 0.30642196633828406
Energy: 0.35692665621396136
Energy: 0.3804891578192727
Energy: 0.35692665621396136
Energy: 0.32539823394733397
Energy: 0.41362544028846204
Energy: 0.4942852029916198
Energy: 0.41362544028846204
Energy: 0.2891390604812809
Energy: 0.38553111466538953
Energy: 0.3718622997623664
Energy: 0.385531114665054
Energy: 0.29822573053146784
Energy: 0.3759503966019256
Energy: 0.32583666866149674
Energy: 0.3759503966019256
Energy: 0.39451254898011756
Energy: 0.3827744355901745
Energy: 0.3045231479824184
Energy: 0.3827744355901745
Energy: 0.30546769304042504
Energy: 0.4816951246136805
Energy: 0.320564723386919
Energy: 0.4816951246136805

minimum gb energy = 0.2870856295795377 eV
minimum distance =  1.68181890081183 Angstroms
sigma value = 17


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

Energy: 0.3100362043158145
Energy: 0.4928482369539746
Energy: 0.36500249362692927
Energy: 0.492848236954182
Energy: 0.5113731488581941
Energy: 0.41217186052757143
Energy: 0.369593292912634
Energy: 0.41217186052757143
Energy: 0.36972981574699526
Energy: 0.3621653320939241
Energy: 0.40139001399318275
Energy: 0.3621653320939241
Energy: 0.39540856755051346
Energy: 0.4114782981089075
Energy: 0.360404363527297
Energy: 0.4114782981089075
Energy: 0.35616642508184565
Energy: 0.462546374545795
Energy: 0.2948834266806442
Energy: 0.462546374545795
Energy: 0.32515635527400427
Energy: 0.43307949478722135
Energy: 0.48154326492799604
Energy: 0.43307949478722135
Energy: 0.3055015717929467
Energy: 0.39768187219166573
Energy: 0.44109047334052154
Energy: 0.39768187219166573
Energy: 0.34399092912972096
Energy: 0.4912735458977397
Energy: 0.39230166528861005
Energy: 0.4912735458977397
Energy: 0.3968393827865003
Energy: 0.4065431260533919
Energy: 0.5113868300395177
Energy: 0.4065431260533919
Energy: 0.30157025632405354
Energy: 0.3889877199515595
Energy: 0.367650745884636
Energy: 0.3889877199515595
Energy: 0.38684370493403686
Energy: 0.39540900543539
Energy: 0.3080845884416209
Energy: 0.39540900543539
Energy: 0.350503209474298
Energy: 0.4739083819336505
Energy: 0.35073445133847486
Energy: 0.4739083819336505
Energy: 0.3943243524341087
Energy: 0.5484959744513336
Energy: 0.3466928567552084
Energy: 0.5484959744513336
Energy: 0.43052717415419095
Energy: 0.4009369166695742
Energy: 0.32842077597401215
Energy: 0.4009369166695742
Energy: 0.2964542119066883
Energy: 0.3958793851292817
Energy: 0.3393175171329348
Energy: 0.3958793851292817
Energy: 0.4638989279348525
Energy: 0.40619088126853203
Energy: 0.40408609215753666
Energy: 0.40619088126853203
Energy: 0.34259036718520824
Energy: 0.4405636593920695
Energy: 0.3983303853755624
Energy: 0.4405636593920695
Energy: 0.3449786499481154
Energy: 0.38561722628462086
Energy: 0.5002710760283573
Energy: 0.38561722628462086
Energy: 0.3252152681928337
Energy: 0.43380852102938805
Energy: 0.38628964211665257
Energy: 0.43380852102938805
Energy: 0.36277994039221245
Energy: 0.5880589700118019
Energy: 0.30877448430537086
Energy: 0.5880589700118019
Energy: 0.3829720835322184
Energy: 0.40327476100698667
Energy: 0.5174893647746767
Energy: 0.40327476100698667
Energy: 0.39595677902437754
Energy: 0.35513988788104944
Energy: 0.3809102315949641
Energy: 0.35513988788104944
Energy: 0.3851676591263576
Energy: 0.40804444399589823
Energy: 0.3879005662509044
Energy: 0.40804444399589823
Energy: 0.2991486043330594
Energy: 0.48501488567995577
Energy: 0.34909102776056183
Energy: 0.48501488567995577
Energy: 0.4500346040106851
Energy: 0.4166554593773901
Energy: 0.3186912841905912
Energy: 0.4166554593773901
Energy: 0.49256048514467543
Energy: 0.39755747250854306
Energy: 0.3041200496025036
Energy: 0.39755747250854306
Energy: 0.3975548100392955
Energy: 0.5065282045667434
Energy: 0.3493386155569732
Energy: 0.5065282045667434
Energy: 0.4576971262627612
Energy: 0.3949665346411159
Energy: 0.4260622822312017
Energy: 0.3949665346411159
Energy: 0.38226206348087616
Energy: 0.37507898965273734
Energy: 0.301996811516205
Energy: 0.37507898965273734
Energy: 0.3088048374748341
Energy: 0.4021642637270356
Energy: 0.38152564465511823
Energy: 0.4021642637270356
Energy: 0.3471276570946657
Energy: 0.5074682261455002
Energy: 0.36937804329469176
Energy: 0.5074682261455002
Energy: 0.3346414848543397
Energy: 0.5169722854017028
Energy: 0.3793691341726859
Energy: 0.5169722854017028
Energy: 0.32925359529719406
Energy: 0.3974144165334329
Energy: 0.4112927082331328
Energy: 0.3974144165334329
Energy: 0.342660297238185
Energy: 0.41304146369619066
Energy: 0.29463158093496455
Energy: 0.41304146369619066
Energy: 0.44517789780852696
Energy: 0.39335528378114126
Energy: 0.4317609254592757
Energy: 0.39335528378114126
Energy: 0.39925824139327587
Energy: 0.4358553119442089
Energy: 0.3449249855240133
Energy: 0.4358553119442089
Energy: 0.4522061512007648
Energy: 0.3911707884735993
Energy: 0.344905998263536
Energy: 0.3911707884735993
Energy: 0.42272871697113257
Energy: 0.4553483716162083
Energy: 0.3241492008687895
Energy: 0.4553483716162083

minimum gb energy = 0.29463158093496455 eV
minimum distance =  1.98660273624084 Angstroms
sigma value = 89


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

Energy: 0.5663844534237635
Energy: 0.3469395019497685
Energy: 0.4039273507225807
Energy: 0.3469395019497685
Energy: 0.3516751563248685
Energy: 0.4171986736406407
Energy: 0.48071300903492054
Energy: 0.4171986736406407
Energy: 0.29837345938763415
Energy: 0.43002348541882013
Energy: 0.5684125289457254
Energy: 0.43002348541882013
Energy: 0.25639696945097806
Energy: 0.5132148576602117
Energy: 0.41723920967285705
Energy: 0.5132148576602117
Energy: 0.4305275755753653
Energy: 0.5771088362973946
Energy: 0.26079811140381565
Energy: 0.5771088362973946
Energy: 0.44418230745333287
Energy: 0.5301792530192706
Energy: 0.2526576702925381
Energy: 0.5301792530192706
Energy: 0.4139365747722685
Energy: 0.432168570300071
Energy: 0.5061214658806064
Energy: 0.432168570300071
Energy: 0.3918184615085743
Energy: 0.5823936556254617
Energy: 0.5519634480071549
Energy: 0.5823936556254617
Energy: 0.41967124240538134
Energy: 0.4442169845924269
Energy: 0.41088326170504275
Energy: 0.4442169845924269
Energy: 0.5921793430558608
Energy: 0.4335042472359086
Energy: 0.5045366997717234
Energy: 0.4335042472359086
Energy: 0.40130578085146773
Energy: 0.5049860361485903
Energy: 0.2480421855926946
Energy: 0.5049860361485903
Energy: 0.27062619658739934
Energy: 0.5355218828262038
Energy: 0.48691273768439475
Energy: 0.5355218828262038
Energy: 0.2510904276679706
Energy: 0.5739236196306824
Energy: 0.4308552489443197
Energy: 0.5739236196306824
Energy: 0.48261665031297896
Energy: 0.44487725606967427
Energy: 0.4362710426124276
Energy: 0.44487725606967427
Energy: 0.5141345482043467
Energy: 0.5281364239873158
Energy: 0.36441254358263314
Energy: 0.5281364239873158

minimum gb energy = 0.2480421855926946 eV
minimum distance =  1.73679014215868 Angstroms
sigma value = 13


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

Energy: 0.2742598975277043
Energy: 0.481162092445
Energy: 0.3638147315034019
Energy: 0.4811620924447726
Energy: 0.5059278779604696
Energy: 0.411871287673536
Energy: 0.3531141288170799
Energy: 0.41187128767330855
Energy: 0.40442474010925694
Energy: 0.37335736288575067
Energy: 0.3634305015717999
Energy: 0.37335736288575067
Energy: 0.26460002464922033
Energy: 0.436270914676846
Energy: 0.34769417736779046
Energy: 0.436270914676846
Energy: 0.3754952205587451
Energy: 0.41097880991987923
Energy: 0.3439919011413213
Energy: 0.41097880991987923
Energy: 0.37438887219500233
Energy: 0.3742205928192142
Energy: 0.34080137101706215
Energy: 0.3742205928192142
Energy: 0.3820200052081595
Energy: 0.40937927279649694
Energy: 0.47802338138329353
Energy: 0.4093792727962695
Energy: 0.3578837227679629
Energy: 0.574868767101413
Energy: 0.36151316455379895
Energy: 0.5748687671016405
Energy: 0.316351911716885
Energy: 0.446298821515694
Energy: 0.4957516327405642
Energy: 0.446298821515694
Energy: 0.3085947392868734
Energy: 0.401521038515922
Energy: 0.532211292850579
Energy: 0.401521038515922
Energy: 0.34825989518107897
Energy: 0.5014546828260197
Energy: 0.3538578807263625
Energy: 0.5014546828260197
Energy: 0.4294866415476557
Energy: 0.3892251953053739
Energy: 0.5100859259682252
Energy: 0.3892251953053739
Energy: 0.4742984825253017
Energy: 0.3646416916169279
Energy: 0.4288920143521465
Energy: 0.3646416916169279
Energy: 0.3655371670086573
Energy: 0.407992045740701
Energy: 0.35740814792245607
Energy: 0.407992045740701
Energy: 0.4598777794688712
Energy: 0.46099473303332394
Energy: 0.35442256424363916
Energy: 0.460994733032869
Energy: 0.4314482407451555
Energy: 0.422583344412337
Energy: 0.330585709313355
Energy: 0.4225833444125645
Energy: 0.48896976894302424
Energy: 0.40945618104202774
Energy: 0.321558848974138
Energy: 0.4094561810418003
Energy: 0.2717685508369444
Energy: 0.5730694823555796
Energy: 0.35685836546642097
Energy: 0.5730694823558072
Energy: 0.3817461523827199
Energy: 0.4404538123411317
Energy: 0.34007644022289973
Energy: 0.4404538123411317
Energy: 0.4547091925448202
Energy: 0.38246883630884054
Energy: 0.37092579448032165
Energy: 0.38246883630884054
Energy: 0.2622740622273095
Energy: 0.4371254497500399
Energy: 0.3434069194763986
Energy: 0.4371254497500399
Energy: 0.4308669287360765
Energy: 0.3912349219571386
Energy: 0.3293030782147597
Energy: 0.3912349219571386
Energy: 0.36629229974242344
Energy: 0.38945377094568073
Energy: 0.347117419222752
Energy: 0.38945377094568073
Energy: 0.2811080271884442
Energy: 0.4070244414063792
Energy: 0.4052286474272545
Energy: 0.4070244414063792
Energy: 0.3471913079009723
Energy: 0.5337866855843129
Energy: 0.3459524740721901
Energy: 0.5337866855843129
Energy: 0.3250776425455797
Energy: 0.48631547626571753
Energy: 0.32671779916321575
Energy: 0.48631547626571753
Energy: 0.31073662195197593
Energy: 0.40280850332181395
Energy: 0.44935175808113914
Energy: 0.4028085033215632
Energy: 0.343180387400979
Energy: 0.48313194186229025
Energy: 0.3492259718538793
Energy: 0.48313194186229025
Energy: 0.39038138786747034
Energy: 0.4002992754051204
Energy: 0.48795379473805045
Energy: 0.4002992754051204
Energy: 0.2701318104531916
Energy: 0.38328769534629104
Energy: 0.3882605562480223
Energy: 0.3832876953465185
Energy: 0.3601186999937405
Energy: 0.4033613416968079
Energy: 0.3596900378837676
Energy: 0.4033613416968079
Energy: 0.41783349375834017
Energy: 0.4248369218829905
Energy: 0.3755492613356331
Energy: 0.4248369218829905
Energy: 0.4662633889395727
Energy: 0.4524257333786227
Energy: 0.3397428726188412
Energy: 0.4524257333786227
Energy: 0.42902494947450937
Energy: 0.407174163528793
Energy: 0.32314543814360847
Energy: 0.407174163528793
Energy: 0.46389679614880647
Energy: 0.5298420056185613
Energy: 0.33906820037806207
Energy: 0.5298420056185613

minimum gb energy = 0.2622740622273095 eV
minimum distance =  1.72886402753157 Angstroms
sigma value = 37


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

Energy: 0.2506314827355767
Energy: 0.40537042149624186
Energy: 0.32306063268978275
Energy: 0.40537042149624186
Energy: 0.43021620452361786
Energy: 0.3700250843010712
Energy: 0.3470759404241338
Energy: 0.3700250843010712
Energy: 0.35129385057547846
Energy: 0.34304817229487455
Energy: 0.3512826281191076
Energy: 0.3430481722944832
Energy: 0.4090166422153969
Energy: 0.39947356915395316
Energy: 0.32821766290355264
Energy: 0.39947356915395316
Energy: 0.35011660368661096
Energy: 0.3844059978082085
Energy: 0.24404812850655766
Energy: 0.3844059978082085
Energy: 0.26865601953280976
Energy: 0.35516600807529347
Energy: 0.4287752116904412
Energy: 0.35516600807529347
Energy: 0.2567739053797943
Energy: 0.38727646609596444
Energy: 0.4336116345855475
Energy: 0.38727646609596444
Energy: 0.3344299094261186
Energy: 0.5064607462726862
Energy: 0.42031946271392356
Energy: 0.5064607462726862
Energy: 0.3070265417516217
Energy: 0.4011883258538757
Energy: 0.3335997857398643
Energy: 0.4011883258538757
Energy: 0.2837471912570311
Energy: 0.3576268753245014
Energy: 0.4417068245577319
Energy: 0.3576268753245014
Energy: 0.3061515822963711
Energy: 0.41153661328185426
Energy: 0.23691272962712495
Energy: 0.41153661328185426
Energy: 0.3359390661509857
Energy: 0.3430531984539198
Energy: 0.42933182969041433
Energy: 0.3430531984539198
Energy: 0.3566156999921801
Energy: 0.3373351544078063
Energy: 0.3402202422394739
Energy: 0.3373351544078063
Energy: 0.32792850140373725
Energy: 0.40080360529675274
Energy: 0.40842850484232895
Energy: 0.40080360529675274
Energy: 0.24404812850655766
Energy: 0.38468208551957705
Energy: 0.35031029239163364
Energy: 0.38468208551957705
Energy: 0.4287752116904412
Energy: 0.35516600807529347
Energy: 0.26865601953280976
Energy: 0.35516600807529347
Energy: 0.43341794588013255
Energy: 0.3870003783849872
Energy: 0.2567264525825568
Energy: 0.3870003783849872
Energy: 0.42031946271392356
Energy: 0.505130710130278
Energy: 0.334719070925934
Energy: 0.5051307101298866
Energy: 0.3335997857398643
Energy: 0.4069013437405526
Energy: 0.3016934698789416
Energy: 0.4069013437405526
Energy: 0.43640370199150136
Energy: 0.384598761171654
Energy: 0.29488406553057056
Energy: 0.384598761171654

minimum gb energy = 0.23691272962712495 eV
minimum distance =  2.26277984480217 Angstroms
sigma value = 25


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

Energy: 0.35641400412776797
Energy: 0.43998095290048433
Energy: 0.3245578234187808
Energy: 0.43998095290048433
Energy: 0.4702636222939355
Energy: 0.37705375542892716
Energy: 0.3174944806066808
Energy: 0.37705375542862163
Energy: 0.41583785717726957
Energy: 0.3519588926606573
Energy: 0.3138137743416718
Energy: 0.3519588926606573
Energy: 0.24306861298420343
Energy: 0.41248166281854
Energy: 0.31806013970567903
Energy: 0.41248166281854
Energy: 0.3634120788118446
Energy: 0.3618595312104904
Energy: 0.44452510201970613
Energy: 0.3618595312104904
Energy: 0.3216794087989924
Energy: 0.33124807178423166
Energy: 0.40874679453538654
Energy: 0.33124807178423166
Energy: 0.33657605877403957
Energy: 0.3681536586339053
Energy: 0.3718309974074215
Energy: 0.3681536586342109
Energy: 0.3205066640088677
Energy: 0.41813821187636097
Energy: 0.3427918070863269
Energy: 0.41813821187636097
Energy: 0.3213352458282443
Energy: 0.3603656857306397
Energy: 0.5089864656464836
Energy: 0.3603656857306397
Energy: 0.3196954283830362
Energy: 0.38727525445645444
Energy: 0.5479311623234768
Energy: 0.38727525445645444
Energy: 0.3362129193596843
Energy: 0.5185317549989088
Energy: 0.25815623139399313
Energy: 0.5185317549989088
Energy: 0.2898611236979283
Energy: 0.38673635173625515
Energy: 0.5452396480283088
Energy: 0.38673635173625515
Energy: 0.276770409345651
Energy: 0.36855213174886603
Energy: 0.5733679233274858
Energy: 0.36855213174886603
Energy: 0.31116834531077137
Energy: 0.4365030892697518
Energy: 0.3408492690942589
Energy: 0.4365030892697518
Energy: 0.31811564866049535
Energy: 0.3590025972165642
Energy: 0.3968517956909122
Energy: 0.3590025972165642
Energy: 0.31352746848741314
Energy: 0.3534082827032821
Energy: 0.45458046954487535
Energy: 0.3534082827032821
Energy: 0.3228674170556153
Energy: 0.3946942044052733
Energy: 0.5079807161205824
Energy: 0.3946942044052733
Energy: 0.2415773573649526
Energy: 0.3705743722933024
Energy: 0.33646481994287836
Energy: 0.3705743722933024
Energy: 0.3802374849471825
Energy: 0.3407662444581457
Energy: 0.3316795335409768
Energy: 0.3407662444581457
Energy: 0.4277160323441723
Energy: 0.35911904781692067
Energy: 0.32367026274197996
Energy: 0.35911904781692067
Energy: 0.34605426460628586
Energy: 0.4211987435252661
Energy: 0.31740062148931736
Energy: 0.4211987435252661
Energy: 0.438966736848031
Energy: 0.3669407074009632
Energy: 0.25322125887195795
Energy: 0.3669407074009632
Energy: 0.4084758151071928
Energy: 0.405180811256529
Energy: 0.3135346620245848
Energy: 0.405180811256529
Energy: 0.2555352785278747
Energy: 0.5034121645043989
Energy: 0.32826907099312813
Energy: 0.5034121645047044
Energy: 0.45341019395279136
Energy: 0.38766454764628605
Energy: 0.283142681116417
Energy: 0.38766454764628605
Energy: 0.30992362043477867
Energy: 0.4264349739308458
Energy: 0.2962251611848069
Energy: 0.4264349739308458

minimum gb energy = 0.2415773573649526 eV
minimum distance =  1.87630198207803 Angstroms
sigma value = 41


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

Energy: 0.4536275267511912
Energy: 0.46494473131194763
Energy: 0.361158193739895
Energy: 0.46494473131194763
Energy: 0.49913208100822337
Energy: 0.41382870808401556
Energy: 0.3320349797157655
Energy: 0.41382870808401556
Energy: 0.46506485122579283
Energy: 0.3969250160994033
Energy: 0.3290402183655807
Energy: 0.3969250160994033
Energy: 0.3050900443534843
Energy: 0.487235623133005
Energy: 0.34428822390800823
Energy: 0.487235623133005
Energy: 0.42516768079984696
Energy: 0.38734967847968405
Energy: 0.4361901000700821
Energy: 0.38734967847968405
Energy: 0.3894074947853482
Energy: 0.3676274365317501
Energy: 0.39984606903288095
Energy: 0.3676274365317501
Energy: 0.42336769285134757
Energy: 0.4111942473819515
Energy: 0.3734907543359973
Energy: 0.4111942473819515
Energy: 0.3475460818206959
Energy: 0.4192074702563941
Energy: 0.31098677391507273
Energy: 0.4192074702563941
Energy: 0.313250536275801
Energy: 0.3735566065142435
Energy: 0.46986671918226197
Energy: 0.3735566065142435
Energy: 0.31042712548050894
Energy: 0.39302607634190667
Energy: 0.5069821560281832
Energy: 0.39302607634190667
Energy: 0.3434395648003891
Energy: 0.4856213870387616
Energy: 0.4492403642758849
Energy: 0.4856213870387616
Energy: 0.35685822089474634
Energy: 0.4010336406643771
Energy: 0.5084830476582113
Energy: 0.40103364066462766
Energy: 0.34193939454514183
Energy: 0.44234638827691286
Energy: 0.4609577669858664
Energy: 0.4423463882766624
Energy: 0.3550661751791242
Energy: 0.5681817136007378
Energy: 0.3165762693637913
Energy: 0.5681817136007378
Energy: 0.31343141072084324
Energy: 0.41488702416870205
Energy: 0.5034174970339594
Energy: 0.41488702416870205
Energy: 0.31675713743761996
Energy: 0.47476874882500086
Energy: 0.37815921049844337
Energy: 0.47476874882500086
Energy: 0.3457898349025479
Energy: 0.5337999333142325
Energy: 0.4198647493315224
Energy: 0.5337999333142325
Energy: 0.3406289645667316
Energy: 0.4014213625357458
Energy: 0.4251675995110946
Energy: 0.4014213625357458
Energy: 0.33198791977638026
Energy: 0.4387562134761931
Energy: 0.29567888337089665
Energy: 0.4387562134761931
Energy: 0.3548915416970013
Energy: 0.4261058266609559
Energy: 0.287463810358335
Energy: 0.4261058266609559
Energy: 0.45586531236728406
Energy: 0.3919315578167354
Energy: 0.37446877729832917
Energy: 0.3919315578167354
Energy: 0.3584876843378541
Energy: 0.40932999991203173
Energy: 0.4326390005791937
Energy: 0.40932999991203173
Energy: 0.47044499527496453
Energy: 0.3781593901087967
Energy: 0.3738387453602734
Energy: 0.3781593901087967
Energy: 0.31001670305748874
Energy: 0.40644056114367394
Energy: 0.3610531383417729
Energy: 0.40644056114367394
Energy: 0.3749387254804698
Energy: 0.40123071469827987
Energy: 0.3175236792412302
Energy: 0.40123071469827987
Energy: 0.38841905573181246
Energy: 0.41658258798199604
Energy: 0.37352063491948917
Energy: 0.41658258798199604
Energy: 0.4202943394889655
Energy: 0.4415963323832421
Energy: 0.3474108451690837
Energy: 0.4415963323832421
Energy: 0.41770012314667027
Energy: 0.408934302308766
Energy: 0.36205520658168194
Energy: 0.408934302308766
Energy: 0.30186259112477865
Energy: 0.5275059040868714
Energy: 0.34249150393241057
Energy: 0.5275059040868714
Energy: 0.287856796236914
Energy: 0.4875941971850523
Energy: 0.3248283719990249
Energy: 0.4875941971850523
Energy: 0.4827270707399704
Energy: 0.41473363234035115
Energy: 0.31030530856316474
Energy: 0.41473363234035115
Energy: 0.4391441778077491
Energy: 0.5606336590414207
Energy: 0.35293222583433076
Energy: 0.5606336590414207

minimum gb energy = 0.287463810358335 eV
minimum distance =  1.64583628787842 Angstroms
sigma value = 15


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

Energy: 0.30879697126112166
Energy: 0.47541253028255703
Energy: 0.33060297523679183
Energy: 0.47541253028255703
Energy: 0.5135355839527466
Energy: 0.38684012673022117
Energy: 0.2929059048936683
Energy: 0.38684012673022117
Energy: 0.5050283567694439
Energy: 0.36934925119615375
Energy: 0.2885470484304129
Energy: 0.36934925119615375
Energy: 0.388038731693124
Energy: 0.4439991436961371
Energy: 0.3150441405990776
Energy: 0.4439991436961371
Energy: 0.39752702409941665
Energy: 0.359356456470498
Energy: 0.3483033620737265
Energy: 0.359356456470498
Energy: 0.4404289925753287
Energy: 0.33912259106958803
Energy: 0.32766751604560684
Energy: 0.33912259106958803
Energy: 0.2845516831104524
Energy: 0.3768759726609649
Energy: 0.3246015370906796
Energy: 0.3768759726609649
Energy: 0.32777435608124705
Energy: 0.3661829174506613
Energy: 0.2904754525292622
Energy: 0.3661829174506613
Energy: 0.3621617363704309
Energy: 0.33275723598885276
Energy: 0.37114295114541945
Energy: 0.33275723598885276
Energy: 0.35475542265363663
Energy: 0.34552193371379747
Energy: 0.3998681842120793
Energy: 0.34552193371379747
Energy: 0.3135176989760758
Energy: 0.3959043356758369
Energy: 0.387847507211863
Energy: 0.3959043356758369
Energy: 0.2946828029784599
Energy: 0.35080025452718094
Energy: 0.39882450439800443
Energy: 0.35080025452718094
Energy: 0.3222992010092453
Energy: 0.3673817758599083
Energy: 0.4001046539565347
Energy: 0.3673817758599083
Energy: 0.31478064704566516
Energy: 0.437468423132167
Energy: 0.2946793216547796
Energy: 0.437468423132167
Energy: 0.29013485940419437
Energy: 0.37586377651768194
Energy: 0.41283280798592076
Energy: 0.37586377651768194
Energy: 0.3012855287163374
Energy: 0.4387714472465798
Energy: 0.34248639038989287
Energy: 0.4387714472465798
Energy: 0.31231399046756547
Energy: 0.4866268434564937
Energy: 0.3771451314681591
Energy: 0.486626843456706
Energy: 0.269614820425218
Energy: 0.38279688017652747
Energy: 0.4063805367857436
Energy: 0.38279688017652747
Energy: 0.29673400625458135
Energy: 0.4325712743379217
Energy: 0.28524286576798524
Energy: 0.43257127433770953
Energy: 0.293562161352028
Energy: 0.4140915717947783
Energy: 0.4567364282393
Energy: 0.4140915717947783
Energy: 0.29066286692923576
Energy: 0.3697437732354963
Energy: 0.39048366505343257
Energy: 0.36974377323570845
Energy: 0.31100468673101195
Energy: 0.4301435064354615
Energy: 0.3810640247718748
Energy: 0.4301435064354615
Energy: 0.31961942069280935
Energy: 0.368283575278144
Energy: 0.3242529125089482
Energy: 0.368283575278144
Energy: 0.3511233322305239
Energy: 0.3515258613342968
Energy: 0.38363618148674894
Energy: 0.3515258613342968
Energy: 0.31327721276190007
Energy: 0.39195404854081123
Energy: 0.2907336554276156
Energy: 0.39195404854081123
Energy: 0.4050806260154376
Energy: 0.34233537225968125
Energy: 0.4150051070134177
Energy: 0.34233537225968125
Energy: 0.28473056542238107
Energy: 0.3371887812399895
Energy: 0.36293201636855815
Energy: 0.3371887812399895
Energy: 0.3245327658270237
Energy: 0.3687900325440515
Energy: 0.38811577725416657
Energy: 0.3687900325440515
Energy: 0.36336978215982135
Energy: 0.37093019172864383
Energy: 0.3307886189886566
Energy: 0.37093019172864383
Energy: 0.3480580507726738
Energy: 0.34451714386045224
Energy: 0.3270952816881345
Energy: 0.34451714386045224
Energy: 0.3813174299103232
Energy: 0.36412793057432985
Energy: 0.29606404936575637
Energy: 0.36412793057432985
Energy: 0.29370569496983245
Energy: 0.44000885579505933
Energy: 0.31658299695122083
Energy: 0.4400088557952715
Energy: 0.4145015082906632
Energy: 0.37432817249868294
Energy: 0.2902688487004594
Energy: 0.37432817249868294
Energy: 0.5273595835748582
Energy: 0.3852519766167197
Energy: 0.29392101732824794
Energy: 0.3852519766167197
Energy: 0.4059882069690186
Energy: 0.5286117567080436
Energy: 0.3310177736283838
Energy: 0.5286117567080436
Energy: 0.44728635839737896
Energy: 0.3994353120762071
Energy: 0.27803850072211644
Energy: 0.3994353120762071
Energy: 0.37682896864643567
Energy: 0.40379792697689065
Energy: 0.2782683144413958
Energy: 0.40379792697689065

minimum gb energy = 0.269614820425218 eV
minimum distance =  2.12941668172396 Angstroms
sigma value = 85


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

Energy: 0.363714523425688
Energy: 0.48905486150139466
Energy: 0.35459910903397834
Energy: 0.48905486150139466
Energy: 0.5294520572844208
Energy: 0.4114029746789386
Energy: 0.3089024999488007
Energy: 0.4114029746789386
Energy: 0.3575988252237889
Energy: 0.4019968237522396
Energy: 0.3033608094587403
Energy: 0.4019968237522396
Energy: 0.2767521062851757
Energy: 0.4989646460798221
Energy: 0.33804857863655663
Energy: 0.49896464607963803
Energy: 0.4402843976564736
Energy: 0.38267725602044117
Energy: 0.3584106851214284
Energy: 0.38267725602044117
Energy: 0.3136382921168394
Energy: 0.37701196522165675
Energy: 0.3386291593782828
Energy: 0.37701196522165675
Energy: 0.3343131207086027
Energy: 0.42277961132313135
Energy: 0.3388488500661045
Energy: 0.42277961132313135
Energy: 0.35687687761299214
Energy: 0.3839680182042223
Energy: 0.2824561036621185
Energy: 0.3839680182042223
Energy: 0.419677193761801
Energy: 0.3656191240760671
Energy: 0.37399240485735874
Energy: 0.3656191240760671
Energy: 0.41017546090575824
Energy: 0.3721871541969555
Energy: 0.39801102479606365
Energy: 0.3721871541969555
Energy: 0.33406408166695745
Energy: 0.4026055576058994
Energy: 0.35178264212597365
Energy: 0.4026055576058994
Energy: 0.3484750135970868
Energy: 0.3719572651516392
Energy: 0.3908166074508519
Energy: 0.3719572651516392
Energy: 0.3983080550130935
Energy: 0.3703176470074047
Energy: 0.3639357570472672
Energy: 0.3703176470074047
Energy: 0.33416277748587003
Energy: 0.42934463355615926
Energy: 0.27494877785134486
Energy: 0.42934463355615926
Energy: 0.28929868127570885
Energy: 0.3856198304264749
Energy: 0.39567921251278143
Energy: 0.3856198304264749
Energy: 0.33499241160437976
Energy: 0.4228701052291735
Energy: 0.31422404689407757
Energy: 0.4228701052291735
Energy: 0.3267695690712138
Energy: 0.459650217175975
Energy: 0.33738187339624887
Energy: 0.459650217175975
Energy: 0.3173771954017764
Energy: 0.40042474629144564
Energy: 0.42080672292337207
Energy: 0.40042474629144564
Energy: 0.33006358754398224
Energy: 0.5163760205452623
Energy: 0.42654194644849186
Energy: 0.5163760205452623
Energy: 0.3140552599836805
Energy: 0.4848702360207019
Energy: 0.4012835904193435
Energy: 0.4848702360207019
Energy: 0.2932320615014534
Energy: 0.4083537701804279
Energy: 0.4730058397942224
Energy: 0.4083537701804279
Energy: 0.34239439341253397
Energy: 0.5521506969968233
Energy: 0.35196965972644145
Energy: 0.5521506969968233
Energy: 0.3095105274420762
Energy: 0.4464747818920087
Energy: 0.4539972946097429
Energy: 0.4464747818920087
Energy: 0.30553482521561437
Energy: 0.3948247017702581
Energy: 0.4986344363182845
Energy: 0.3948247017702581
Energy: 0.3392743578443813
Energy: 0.5035051126332638
Energy: 0.27811961749138253
Energy: 0.5035051126332638
Energy: 0.34137072193600815
Energy: 0.387519708309642
Energy: 0.4870049253105289
Energy: 0.387519708309642
Energy: 0.3513258575530162
Energy: 0.370172487962187
Energy: 0.4150507060124181
Energy: 0.370172487962187
Energy: 0.33184076758683717
Energy: 0.44786874959224543
Energy: 0.3475242101975057
Energy: 0.44786874959224543
Energy: 0.43571667241649414
Energy: 0.37280186960758627
Energy: 0.4183873547407323
Energy: 0.37280186960758627
Energy: 0.40869527137789724
Energy: 0.3515212272971603
Energy: 0.38067504714672007
Energy: 0.3515212272971603
Energy: 0.3484064332379943
Energy: 0.3990081409764888
Energy: 0.2745166582257388
Energy: 0.3990081409764888
Energy: 0.34661697956985027
Energy: 0.3973418479345561
Energy: 0.3443953719970786
Energy: 0.3973418479345561
Energy: 0.4600197729495244
Energy: 0.35321653370258416
Energy: 0.33455969646403083
Energy: 0.35321653370258416
Energy: 0.4302348863615331
Energy: 0.37507756483075405
Energy: 0.34022991977298556
Energy: 0.37507756483075405
Energy: 0.2772988065402126
Energy: 0.44377287121176984
Energy: 0.3300001715874816
Energy: 0.44377287121176984
Energy: 0.4820700164496883
Energy: 0.3745502970579618
Energy: 0.3676584224807762
Energy: 0.3745502970579618
Energy: 0.4175852887132059
Energy: 0.39251207910003916
Energy: 0.34961349998275043
Energy: 0.39251207910003916
Energy: 0.3536751065833888
Energy: 0.4960624171446421
Energy: 0.3377869186097671
Energy: 0.4960624171446421
Energy: 0.4780980544568035
Energy: 0.3970839443338585
Energy: 0.31592016648590326
Energy: 0.3970839443338585
Energy: 0.37460877106887924
Energy: 0.4554155427614561
Energy: 0.3162893033444142
Energy: 0.4554155427614561
Energy: 0.28151083296835644
Energy: 0.5444391048573939
Energy: 0.3387488889820053
Energy: 0.5444391048573939
Energy: 0.4602882220904075
Energy: 0.4082832929591874
Energy: 0.29360581470332564
Energy: 0.4082832929591874
Energy: 0.32379147965970406
Energy: 0.4943968106636771
Energy: 0.3159806964468594
Energy: 0.4943968106636771

minimum gb energy = 0.2745166582257388 eV
minimum distance =  1.80385349255747 Angstroms
sigma value = 113


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

Energy: 0.0005901160227984992
Energy: 0.3171856196479511
Energy: 0.7147208491478205
Energy: 0.3171856196479511
Energy: 0.16687090070767857
Energy: 0.6047050798385668
Energy: 0.6952707929376294
Energy: 0.6047050798385668
Energy: 0.13999572190330736
Energy: 0.6510669015187608
Energy: 0.6300197895608247
Energy: 0.6510669015186361
Energy: 0.0076347157186080926
Energy: 0.9427028461022308
Energy: 0.6982414908932401
Energy: 0.9427028461022308
Energy: 0.6892784822524322
Energy: 0.579468161846242
Energy: 0.7598658906407658
Energy: 0.579468161846242
Energy: 0.10660608887379351
Energy: 0.7107859352352034
Energy: 0.5970774000009519
Energy: 0.7107859352352034

minimum gb energy = 0.0005901160227984992 eV
minimum distance =  1.91432880311025 Angstroms
sigma value = 1