Model name: model_name=EAM_Dynamo_LiuAdams_1998_AlMg__MO_019873715786_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=4.03203821182251
cohesive_energy=3.36023026856906
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: 0.010445889955402077
Energy: 0.011046904331868678
Energy: 0.2980054315742232
Energy: 0.011046904331868678
Energy: 0.011046904331868678
Energy: 0.4236734041602793
Energy: 0.011046904331868678
Energy: 0.4236734041612597
Energy: 0.29800543157668813
Energy: 0.011046904332344846
Energy: 0.010445889955402077
Energy: 0.011046904331868678
Energy: 0.011046904331868678
Energy: 0.42367340415927096
Energy: 0.011046904331868678
Energy: 0.4236734041597751

minimum gb energy = 0.010445889955402077 eV
minimum distance =  2.82811512178145 Angstroms
sigma value = 1


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

Energy: 0.5570562506135218
Energy: 0.5710102608151602
Energy: 0.6070866350602925
Energy: 0.5710102608151602
Energy: 0.549077260198958
Energy: 0.558910447162449
Energy: 0.5480052612447145
Energy: 0.5589104471630605
Energy: 0.524868770906961
Energy: 0.5603379157565228
Energy: 0.5460563278607947
Energy: 0.5603379157559113
Energy: 0.535977465472869
Energy: 0.5765644869996114
Energy: 0.5273407753377115
Energy: 0.5765644869996114
Energy: 0.534798782723047
Energy: 0.5754881376257093
Energy: 0.5480018529572181
Energy: 0.5754881376257093
Energy: 0.5269531350681899
Energy: 0.6203923295916242
Energy: 0.5123510922814841
Energy: 0.6203923295910126
Energy: 0.5630070529345851
Energy: 0.5601714967821346
Energy: 0.5269252505794292
Energy: 0.5601714967821346
Energy: 0.5105257559379606
Energy: 0.5739512760494917
Energy: 0.5077149196361087
Energy: 0.5739512760482688
Energy: 0.527752563386401
Energy: 0.631245157863683
Energy: 0.5931518695139846
Energy: 0.6312451578642945
Energy: 0.5102293536491703
Energy: 0.5598727166714722
Energy: 0.5058686966119038
Energy: 0.5598727166720836
Energy: 0.5598113315502078
Energy: 0.5586347149618984
Energy: 0.5277992043277517
Energy: 0.5586347149618984
Energy: 0.5570185990973684
Energy: 0.5746568863269644
Energy: 0.5226291040152695
Energy: 0.5746568863269644
Energy: 0.5485160219466511
Energy: 0.5588393430977732
Energy: 0.5629354137400425
Energy: 0.5588393430989961
Energy: 0.5447807211232767
Energy: 0.5620640098093492
Energy: 0.521411781061023
Energy: 0.5620640098087376
Energy: 0.5430202737860955
Energy: 0.5767658397480638
Energy: 0.5711306094105724
Energy: 0.5767658397468409
Energy: 0.5415606041257303
Energy: 0.5716050919076169
Energy: 0.5494364085809512
Energy: 0.5716050919070054
Energy: 0.5459774108469386
Energy: 0.5603044816983076
Energy: 0.5160130368524305
Energy: 0.5603044816976961
Energy: 0.5480062622221691
Energy: 0.5564945603273753
Energy: 0.5633327457060302
Energy: 0.5564945603273753
Energy: 0.5109540075831848
Energy: 0.5732033821669984
Energy: 0.5219197055550653
Energy: 0.5732033821682212
Energy: 0.5965474222227654
Energy: 0.5344949875167
Energy: 0.5293246733083438
Energy: 0.5344949875136427
Energy: 0.5106496401020407
Energy: 0.5602713177990067
Energy: 0.5050939206947251
Energy: 0.5602713177983953
Energy: 0.5274961075534812
Energy: 0.5399960411371687
Energy: 0.5911927682643958
Energy: 0.5399960411359457
Energy: 0.5872887346234009
Energy: 0.575739877529254
Energy: 0.5173553461017435
Energy: 0.575739877529254
Energy: 0.5633379181173677
Energy: 0.5605340493125389
Energy: 0.5265909282921668
Energy: 0.5605340493113161
Energy: 0.5269855836199782
Energy: 0.5648524893789407
Energy: 0.5983427507454296
Energy: 0.5648524893795521
Energy: 0.5346175850322766
Energy: 0.5753518034330659
Energy: 0.5304892618888488
Energy: 0.5753518034336774
Energy: 0.5381091605612581
Energy: 0.6255820848652569
Energy: 0.5275286434392441
Energy: 0.6255820848646455
Energy: 0.5265369254125305
Energy: 0.5584491163477452
Energy: 0.545944593890142
Energy: 0.5584491163477452
Energy: 0.5493376346869083
Energy: 0.5530471312732183
Energy: 0.5436637564153007
Energy: 0.5530471312738297
Energy: 0.5576754528196041
Energy: 0.5718249167752075
Energy: 0.5526448325444197
Energy: 0.5718249167758189
Energy: 0.550562688819398
Energy: 0.5571642527557573
Energy: 0.5465593078707461
Energy: 0.5571642527557573
Energy: 0.5336648034266689
Energy: 0.5625486942793139
Energy: 0.5447889615178131
Energy: 0.5625486942780911
Energy: 0.5347333963115435
Energy: 0.5767157078353973
Energy: 0.5284354933556448
Energy: 0.5767157078366202

minimum gb energy = 0.5050939206947251 eV
minimum distance =  2.55496389155461 Angstroms
sigma value = 1


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

Energy: 0.5938034800048844
Energy: 0.5977184876291826
Energy: 0.635246024723464
Energy: 0.5977184876291826
Energy: 0.5537115596630748
Energy: 0.5824492797794545
Energy: 0.5619353050412764
Energy: 0.5824492797766976
Energy: 0.5421755308168521
Energy: 0.5953774938664015
Energy: 0.5611952963146806
Energy: 0.5953774938650072
Energy: 0.5337741605082768
Energy: 0.5436107030944112
Energy: 0.5326086715218821
Energy: 0.5436107030951084
Energy: 0.531418960645969
Energy: 0.5708131594007549
Energy: 0.5847863627110828
Energy: 0.5708131593972692
Energy: 0.5871244488667063
Energy: 0.5706827979189101
Energy: 0.5636268383219427
Energy: 0.5706827979175156
Energy: 0.5896233486330593
Energy: 0.5447199838840282
Energy: 0.5326716173118679
Energy: 0.5447199838791481
Energy: 0.5190348855614281
Energy: 0.5957427941809719
Energy: 0.5244976060220822
Energy: 0.5957427941865493
Energy: 0.5363484155330521
Energy: 0.5543322224412135
Energy: 0.5791205973025283
Energy: 0.5543322224391221
Energy: 0.5324550930846451
Energy: 0.5953223189611232
Energy: 0.5249486980624709
Energy: 0.595322318960426
Energy: 0.5547527602767346
Energy: 0.5594759160584457
Energy: 0.5617844194413016
Energy: 0.5594759160598402
Energy: 0.5276398052341169
Energy: 0.5891862208313106
Energy: 0.5612119232967447
Energy: 0.5891862208334019
Energy: 0.5746371854660074
Energy: 0.5708191305073066
Energy: 0.5511652104767273
Energy: 0.5708191305073066
Energy: 0.5744982242938363
Energy: 0.5707094679466169
Energy: 0.5467446645038995
Energy: 0.5707094679466169
Energy: 0.5275406247751618
Energy: 0.5891785288321131
Energy: 0.5612204613377422
Energy: 0.5891785288328103
Energy: 0.5547056787591804
Energy: 0.559251636761829
Energy: 0.5617821902781595
Energy: 0.5592516367611319
Energy: 0.5324749354072009
Energy: 0.595569172779853
Energy: 0.5271171225533127
Energy: 0.5955691727777616
Energy: 0.5348669363078602
Energy: 0.5544399761132044
Energy: 0.5788144722791962
Energy: 0.5544399761104157
Energy: 0.5190496927430974
Energy: 0.5957160153681744
Energy: 0.5253551506370245
Energy: 0.5957160153639914
Energy: 0.5896826670549926
Energy: 0.544736456642061
Energy: 0.5401429541633537
Energy: 0.544736456637181
Energy: 0.5870780042249252
Energy: 0.5705608483473662
Energy: 0.5246487673774465
Energy: 0.570560848346669
Energy: 0.5314908940458581
Energy: 0.5708496618899661
Energy: 0.5500676981327736
Energy: 0.5708496618885719
Energy: 0.5313519575091759
Energy: 0.5434134210344602
Energy: 0.5325885176502431
Energy: 0.5434134210351573
Energy: 0.5421724294056923
Energy: 0.5951942256695026
Energy: 0.5612366438895328
Energy: 0.5951942256701999
Energy: 0.5536121870951642
Energy: 0.5824228998109501
Energy: 0.5618926527058754
Energy: 0.5824228998095874
Energy: 0.5938034800048844
Energy: 0.5977184876291826
Energy: 0.6033108916205354
Energy: 0.5977184876291826
Energy: 0.5537115596630748
Energy: 0.5824492797794545
Energy: 0.5619353050419738
Energy: 0.5824492797766976
Energy: 0.5421755308175492
Energy: 0.5953774938664015
Energy: 0.5611952963153779
Energy: 0.5953774938650072
Energy: 0.533774160508974
Energy: 0.543610703093714
Energy: 0.5397029308376728
Energy: 0.5436107030951084

minimum gb energy = 0.5190348855614281 eV
minimum distance =  2.53956281188492 Angstroms
sigma value = 25


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

Energy: 0.5857124890059792
Energy: 0.6195283591862264
Energy: 0.6677288108950449
Energy: 0.6195283591862264
Energy: 0.5776063080088967
Energy: 0.5845759949543785
Energy: 0.5586044784359618
Energy: 0.5845759949543785
Energy: 0.5578127317327232
Energy: 0.6501742252001698
Energy: 0.5572650886810648
Energy: 0.6501742252001698
Energy: 0.5486292476065563
Energy: 0.6070803326058479
Energy: 0.5507709924068102
Energy: 0.6070803326058479
Energy: 0.5527515828862711
Energy: 0.6221969206315109
Energy: 0.6169875479169873
Energy: 0.6221969206315109
Energy: 0.615628619165607
Energy: 0.6511420680110688
Energy: 0.6256828131111072
Energy: 0.6511420680118791
Energy: 0.6250422074612145
Energy: 0.5578590305333858
Energy: 0.5735772062561646
Energy: 0.5578590305325755
Energy: 0.6590387955788871
Energy: 0.6212861334146099
Energy: 0.5419726872365758
Energy: 0.6212861334137993
Energy: 0.573478078147347
Energy: 0.5882435431448875
Energy: 0.5783411074320401
Energy: 0.5882435431448875
Energy: 0.556511255257479
Energy: 0.652868894281112
Energy: 0.5474001867802843
Energy: 0.652868894281112
Energy: 0.5643073884723306
Energy: 0.6196039929371379
Energy: 0.5947921534994152
Energy: 0.6196039929371379
Energy: 0.5691260585982233
Energy: 0.6196142503248508
Energy: 0.5965383257494653
Energy: 0.6196142503248508
Energy: 0.5573194936353134
Energy: 0.6027219486692014
Energy: 0.5451824062347288
Energy: 0.6027219486700118
Energy: 0.5738995495032376
Energy: 0.5880812430719731
Energy: 0.5776653196075674
Energy: 0.5880812430711628
Energy: 0.5378887801355406
Energy: 0.6219859387586776
Energy: 0.540855276909773
Energy: 0.6219859387586776
Energy: 0.5767527067498814
Energy: 0.5605160189325556
Energy: 0.5516993693338603
Energy: 0.5605160189333661
Energy: 0.5349308883225545
Energy: 0.6505988131354499
Energy: 0.5313258869528596
Energy: 0.6505988131354499
Energy: 0.5508258830246863
Energy: 0.595902714623733
Energy: 0.562602688297259
Energy: 0.5959027146245435
Energy: 0.539056016891364
Energy: 0.6118984049138392
Energy: 0.5520443219376291
Energy: 0.6118984049138392
Energy: 0.5783430674847246
Energy: 0.6507866604160787
Energy: 0.557438535912027
Energy: 0.6507866604160787
Energy: 0.5675867388105986
Energy: 0.5829484155201615
Energy: 0.5583235510236375
Energy: 0.582948415520972
Energy: 0.584425113019963
Energy: 0.6199808333351715
Energy: 0.6013482621722762
Energy: 0.6199808333359821
Energy: 0.5771146129202241
Energy: 0.5986012151202049
Energy: 0.559114060675722
Energy: 0.5986012151202049
Energy: 0.5594051635919529
Energy: 0.6499998316744526
Energy: 0.5566295707281901
Energy: 0.6499998316744526
Energy: 0.662905501513492
Energy: 0.5690241772354357
Energy: 0.5503134398225676
Energy: 0.5690241772354357

minimum gb energy = 0.5313258869528596 eV
minimum distance =  2.5444269511655 Angstroms
sigma value = 9


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

Energy: 0.5909018014997046
Energy: 0.591384321543329
Energy: 0.7094175916159898
Energy: 0.5913843215442958
Energy: 0.5851460046274138
Energy: 0.6092638917600034
Energy: 0.5731667554661576
Energy: 0.6092638917600034
Energy: 0.5757107018935758
Energy: 0.5964353360282041
Energy: 0.5662513109499814
Energy: 0.596435336029171
Energy: 0.6681974519874032
Energy: 0.6487433505248111
Energy: 0.5581031816708064
Energy: 0.6487433505257779
Energy: 0.6435497763007207
Energy: 0.607655126697828
Energy: 0.6533916345886442
Energy: 0.6076551266987948
Energy: 0.5406350645673021
Energy: 0.596478020631827
Energy: 0.5953248039006163
Energy: 0.596478020631827
Energy: 0.6056924689423991
Energy: 0.5575805593573049
Energy: 0.5575039916752572
Energy: 0.5575805593563381
Energy: 0.610740901864159
Energy: 0.596781456315503
Energy: 0.5567749352512664
Energy: 0.5967814563145362
Energy: 0.5897751447400192
Energy: 0.6087057919916076
Energy: 0.5942572688369969
Energy: 0.6087057919906408
Energy: 0.5889298179443881
Energy: 0.5921199131283951
Energy: 0.5959049969600669
Energy: 0.5921199131264615
Energy: 0.5595013502463257
Energy: 0.6033099040712859
Energy: 0.5646887652702198
Energy: 0.6033099040703191
Energy: 0.6071903197816387
Energy: 0.6133554664735704
Energy: 0.5578111445455964
Energy: 0.6133554664726035
Energy: 0.5405127961647302
Energy: 0.5960452462624767
Energy: 0.6102185109257647
Energy: 0.5960452462624767
Energy: 0.6011064269422194
Energy: 0.5871459072792411
Energy: 0.5818029059289637
Energy: 0.5871459072782743
Energy: 0.5405253900141209
Energy: 0.5958128823367248
Energy: 0.610415578598605
Energy: 0.5958128823367248
Energy: 0.6072006958088365
Energy: 0.6134253443321074
Energy: 0.5579137406923065
Energy: 0.6134253443321074
Energy: 0.5593983220790965
Energy: 0.6033202149416841
Energy: 0.5661905533664846
Energy: 0.6033202149407173
Energy: 0.5889735993142097
Energy: 0.5919058124828676
Energy: 0.5958744638847275
Energy: 0.5919058124838343
Energy: 0.5898214088383916
Energy: 0.6087122201779624
Energy: 0.5942890520430588
Energy: 0.6087122201750621
Energy: 0.6107965571055256
Energy: 0.59676742417262
Energy: 0.5567266312199312
Energy: 0.5967674241706863
Energy: 0.6058150962177081
Energy: 0.5574980714219977
Energy: 0.5575714151431989
Energy: 0.5574980714219977

minimum gb energy = 0.5405127961647302 eV
minimum distance =  2.65449147444779 Angstroms
sigma value = 25


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

Energy: 0.5723319770417621
Energy: 0.6441308075154315
Energy: 0.7429363814346936
Energy: 0.6441308075142358
Energy: 0.5569019901339424
Energy: 0.6087004519562876
Energy: 0.54363850663012
Energy: 0.6087004519562876
Energy: 0.5962719228273967
Energy: 0.6664510251129908
Energy: 0.5422882996393867
Energy: 0.6664510251117953
Energy: 0.6245375264879116
Energy: 0.638253942767834
Energy: 0.6332436247434089
Energy: 0.638253942767834
Energy: 0.6325119223827681
Energy: 0.5566459662952872
Energy: 0.5894599180014055
Energy: 0.5566459662964828
Energy: 0.5448237918388469
Energy: 0.6651369409727298
Energy: 0.5940311395784938
Energy: 0.6651369409739253
Energy: 0.5438699915949767
Energy: 0.6072686503927832
Energy: 0.5962773792882307
Energy: 0.6072686503927832
Energy: 0.6701029651096948
Energy: 0.6454552013185656
Energy: 0.5729214080579875
Energy: 0.6454552013185656
Energy: 0.5423876956495146
Energy: 0.6085058203954056
Energy: 0.55707104846361
Energy: 0.6085058203954056
Energy: 0.6593059908821269
Energy: 0.6260580942538102
Energy: 0.5947714169189876
Energy: 0.6260580942538102
Energy: 0.5620535094182316
Energy: 0.6485410657463492
Energy: 0.7135999611381787
Energy: 0.6485410657463492
Energy: 0.588574519679002
Energy: 0.6052152439660407
Energy: 0.6588741467946229
Energy: 0.6052152439648453
Energy: 0.6235637043838074
Energy: 0.666936176482414
Energy: 0.5420128638567515
Energy: 0.666936176482414
Energy: 0.5897973600860698
Energy: 0.5912614915293167
Energy: 0.6249460835485817
Energy: 0.5912614915305123
Energy: 0.5690206811038416
Energy: 0.646104652407343
Energy: 0.6787270714766895
Energy: 0.646104652407343
Energy: 0.5576735822227085
Energy: 0.6267549015187162
Energy: 0.5449387839899038
Energy: 0.6267549015187162
Energy: 0.5941910116574758
Energy: 0.5933375036243784
Energy: 0.6577593575598163
Energy: 0.5933375036243784

minimum gb energy = 0.5420128638567515 eV
minimum distance =  2.62834162869479 Angstroms
sigma value = 17


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

Energy: 0.6046895241014653
Energy: 0.6782135077966589
Energy: 0.7535672778650787
Energy: 0.6782135077973359
Energy: 0.6217396962526374
Energy: 0.5900778467492349
Energy: 0.5542296255648133
Energy: 0.5900778467485579
Energy: 0.6561596272689739
Energy: 0.5986630573881856
Energy: 0.5535808658861312
Energy: 0.5986630573888627
Energy: 0.5968278914931179
Energy: 0.6049690238907975
Energy: 0.6014262872762437
Energy: 0.6049690238921519
Energy: 0.6595007443456451
Energy: 0.5872786980228848
Energy: 0.5844533495255285
Energy: 0.587278698024239
Energy: 0.5654935363604279
Energy: 0.6100646377892966
Energy: 0.6553364873382092
Energy: 0.6100646377886195
Energy: 0.5856713003060656
Energy: 0.6079800756240257
Energy: 0.5824508569123319
Energy: 0.6079800756247028
Energy: 0.6536668394568549
Energy: 0.6102997799789479
Energy: 0.5684266972862799
Energy: 0.610299779979625
Energy: 0.6137732526659768
Energy: 0.6250110859011077
Energy: 0.6553855761879775
Energy: 0.6250110859011077
Energy: 0.7059386094078063
Energy: 0.6063265551504033
Energy: 0.6028085242380267
Energy: 0.6063265551497263
Energy: 0.5551259749974113
Energy: 0.603648886718193
Energy: 0.666280906848143
Energy: 0.6036488867168388
Energy: 0.5967772469409567
Energy: 0.6072845582737263
Energy: 0.594138584504598
Energy: 0.6072845582730491
Energy: 0.655113536582506
Energy: 0.6060745729924922
Energy: 0.6062214394029649
Energy: 0.6060745729924922
Energy: 0.5577259552112568
Energy: 0.645566437259799
Energy: 0.6213790586605658
Energy: 0.645566437259799
Energy: 0.6123815280265694
Energy: 0.6078024833154396
Energy: 0.5990663940679558
Energy: 0.6078024833154396
Energy: 0.6421996942813566
Energy: 0.6110133789359232
Energy: 0.6301220981002634
Energy: 0.6110133789352461
Energy: 0.5830959328891584
Energy: 0.6224365394819233
Energy: 0.6885929543146618
Energy: 0.6224365394812462
Energy: 0.6645760264513377
Energy: 0.5941838971985334
Energy: 0.5655064876586434
Energy: 0.5941838971978562
Energy: 0.5840091813586471
Energy: 0.6245624946202855
Energy: 0.5870148353524264
Energy: 0.6245624946209626
Energy: 0.5826290851482917
Energy: 0.6047152434522292
Energy: 0.5875555055617425
Energy: 0.6047152434529063
Energy: 0.5902026044172787
Energy: 0.5928512458689069
Energy: 0.6320823717970269
Energy: 0.5928512458675526
Energy: 0.5832211724196269
Energy: 0.656279073681302
Energy: 0.7083196187277876
Energy: 0.6562790736792705
Energy: 0.5903644728381454
Energy: 0.6055449675915534
Energy: 0.5544078093661011
Energy: 0.6055449675915534
Energy: 0.5928489616236
Energy: 0.6097563314397462
Energy: 0.6552160413647286
Energy: 0.6097563314404234
Energy: 0.5952708212481654
Energy: 0.5987663978058136
Energy: 0.6561871061508553
Energy: 0.5987663978058136
Energy: 0.682642762667559
Energy: 0.6051056328939945
Energy: 0.5541084101558427
Energy: 0.6051056328946717
Energy: 0.583697731995506
Energy: 0.6314122807111061
Energy: 0.72538059073396
Energy: 0.6314122807117831
Energy: 0.6397416571792065
Energy: 0.6102188014998683
Energy: 0.6331933684980706
Energy: 0.6102188014985139
Energy: 0.6697512062412896
Energy: 0.6064169249880623
Energy: 0.586711441362797
Energy: 0.6064169249887393
Energy: 0.5685857466062035
Energy: 0.6240632861995731
Energy: 0.6616413417238431
Energy: 0.6240632861995731

minimum gb energy = 0.5535808658861312 eV
minimum distance =  2.51182699607007 Angstroms
sigma value = 53


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

Energy: 0.5133501641219304
Energy: 0.514087618377707
Energy: 0.7832481157127029
Energy: 0.514087618377707
Energy: 0.6408716465353994
Energy: 0.584739299826389
Energy: 0.5724606432319477
Energy: 0.584739299826389
Energy: 0.5248196397311895
Energy: 0.5140953997270606
Energy: 0.5151023233402404
Energy: 0.5140953997286196
Energy: 0.5247874333634625
Energy: 0.5142188922357873
Energy: 0.5150469517034295
Energy: 0.5142188922342283
Energy: 0.6408958055340184
Energy: 0.5847004319807931
Energy: 0.572564091408645
Energy: 0.5847004319792343
Energy: 0.5133501641219304
Energy: 0.514087618379266
Energy: 0.7962038917258816
Energy: 0.514087618377707
Energy: 0.6408716465353994
Energy: 0.584739299826389
Energy: 0.5824841718124903
Energy: 0.584739299826389
Energy: 0.5248196397311895
Energy: 0.5140953997270606
Energy: 0.5716512447367517
Energy: 0.5140953997286196
Energy: 0.5247874333619035
Energy: 0.5142188922357873
Energy: 0.5759449501573413
Energy: 0.5142188922342283
Energy: 0.6408958055340184
Energy: 0.5847004319792343
Energy: 0.6256807528985057
Energy: 0.5847004319792343
Energy: 0.5133501641219304
Energy: 0.514087618379266
Energy: 0.6879661658570821
Energy: 0.514087618377707
Energy: 0.6408716465338405
Energy: 0.584739299826389
Energy: 0.6208061625581055
Energy: 0.584739299826389
Energy: 0.5248196397311895
Energy: 0.5140953997255017
Energy: 0.6198500449623509
Energy: 0.5140953997286196

minimum gb energy = 0.5133501641219304 eV
minimum distance =  2.598242161282 Angstroms
sigma value = 9


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

Energy: 0.5575107615377242
Energy: 0.6948267312847595
Energy: 0.778888079496442
Energy: 0.6948267312847595
Energy: 0.6908207611916884
Energy: 0.5943958964986873
Energy: 0.5742909454760373
Energy: 0.5943958964986873
Energy: 0.5791052054023595
Energy: 0.5478292955843884
Energy: 0.5647566632723466
Energy: 0.5478292955849653
Energy: 0.6514333494474999
Energy: 0.6538067440236065
Energy: 0.5740642056020608
Energy: 0.6538067440224526
Energy: 0.6491020059574683
Energy: 0.5782833942029852
Energy: 0.5708760287741743
Energy: 0.5782833942018313
Energy: 0.5477523337725047
Energy: 0.5480193094820495
Energy: 0.6595336780577289
Energy: 0.5480193094820495
Energy: 0.7372964753650447
Energy: 0.5743924812367935
Energy: 0.5740382053837733
Energy: 0.5743924812367935
Energy: 0.5779895326391241
Energy: 0.6614747729394211
Energy: 0.6559027877670871
Energy: 0.6614747729399981
Energy: 0.5680556305392995
Energy: 0.6152972550000697
Energy: 0.5537720402550599
Energy: 0.6152972550000697
Energy: 0.5722367501271037
Energy: 0.591320366373941
Energy: 0.5754362940898633
Energy: 0.5913203663727871
Energy: 0.5870417883452128
Energy: 0.6078840708046213
Energy: 0.7513705728137372
Energy: 0.6078840708034673
Energy: 0.6585785387904273
Energy: 0.6370552733297201
Energy: 0.569327351165316
Energy: 0.6370552733285662
Energy: 0.58051094799822
Energy: 0.6696052196216278
Energy: 0.7039586928227771
Energy: 0.6696052196210509
Energy: 0.6513580835637401
Energy: 0.669539314997321
Energy: 0.5615856572623082
Energy: 0.669539314996744
Energy: 0.5753731023470562
Energy: 0.6317238901582494
Energy: 0.642545842319431
Energy: 0.6317238901588264
Energy: 0.5822383448460602
Energy: 0.6590168334156103
Energy: 0.6545375214908794
Energy: 0.6590168334150333
Energy: 0.6187395525031305
Energy: 0.6318065895469446
Energy: 0.5758129248418812
Energy: 0.6318065895475214
Energy: 0.5989216567332605
Energy: 0.5745533601483063
Energy: 0.6505023738920609
Energy: 0.5745533601488831
Energy: 0.6585209823148558
Energy: 0.6315005527701847
Energy: 0.5494358697253473
Energy: 0.6315005527707617
Energy: 0.5687542399386296
Energy: 0.6000069201081271
Energy: 0.6442083185821802
Energy: 0.6000069201069731
Energy: 0.6511774253360033
Energy: 0.6511540016834595
Energy: 0.656285424558932
Energy: 0.6511540016834595
Energy: 0.6272768758627328
Energy: 0.6247521997118338
Energy: 0.571213851962985
Energy: 0.6247521997112567
Energy: 0.5536167513271698
Energy: 0.6326680964781717
Energy: 0.5723147996434546
Energy: 0.6326680964781717
Energy: 0.7418648547672118
Energy: 0.6848093052752044
Energy: 0.5865408934955001
Energy: 0.6848093052752044
Energy: 0.5737409087421121
Energy: 0.6454622700694086
Energy: 0.7324242418188346
Energy: 0.6454622700711395
Energy: 0.6171656396688623
Energy: 0.5865747673995554
Energy: 0.5787384184871708
Energy: 0.5865747673995554
Energy: 0.594608726117976
Energy: 0.6175366221951442
Energy: 0.6506657481051916
Energy: 0.6175366221951442
Energy: 0.5608649369110157
Energy: 0.670630809685133
Energy: 0.6478558726099024
Energy: 0.6706308096857101
Energy: 0.6010871124115281
Energy: 0.5871599927176953
Energy: 0.5780369390828257
Energy: 0.5871599927159643
Energy: 0.5732304007269472
Energy: 0.6495944370543811
Energy: 0.7337242374219853
Energy: 0.6495944370526503
Energy: 0.7073422710774544
Energy: 0.6088417243727449
Energy: 0.5859730305431642
Energy: 0.6088417243738989
Energy: 0.5496260489534596
Energy: 0.5759084523030807
Energy: 0.5710453178110095
Energy: 0.5759084523025036
Energy: 0.5509467801607396
Energy: 0.6249887586250912
Energy: 0.5705585454985014
Energy: 0.6249887586256683
Energy: 0.651835757661463
Energy: 0.6511943137900951
Energy: 0.6545583920817092
Energy: 0.6511943137900951
Energy: 0.568302764790255
Energy: 0.6656570055042031
Energy: 0.7670677249142163
Energy: 0.6656570055024722

minimum gb energy = 0.5477523337725047 eV
minimum distance =  2.56469211596319 Angstroms
sigma value = 73


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

Energy: 0.5802741846786212
Energy: 0.5807946805030815
Energy: 0.7546995323809508
Energy: 0.5807946805012505
Energy: 0.6478873449710301
Energy: 0.593883943417635
Energy: 0.5823805664431466
Energy: 0.5938839434185504
Energy: 0.5800976720586349
Energy: 0.5704065177979928
Energy: 0.5526873231274848
Energy: 0.5704065177970774
Energy: 0.5895686573347315
Energy: 0.6265848348842127
Energy: 0.6071246045190845
Energy: 0.6265848348860436
Energy: 0.611053848029253
Energy: 0.5997797894867449
Energy: 0.5728947892971473
Energy: 0.5997797894876603
Energy: 0.5999685051501832
Energy: 0.5577523425556802
Energy: 0.7086595441966712
Energy: 0.5577523425565957
Energy: 0.737973502990255
Energy: 0.6939392777498312
Energy: 0.5814205434229224
Energy: 0.6939392777470849
Energy: 0.5789161567445843
Energy: 0.5385391690297061
Energy: 0.6826649618369376
Energy: 0.5385391690287907
Energy: 0.7306545566088244
Energy: 0.5383567712864704
Energy: 0.5386159699329452
Energy: 0.538356771285555
Energy: 0.5839698300586738
Energy: 0.6220095630148508
Energy: 0.5842818109383505
Energy: 0.6220095630166816
Energy: 0.5592879888766349
Energy: 0.569853499542849
Energy: 0.7027040195046386
Energy: 0.5698534995437644
Energy: 0.6433248865768071
Energy: 0.5601177220996448
Energy: 0.5697870870424679
Energy: 0.5601177220987295
Energy: 0.5725608215144592
Energy: 0.6116750051661578
Energy: 0.6495642816829745
Energy: 0.6116750051661578
Energy: 0.7122887284413976
Energy: 0.6146612881141091
Energy: 0.598751571229377
Energy: 0.6146612881131936
Energy: 0.5435287513582261
Energy: 0.6593116495379739
Energy: 0.7060360486445345
Energy: 0.6593116495379739
Energy: 0.6825216578899148
Energy: 0.5948441757057477
Energy: 0.5784146414927651
Energy: 0.5948441757057477
Energy: 0.5803626708199884
Energy: 0.5804480835712318
Energy: 0.5803442889280761
Energy: 0.5804480835721472
Energy: 0.5816409868598899
Energy: 0.5812828925875708
Energy: 0.5820730640854394
Energy: 0.5812828925875708
Energy: 0.5693412064372582
Energy: 0.5377546861873036
Energy: 0.5772665360449606
Energy: 0.5377546861854728
Energy: 0.5801965235628825
Energy: 0.615392163235564
Energy: 0.7486904681796698
Energy: 0.615392163235564
Energy: 0.7045524544428803
Energy: 0.6007537761695453
Energy: 0.5979118629460222
Energy: 0.6007537761686299
Energy: 0.607116410172357
Energy: 0.6095938477519869
Energy: 0.6424118595658315
Energy: 0.6095938477519869

minimum gb energy = 0.5377546861854728 eV
minimum distance =  2.57627848573753 Angstroms
sigma value = 7


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

Energy: 0.5459002340284517
Energy: 0.546803012986534
Energy: 0.7856491214933141
Energy: 0.5468030129832974
Energy: 0.7425685928287068
Energy: 0.5838448046167316
Energy: 0.5827574388408975
Energy: 0.5838448046102586
Energy: 0.5774498238485394
Energy: 0.5495020065166881
Energy: 0.5558775766480338
Energy: 0.5495020065147462
Energy: 0.6323594767359508
Energy: 0.5835579342880491
Energy: 0.5851980452153479
Energy: 0.5835579342945221
Energy: 0.5781760771609609
Energy: 0.5933176861903139
Energy: 0.5524950203768312
Energy: 0.5933176861922559
Energy: 0.5709068126296438
Energy: 0.5877203919795632
Energy: 0.7266722786464499
Energy: 0.5877203919789159
Energy: 0.6564519462514222
Energy: 0.6591648896862804
Energy: 0.5949703048653193
Energy: 0.6591648896869277
Energy: 0.57059690160107
Energy: 0.5872698921323581
Energy: 0.7656087426492407
Energy: 0.5872698921323581
Energy: 0.6539770987038569
Energy: 0.575268190322583
Energy: 0.5832557583181807
Energy: 0.5752681903238777
Energy: 0.5749849664777044
Energy: 0.5845565675953094
Energy: 0.6181208696701005
Energy: 0.5845565676017824
Energy: 0.5935857594739101
Energy: 0.628449496098659
Energy: 0.5960923598915514
Energy: 0.6284494960999536
Energy: 0.5474988763818436
Energy: 0.5929569516756137
Energy: 0.5935552945563827
Energy: 0.5929569516775556
Energy: 0.547037692128034
Energy: 0.5485245596831868
Energy: 0.6374622281632331
Energy: 0.5485245596851287
Energy: 0.5882279189224525
Energy: 0.5844763843253632
Energy: 0.6353348006150463
Energy: 0.5844763843253632
Energy: 0.5736735908526596
Energy: 0.6575424977354206
Energy: 0.7158560030291927
Energy: 0.6575424977380099
Energy: 0.7676349225608217
Energy: 0.5423152269156027
Energy: 0.5772215778605628
Energy: 0.5423152269143081
Energy: 0.5793020362739054
Energy: 0.5940293547945217
Energy: 0.6608969230483086
Energy: 0.5940293547945217
Energy: 0.5585415559308335
Energy: 0.6030711576749096
Energy: 0.5947234023647392
Energy: 0.603071157677499
Energy: 0.5794585891080662
Energy: 0.5876135212362517
Energy: 0.5704616282744638
Energy: 0.5876135212356044
Energy: 0.5754259090377069
Energy: 0.5932438454542599
Energy: 0.5990778734625244
Energy: 0.5932438454587912
Energy: 0.6385198500812667
Energy: 0.5625996751544349
Energy: 0.5863916488855594
Energy: 0.5625996751518456
Energy: 0.5751826260105379
Energy: 0.5498009371688395
Energy: 0.6450749651180423
Energy: 0.5498009371733706
Energy: 0.713547016416997
Energy: 0.640069082213119
Energy: 0.5963951419461152
Energy: 0.640069082211177
Energy: 0.5489045575585385
Energy: 0.5472585584781148
Energy: 0.7354223575514756
Energy: 0.5472585584742309
Energy: 0.6298728631723006
Energy: 0.5929320785806665
Energy: 0.5952042561314115
Energy: 0.5929320785806665
Energy: 0.6330056820921065
Energy: 0.6277403721549091
Energy: 0.593402632901527
Energy: 0.6277403721562037
Energy: 0.5756509088697908
Energy: 0.5857524389856594
Energy: 0.5980087579765264
Energy: 0.5857524389856594
Energy: 0.63345484816222
Energy: 0.5936985087139842
Energy: 0.5850118143024309
Energy: 0.5936985087133368
Energy: 0.5680241458269066
Energy: 0.5875103687463284
Energy: 0.6884565673076389
Energy: 0.5875103687528016
Energy: 0.6793419800055331
Energy: 0.6874747477266342
Energy: 0.5825546497276872
Energy: 0.6874747477214558
Energy: 0.5680147479215569
Energy: 0.587529987410509
Energy: 0.7000744144815296
Energy: 0.5875299874092144

minimum gb energy = 0.5423152269143081 eV
minimum distance =  2.56081010207761 Angstroms
sigma value = 29


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

Energy: 0.49538406123353806
Energy: 0.5002130788889725
Energy: 0.804687205030271
Energy: 0.5002130788896239
Energy: 0.5295944359696438
Energy: 0.4956523987051259
Energy: 0.49550278749202015
Energy: 0.4956523841580105
Energy: 0.6537389635208081
Energy: 0.5136063744639834
Energy: 0.5610848698257626
Energy: 0.5136063744646348
Energy: 0.4954772644574951
Energy: 0.4715919900203618
Energy: 0.49538886476246285
Energy: 0.4715919900203618
Energy: 0.49560130933326924
Energy: 0.5043185766960702
Energy: 0.5795695975793346
Energy: 0.5043185766951682
Energy: 0.5770772527280839
Energy: 0.5130555806092613
Energy: 0.5770970570262779
Energy: 0.5130555806090358
Energy: 0.5795432855051571
Energy: 0.50430308457198
Energy: 0.4956068487345285
Energy: 0.5043030845717796
Energy: 0.4953975022829354
Energy: 0.4714859915539289
Energy: 0.4954576596143705
Energy: 0.4714859915561335
Energy: 0.5610946205169884
Energy: 0.5144486034404873
Energy: 0.6537032807564255
Energy: 0.5144486034385081

minimum gb energy = 0.4714859915539289 eV
minimum distance =  2.60633952589992 Angstroms
sigma value = 5


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

Energy: 0.5261489356073018
Energy: 0.5313039174396349
Energy: 0.8109526370315053
Energy: 0.5313039174408578
Energy: 0.6042938119253445
Energy: 0.5431686377609729
Energy: 0.5463939387436316
Energy: 0.5431686377609729
Energy: 0.5201368153173704
Energy: 0.5776015840668577
Energy: 0.6529554921759985
Energy: 0.5776015840662463
Energy: 0.5995718285243395
Energy: 0.5543052374783555
Energy: 0.5207039434272256
Energy: 0.5543052374783555
Energy: 0.5293283934309109
Energy: 0.5591517718427065
Energy: 0.6082320279438368
Energy: 0.5591517718408723
Energy: 0.5511814600905203
Energy: 0.5789327726269295
Energy: 0.5194498638978493
Energy: 0.578932772626318
Energy: 0.5170682712274592
Energy: 0.5545288849980247
Energy: 0.516712224917489
Energy: 0.5545288849974133
Energy: 0.516793652681891
Energy: 0.5791335769350822
Energy: 0.5281127726103063
Energy: 0.5791335769344708
Energy: 0.518020001447443
Energy: 0.558514443531099
Energy: 0.5414683005103502
Energy: 0.5585144435329333
Energy: 0.5177787649069534
Energy: 0.554951665320414
Energy: 0.5223663532671722
Energy: 0.5549516653198024
Energy: 0.5515163398724185
Energy: 0.6094895043928857
Energy: 0.5214245313249507
Energy: 0.6094895043941086
Energy: 0.5489252301160198
Energy: 0.5610803970194478
Energy: 0.5315490056647793
Energy: 0.5610803970200593
Energy: 0.549247331547621
Energy: 0.5316442955366127
Energy: 0.5340930552186157
Energy: 0.5316442955372243
Energy: 0.5281495421366083
Energy: 0.5316169033768927
Energy: 0.5845376732567522
Energy: 0.5316169033768927
Energy: 0.6524089790543124
Energy: 0.618192286588355
Energy: 0.5213283354378817
Energy: 0.618192286588355
Energy: 0.5181288581083175
Energy: 0.5298315509335354
Energy: 0.5620811848631473
Energy: 0.5298315509335354
Energy: 0.604519184425506
Energy: 0.5254970928314093
Energy: 0.5278534081771877
Energy: 0.5254970928320207
Energy: 0.5211670243148038
Energy: 0.5786928313329359
Energy: 0.621588463184012
Energy: 0.5786928313323244
Energy: 0.5175723995035156
Energy: 0.5560854761896837
Energy: 0.521227817600464
Energy: 0.5560854761909068
Energy: 0.5284863522900726
Energy: 0.6291974264023016
Energy: 0.5231785824427808
Energy: 0.6291974264010786
Energy: 0.6059294776239473
Energy: 0.5534395587697948
Energy: 0.5182981868374248
Energy: 0.5534395587704062
Energy: 0.5499335829682263
Energy: 0.5547930227908638
Energy: 0.5180714662272239
Energy: 0.5547930227902523
Energy: 0.5227055375428686
Energy: 0.5315589031961557
Energy: 0.5336928989238219
Energy: 0.5315589031967395
Energy: 0.5307810118243688
Energy: 0.5340013692977987
Energy: 0.5282757776945547
Energy: 0.5340013692977987
Energy: 0.5308066467815882
Energy: 0.5279194095323223
Energy: 0.6033301791937089
Energy: 0.5279194095310995
Energy: 0.5256149850622998
Energy: 0.5320406983881204
Energy: 0.5301913279679867
Energy: 0.5320406983881204
Energy: 0.522175058522107
Energy: 0.5148918395678844
Energy: 0.522805264381136
Energy: 0.5148918395684959
Energy: 0.5642151404348585
Energy: 0.5534553376226515
Energy: 0.5181836853032651
Energy: 0.5534553376226515
Energy: 0.5261634756693128
Energy: 0.5202684759051932
Energy: 0.7426963577127587
Energy: 0.5202684759045817
Energy: 0.6050450113045067
Energy: 0.5787642591374516
Energy: 0.521246653280428
Energy: 0.5787642591380632
Energy: 0.5186003361197782
Energy: 0.523137034114957
Energy: 0.6075204910493837
Energy: 0.523137034114957
Energy: 0.6053480046458052
Energy: 0.5775887029119753
Energy: 0.5265139856787654
Energy: 0.5775887029113639
Energy: 0.5194757269711177
Energy: 0.5537957259527497
Energy: 0.609081137247896
Energy: 0.5537957259533612

minimum gb energy = 0.5148918395678844 eV
minimum distance =  2.55822090954905 Angstroms
sigma value = 1


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

Energy: 0.5160868927972618
Energy: 0.5166892757033402
Energy: 0.7207328500200694
Energy: 0.5166892757033402
Energy: 0.51528737968122
Energy: 0.5202079245627294
Energy: 0.5102492483291042
Energy: 0.5202079245635747
Energy: 0.5011464293349703
Energy: 0.5893444521919073
Energy: 0.6044411515584006
Energy: 0.5893444521935983
Energy: 0.5501357655735826
Energy: 0.5497352271892076
Energy: 0.5010316119753299
Energy: 0.5497352271900531
Energy: 0.5139231436973196
Energy: 0.5646558961263036
Energy: 0.6214289439926328
Energy: 0.564655896127149
Energy: 0.5116042944470371
Energy: 0.5480994818634134
Energy: 0.5012690568234505
Energy: 0.5480994818617224
Energy: 0.501771996746623
Energy: 0.5617675923270409
Energy: 0.5166652851361697
Energy: 0.5617675923270409
Energy: 0.5018570348023319
Energy: 0.5895180856871449
Energy: 0.5331123129947305
Energy: 0.5895180856888357
Energy: 0.5163873718797152
Energy: 0.5134654770722156
Energy: 0.5329199142162326
Energy: 0.5134654770722156
Energy: 0.5162842446582311
Energy: 0.5135213234066165
Energy: 0.5280676705567957
Energy: 0.5135213234040802
Energy: 0.5018351847988618
Energy: 0.5894797409042871
Energy: 0.5325284060099164
Energy: 0.5894797409085143
Energy: 0.5017562301165654
Energy: 0.5618659153910227
Energy: 0.5058153200459053
Energy: 0.5618659153893317
Energy: 0.5117463051875836
Energy: 0.5481053215153403
Energy: 0.5010214714810092
Energy: 0.548105321512804
Energy: 0.513942947949957
Energy: 0.5647092386085165
Energy: 0.5778859735597899
Energy: 0.5647092386085165
Energy: 0.5478094628145763
Energy: 0.5497414937796705
Energy: 0.5010657527227594
Energy: 0.5497414937813615
Energy: 0.5015877416740699
Energy: 0.5893713393825777
Energy: 0.5888601355281063
Energy: 0.5893713393834231
Energy: 0.6523178315470267
Energy: 0.5201511004285018
Energy: 0.5103233831702569
Energy: 0.5201511004285018
Energy: 0.5160868927972618
Energy: 0.5166892757033402
Energy: 0.6717138963430319
Energy: 0.5166892757024947
Energy: 0.5152873796803744
Energy: 0.5202079245618839
Energy: 0.5102492483291042
Energy: 0.5202079245644202
Energy: 0.5011464293349703
Energy: 0.5893444521919073
Energy: 0.7280074967379688
Energy: 0.5893444521935983
Energy: 0.5501357655718917
Energy: 0.5497352271892076
Energy: 0.5010316119753299
Energy: 0.5497352271900531
Energy: 0.5139231436981649
Energy: 0.5646558961263036
Energy: 0.6165571103108424
Energy: 0.564655896127149
Energy: 0.5116042944461917
Energy: 0.5480994818634134
Energy: 0.5012690568234505
Energy: 0.5480994818617224
Energy: 0.5017719967474685
Energy: 0.5617675923270409
Energy: 0.5066902100581033
Energy: 0.5617675923270409

minimum gb energy = 0.5010214714810092 eV
minimum distance =  2.57226041337532 Angstroms
sigma value = 17


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

Energy: 0.5232675969411289
Energy: 0.5240026768335395
Energy: 0.8235263058804357
Energy: 0.5240026768330169
Energy: 0.5928179036527906
Energy: 0.5187235962078472
Energy: 0.5141211307519196
Energy: 0.5187235962083698
Energy: 0.5097535006351603
Energy: 0.5641152616523669
Energy: 0.6306263043595145
Energy: 0.5641152616528895
Energy: 0.6702147252896947
Energy: 0.6024870011785646
Energy: 0.5095961474376894
Energy: 0.6024870011790872
Energy: 0.5133146507807239
Energy: 0.6067873933723499
Energy: 0.6475445298882884
Energy: 0.6067873933707824
Energy: 0.5190409617022759
Energy: 0.6853244130073172
Energy: 0.5146303361369718
Energy: 0.685324413006272
Energy: 0.5265952185056432
Energy: 0.5454427830416164
Energy: 0.5189233092498527
Energy: 0.5454427830410938
Energy: 0.5098892714512993
Energy: 0.619092221461941
Energy: 0.5109653152718523
Energy: 0.6190922214629861
Energy: 0.5189849171253826
Energy: 0.6111843635955927
Energy: 0.5511587121458863
Energy: 0.6111843635955927
Energy: 0.5186032575067248
Energy: 0.6183643544406449
Energy: 0.5170855527447614
Energy: 0.6183643544406449
Energy: 0.5142486970667388
Energy: 0.6099678560790132
Energy: 0.5166096210437867
Energy: 0.6099678560784907
Energy: 0.506540127351437
Energy: 0.5412276217342364
Energy: 0.5065744578368936
Energy: 0.5412276217326688
Energy: 0.5286945586427962
Energy: 0.6139247683791733
Energy: 0.512176268819684
Energy: 0.6139247683802185
Energy: 0.5258925728906236
Energy: 0.5525092682155185
Energy: 0.5238384504363968
Energy: 0.5525092682155185
Energy: 0.5236039254139072
Energy: 0.6041793974505731
Energy: 0.5288416813204931
Energy: 0.6041793974500507
Energy: 0.5150835650538568
Energy: 0.5642039141379088
Energy: 0.6456559211696119
Energy: 0.5642039141368637
Energy: 0.5128382359503201
Energy: 0.6040859237159067
Energy: 0.5123127428015424
Energy: 0.6040859237153843
Energy: 0.5067161419517886
Energy: 0.5685499394734125
Energy: 0.5494362454359305
Energy: 0.5685499394723674
Energy: 0.5874713283191911
Energy: 0.5968223115405257
Energy: 0.5142203260720124
Energy: 0.5968223115405257
Energy: 0.5116376904291486
Energy: 0.5193489797330882
Energy: 0.6134165203286865
Energy: 0.5193489797320432
Energy: 0.6527751310234211
Energy: 0.5769465845053504
Energy: 0.5237313742333785
Energy: 0.576946584506918
Energy: 0.5222528212620041
Energy: 0.6203393003534393
Energy: 0.6524113207424691
Energy: 0.6203393003534393
Energy: 0.592835445487525
Energy: 0.6070751852004425
Energy: 0.5132721979419006
Energy: 0.6070751852009649
Energy: 0.5140595046452948
Energy: 0.5997279062337618
Energy: 0.5892703791166718
Energy: 0.5997279062327168
Energy: 0.5632360190223163
Energy: 0.5681122669034956
Energy: 0.5077566752958569
Energy: 0.568112266902973
Energy: 0.5134233483034245
Energy: 0.5531293701807882
Energy: 0.5127284994018123
Energy: 0.5531293701813109
Energy: 0.5821953786210308
Energy: 0.6149964735475028
Energy: 0.516017403142815
Energy: 0.6149964735475028
Energy: 0.531533990416792
Energy: 0.6046280501490199
Energy: 0.5240716139907132
Energy: 0.6046280501511101
Energy: 0.5236777064609305
Energy: 0.5524997950723374
Energy: 0.5253098926287261
Energy: 0.5524997950697246
Energy: 0.5131938020455616
Energy: 0.6148861279258272
Energy: 0.5303889176989972
Energy: 0.614886127924782
Energy: 0.5069436492871919
Energy: 0.5515739291870958
Energy: 0.506531799904595
Energy: 0.5515739291865731
Energy: 0.5165902540299265
Energy: 0.609548354612843
Energy: 0.5128771960290519
Energy: 0.6095483546117978
Energy: 0.5161295184947684
Energy: 0.6182938141526048
Energy: 0.5941573031854592
Energy: 0.6182938141520822
Energy: 0.5494515258539234
Energy: 0.610965874098529
Energy: 0.5175267411399498
Energy: 0.610965874098529
Energy: 0.510410348396462
Energy: 0.6195700071538733
Energy: 0.5300426719516979
Energy: 0.619570007153351
Energy: 0.5189557463964369
Energy: 0.5460964895678966
Energy: 0.5254402359543795
Energy: 0.5460964895689417
Energy: 0.5130892554925821
Energy: 0.6983513575548219
Energy: 0.518939199347982
Energy: 0.6983513575553445
Energy: 0.6459582772876846
Energy: 0.6070388494389661
Energy: 0.5145294015350194
Energy: 0.6070388494400112

minimum gb energy = 0.506531799904595 eV
minimum distance =  2.51744761404484 Angstroms
sigma value = 89


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

Energy: 0.4671005809459349
Energy: 0.46749078473178973
Energy: 0.8523528680090637
Energy: 0.46749078473178973
Energy: 0.4678807434222987
Energy: 0.4814982557878856
Energy: 0.4783011063882581
Energy: 0.4814982557878856
Energy: 0.47613735599069723
Energy: 0.6707048185006609
Energy: 0.7818462213379631
Energy: 0.6707048185006609
Energy: 0.5273090691333443
Energy: 0.48151912400345365
Energy: 0.47775779129966167
Energy: 0.48151912400345365
Energy: 0.4763508314944405
Energy: 0.641904616989367
Energy: 0.6169484392560564
Energy: 0.641904616989367
Energy: 0.476109467205163
Energy: 0.46780104586149235
Energy: 0.4701252682058994
Energy: 0.46780104586149235
Energy: 0.476121694436614
Energy: 0.5508742023090748
Energy: 0.467849474958621
Energy: 0.5508742023090748
Energy: 0.49435202130098754
Energy: 0.6419181533937649
Energy: 0.4779442346947498
Energy: 0.6419181533951321
Energy: 0.47636206869446396
Energy: 0.5116967984616377
Energy: 0.4855175831398379
Energy: 0.5116967984616377
Energy: 0.4824903660967181
Energy: 0.46740604924962226
Energy: 0.47678282349006745
Energy: 0.4674060492523568
Energy: 0.46726490193236575
Energy: 0.4815191155192224
Energy: 0.47599557372339435
Energy: 0.4815191155192224
Energy: 0.467378568211057
Energy: 0.5487719186801636
Energy: 0.47807906471412037
Energy: 0.5487719186787964
Energy: 0.4761700861542267
Energy: 0.4674917706509765
Energy: 0.5056157983777565
Energy: 0.46749177066051634
Energy: 0.4765462136332124
Energy: 0.5101703476758952
Energy: 0.476478781182239
Energy: 0.5101703476758952
Energy: 0.4950655107695312
Energy: 0.46746814825278704
Energy: 0.4762041302762137
Energy: 0.46746814825278704

minimum gb energy = 0.4671005809459349 eV
minimum distance =  2.58012259896195 Angstroms
sigma value = 13


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

Energy: 0.48355441700136714
Energy: 0.5970867676642331
Energy: 0.657285973025115
Energy: 0.5970867676630869
Energy: 0.5387374675102276
Energy: 0.6028645606393119
Energy: 0.46954921216664147
Energy: 0.6028645606416042
Energy: 0.4704745712103585
Energy: 0.5972188858249912
Energy: 0.5655425633072922
Energy: 0.5972188858272834
Energy: 0.4698039749408921
Energy: 0.6046172221497188
Energy: 0.46829819375245746
Energy: 0.6046172221491457
Energy: 0.47460376638699636
Energy: 0.5973933299417019
Energy: 0.5140820743817969
Energy: 0.5973933299319598
Energy: 0.46988681104792196
Energy: 0.5417454644065476
Energy: 0.47531430559012067
Energy: 0.5417454644099859
Energy: 0.47546252727597593
Energy: 0.5960342581418976
Energy: 0.6700142403739221
Energy: 0.5960342581373129
Energy: 0.4707677579688506
Energy: 0.60264162436188
Energy: 0.47524411498519
Energy: 0.6026416243572954
Energy: 0.47503335214785714
Energy: 0.6241408128181506
Energy: 0.5670758159614259
Energy: 0.6241408128233082
Energy: 0.5470693089507467
Energy: 0.6035071952736777
Energy: 0.46845109698122694
Energy: 0.6035071952765431
Energy: 0.4744428264613318
Energy: 0.5708068219273279
Energy: 0.4704154549701297
Energy: 0.5708068219250356
Energy: 0.6061653947783164
Energy: 0.6891599920465294
Energy: 0.4725175141424013
Energy: 0.6891599920436902
Energy: 0.49034780432910374
Energy: 0.5394994244086879
Energy: 0.48903068814091577
Energy: 0.5394994244075418
Energy: 0.5970241865186484
Energy: 0.6376886491269995
Energy: 0.4718322035073819
Energy: 0.6376886491298649
Energy: 0.4774389113066412
Energy: 0.6424331614583093
Energy: 0.4778341391317292
Energy: 0.642433161456017
Energy: 0.4694685123427995
Energy: 0.5696869376979422
Energy: 0.4661283531501501
Energy: 0.5696869376996614
Energy: 0.4772672831237581
Energy: 0.5545716050168751
Energy: 0.46645385792548877
Energy: 0.554571605016302
Energy: 0.48754700764825787
Energy: 0.6235597605976707
Energy: 0.47379768519652443
Energy: 0.6235597605976707
Energy: 0.4776027311933608
Energy: 0.5950829256472209
Energy: 0.4740509450703383
Energy: 0.595082925647794
Energy: 0.47694941921246425
Energy: 0.5950137617045702
Energy: 0.4737602253286222
Energy: 0.5950137617062894
Energy: 0.4878771446034351
Energy: 0.6236348823312005
Energy: 0.47389001176472095
Energy: 0.6236348823340658
Energy: 0.47744190839395817
Energy: 0.5546678075520094
Energy: 0.46640955676526263
Energy: 0.5546678075508633
Energy: 0.4695128014057406
Energy: 0.569771885391553
Energy: 0.46619895152084867
Energy: 0.5697718853909799
Energy: 0.477423923466489
Energy: 0.6420626693064212
Energy: 0.475190818828278
Energy: 0.6420626693047019
Energy: 0.597147642498018
Energy: 0.6377851166697797
Energy: 0.47183056202534424
Energy: 0.6377851166755104
Energy: 0.49033188929930066
Energy: 0.539883657097786
Energy: 0.47125834074727296
Energy: 0.5398836570989322
Energy: 0.6042826758605715
Energy: 0.6891339967847441
Energy: 0.4721989066402691
Energy: 0.6891339967830249
Energy: 0.4774639516429346
Energy: 0.5709562034835524
Energy: 0.4677595498291515
Energy: 0.5709562034869908
Energy: 0.5473123560385985
Energy: 0.6041375294508803
Energy: 0.4684261748411986
Energy: 0.6041375294525995
Energy: 0.47740478614656034
Energy: 0.6242566176989603
Energy: 0.5353593810849108
Energy: 0.6242566177006795
Energy: 0.47096402729197473
Energy: 0.6026771941787934
Energy: 0.47519244294230706
Energy: 0.6026771941747818
Energy: 0.47480059929710383
Energy: 0.5960063813274391
Energy: 0.5962418127459567
Energy: 0.5960063813303045
Energy: 0.46965213598593786
Energy: 0.5415178222368763
Energy: 0.4751954138538407
Energy: 0.54151782223573
Energy: 0.47503594004962085
Energy: 0.5974700692685112
Energy: 0.5921632938303899
Energy: 0.5974700692833851
Energy: 0.4694997261582
Energy: 0.6046223118313143
Energy: 0.46808126789921445
Energy: 0.604622311829022

minimum gb energy = 0.4661283531501501 eV
minimum distance =  2.51759714242983 Angstroms
sigma value = 37


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

Energy: 0.44676246625286964
Energy: 0.4473141486168896
Energy: 0.6604163928120624
Energy: 0.4473141486168896
Energy: 0.6767514904396501
Energy: 0.5783792537401556
Energy: 0.4356526265227897
Energy: 0.5783792537401556
Energy: 0.4298058833168125
Energy: 0.6849596405752536
Energy: 0.6107008857304179
Energy: 0.6849596405752536
Energy: 0.4304338690013749
Energy: 0.5509452454907307
Energy: 0.43571373755209925
Energy: 0.5509452454907307
Energy: 0.43466514006665985
Energy: 0.5462684745671875
Energy: 0.5100303221073312
Energy: 0.5462684745671875
Energy: 0.4342486683158543
Energy: 0.5782953552156348
Energy: 0.4313980805732663
Energy: 0.5782953552156348
Energy: 0.43568119644707054
Energy: 0.7102992346591227
Energy: 0.5470451123108914
Energy: 0.7102992346591227
Energy: 0.43517247653566343
Energy: 0.4473794992430249
Energy: 0.4487445371012649
Energy: 0.4473794992430249
Energy: 0.4346860224001322
Energy: 0.5783641641205781
Energy: 0.6070143424586832
Energy: 0.5783641641205781
Energy: 0.5941156302858861
Energy: 0.6506486498246365
Energy: 0.4312464197785193
Energy: 0.6506486498246365
Energy: 0.4348477855439914
Energy: 0.7054018410922797
Energy: 0.4302012931371483
Energy: 0.7054018410922797
Energy: 0.5491531258124502
Energy: 0.5462255020357234
Energy: 0.4358087445499602
Energy: 0.5462255020367094
Energy: 0.43013690147059797
Energy: 0.5783021805246327
Energy: 0.43419587927425757
Energy: 0.5783021805256187
Energy: 0.5391276377585
Energy: 0.6611443059414512
Energy: 0.4352905362113682
Energy: 0.6611443059414512
Energy: 0.44699186471323366
Energy: 0.466662012778242
Energy: 0.43512596861404107
Energy: 0.4666620127792279
Energy: 0.44757340650392285
Energy: 0.5783034479939071
Energy: 0.43571121550601183
Energy: 0.578303447994893
Energy: 0.4300531461084804
Energy: 0.6936465899664872
Energy: 0.447718099624768
Energy: 0.6936465899664872
Energy: 0.43006374040264983
Energy: 0.7057535150359039
Energy: 0.4351657211655433
Energy: 0.7057535150359039
Energy: 0.43491900098607367
Energy: 0.5462341451437398
Energy: 0.4353854566575871
Energy: 0.5462341451437398
Energy: 0.4356048065453074
Energy: 0.5783172294938059
Energy: 0.43000041742163286
Energy: 0.5783172294938059

minimum gb energy = 0.4298058833168125 eV
minimum distance =  2.57004574593801 Angstroms
sigma value = 25


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

Energy: 0.4268073622677091
Energy: 0.560734906208176
Energy: 0.5951909800192244
Energy: 0.5607349062097159
Energy: 0.6559973485599477
Energy: 0.5649221183005607
Energy: 0.4091925820487701
Energy: 0.5649221183005607
Energy: 0.4048600800465227
Energy: 0.405232086266447
Energy: 0.5546953724565176
Energy: 0.4052320862656772
Energy: 0.4782018380396977
Energy: 0.5645289028732795
Energy: 0.40894198780904195
Energy: 0.5645289028740496
Energy: 0.4082304829736546
Energy: 0.5642281058882063
Energy: 0.4582464192161702
Energy: 0.5642281058882063
Energy: 0.3977911379121459
Energy: 0.5648821893657088
Energy: 0.4093092075082265
Energy: 0.5648821893657088
Energy: 0.4099273713903023
Energy: 0.48300311624349046
Energy: 0.45569881004417195
Energy: 0.4830031162427205
Energy: 0.40009387802010243
Energy: 0.5001221519852342
Energy: 0.40604305370517124
Energy: 0.5001221519852342
Energy: 0.4081469516263314
Energy: 0.5644214114014279
Energy: 0.5967014275917092
Energy: 0.5644214114029676
Energy: 0.40096742906318983
Energy: 0.5602874590308752
Energy: 0.42801816429457396
Energy: 0.5602874590308752
Energy: 0.40992918178874543
Energy: 0.4821455345895844
Energy: 0.5587576387526799
Energy: 0.4821455345895844
Energy: 0.5251352795383998
Energy: 0.5763429742245771
Energy: 0.4059477842858409
Energy: 0.5763429742245771
Energy: 0.4089750918484447
Energy: 0.5648163347831086
Energy: 0.5224567410982945
Energy: 0.5648163347823387
Energy: 0.5052751875573996
Energy: 0.5625755844220862
Energy: 0.4092099356177625
Energy: 0.5625755844205464
Energy: 0.409956953762383
Energy: 0.4818409961912682
Energy: 0.3978361557246853
Energy: 0.4818409961912682
Energy: 0.50488457776366
Energy: 0.6433638709495251
Energy: 0.40858005855187907
Energy: 0.643363870950295
Energy: 0.40910340736653966
Energy: 0.49955224666975
Energy: 0.40020370826278695
Energy: 0.49955224666898007
Energy: 0.4895945163511568
Energy: 0.5654414136671733
Energy: 0.4088789712535019
Energy: 0.5654414136664033
Energy: 0.4299553955337331
Energy: 0.5599240526098697
Energy: 0.40101898482922543
Energy: 0.5599240526098697
Energy: 0.5588587940755076
Energy: 0.6096913399818125
Energy: 0.40861023023055937
Energy: 0.6096913399818125
Energy: 0.40894895437817674
Energy: 0.5756979737138457
Energy: 0.40821069590709946
Energy: 0.5756979737146156
Energy: 0.4055408172292471
Energy: 0.5651866021525029
Energy: 0.4087339116315228
Energy: 0.5651866021525029
Energy: 0.4098693856217514
Energy: 0.5631853075647562
Energy: 0.5052964525775726
Energy: 0.563185307565526
Energy: 0.39787752222282247
Energy: 0.6074429000995825
Energy: 0.4091150396300158
Energy: 0.6074429000995825
Energy: 0.40884461720619664
Energy: 0.6422901541798697
Energy: 0.5045878691960134
Energy: 0.6422901541790997
Energy: 0.4008992915810853
Energy: 0.49924127517452516
Energy: 0.40531140849918273
Energy: 0.49924127517452516

minimum gb energy = 0.3977911379121459 eV
minimum distance =  2.5304519658599 Angstroms
sigma value = 41


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

Energy: 0.5067583908877834
Energy: 0.5056083726894305
Energy: 0.8357587137765858
Energy: 0.5056083726894305
Energy: 0.6406712682229373
Energy: 0.5018687679417818
Energy: 0.37590828083526934
Energy: 0.5018687679417818
Energy: 0.38524833941108644
Energy: 0.49860716969030827
Energy: 0.5026738680076429
Energy: 0.49860716969030827
Energy: 0.4990620311679914
Energy: 0.5017960478809046
Energy: 0.375918188169735
Energy: 0.5017960478809046
Energy: 0.37287340309839073
Energy: 0.5134398286681404
Energy: 0.41287566029933254
Energy: 0.5134398286675094
Energy: 0.43522467885933036
Energy: 0.502329767083157
Energy: 0.3758028031653245
Energy: 0.5023297670825257
Energy: 0.3753016892289154
Energy: 0.5014682188291517
Energy: 0.41520997759042755
Energy: 0.5014682188291517
Energy: 0.36919768346245746
Energy: 0.44562856239294485
Energy: 0.3735322965572198
Energy: 0.44562856239294485
Energy: 0.3774489861028683
Energy: 0.5701583160105722
Energy: 0.5873830827969886
Energy: 0.570158316009941
Energy: 0.37151974375313734
Energy: 0.499160675815995
Energy: 0.3858979923803597
Energy: 0.499160675815995
Energy: 0.37527048321073203
Energy: 0.5013435230032837
Energy: 0.5658249820232047
Energy: 0.5013435230026526
Energy: 0.3713405525487047
Energy: 0.5062262206656998
Energy: 0.5050433947363003
Energy: 0.506226220666331
Energy: 0.37744520950028215
Energy: 0.5656530773410317
Energy: 0.6241110392118837
Energy: 0.5656530773397692
Energy: 0.47185366084756847
Energy: 0.6115524269135656
Energy: 0.38589298164546376
Energy: 0.6115524269141968
Energy: 0.37541508951988506
Energy: 0.5018150935272325
Energy: 0.4993543783318014
Energy: 0.5018150935278638
Energy: 0.4631295272386332
Energy: 0.509486879193649
Energy: 0.3735084848332536
Energy: 0.509486879193649
Energy: 0.37750932773632734
Energy: 0.5623412407953969
Energy: 0.500270096080532
Energy: 0.5623412407947657
Energy: 0.4614324682644588
Energy: 0.6214559085056914
Energy: 0.3759143829465646
Energy: 0.6214559085056914
Energy: 0.3753665347175748
Energy: 0.4461337024106272
Energy: 0.3691498250808324
Energy: 0.44613370240999606
Energy: 0.45672812828083603
Energy: 0.5706248285343827
Energy: 0.377558114510214
Energy: 0.5706248285343827
Energy: 0.3878165581067546
Energy: 0.5642939811474017
Energy: 0.3738948426308406
Energy: 0.5642939811480329
Energy: 0.565465600448917
Energy: 0.6244566054202543
Energy: 0.37583327250447557
Energy: 0.6244566054202543
Energy: 0.505092560498836
Energy: 0.5061326830880504
Energy: 0.3713880446551342
Energy: 0.5061326830880504
Energy: 0.5056525341409758
Energy: 0.5642828163413791
Energy: 0.37730123587102615
Energy: 0.5642828163413791
Energy: 0.3876150065617194
Energy: 0.6237519657462988
Energy: 0.37633295022527014
Energy: 0.62375196574693
Energy: 0.4991055050031748
Energy: 0.6141188281165914
Energy: 0.37592983861901486
Energy: 0.6141188281159602
Energy: 0.3754449497858959
Energy: 0.5098131946138132
Energy: 0.4630531019038924
Energy: 0.5098131946144443
Energy: 0.37323422449726396
Energy: 0.5628115244991272
Energy: 0.3793912021097972
Energy: 0.5628115244997584
Energy: 0.3774372569015575
Energy: 0.6252958134344127
Energy: 0.461075640778041
Energy: 0.6252958134350439
Energy: 0.3693050316568658
Energy: 0.5806058813137469
Energy: 0.37829054412597046
Energy: 0.5806058813143782
Energy: 0.37694944319248086
Energy: 0.5711812920612949
Energy: 0.45645850324879444
Energy: 0.5711812920612949
Energy: 0.37160505266634086
Energy: 0.5646652986790031
Energy: 0.39035008369154517
Energy: 0.5646652986802654

minimum gb energy = 0.3691498250808324 eV
minimum distance =  2.53096828177081 Angstroms
sigma value = 15


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

Energy: 0.46648350025189617
Energy: 0.5614998603463806
Energy: 0.5063417523419548
Energy: 0.5614998603453111
Energy: 0.6234923064101373
Energy: 0.5154641722188466
Energy: 0.35676381816488173
Energy: 0.5154641722193813
Energy: 0.36712435241101643
Energy: 0.45723193672461915
Energy: 0.40732084126925144
Energy: 0.45723193672515383
Energy: 0.6332610164307454
Energy: 0.5160915848617064
Energy: 0.3565930399433848
Energy: 0.5160915848617064
Energy: 0.35457962004270277
Energy: 0.5260699475922859
Energy: 0.38626292937829015
Energy: 0.5260699475922859
Energy: 0.45298013512986823
Energy: 0.5137258971738935
Energy: 0.35666146058584114
Energy: 0.5137258971738935
Energy: 0.3563539179404223
Energy: 0.46201505838551477
Energy: 0.3839702055942763
Energy: 0.46201505838551477
Energy: 0.40046985202997404
Energy: 0.4621303315082618
Energy: 0.35660834659315654
Energy: 0.4621303315082618
Energy: 0.35773326542087885
Energy: 0.5746688854461519
Energy: 0.505946804136821
Energy: 0.5746688854450825
Energy: 0.34555388937635045
Energy: 0.5138633241054334
Energy: 0.3549534383533941
Energy: 0.5138633241075721
Energy: 0.3563534937087924
Energy: 0.5159702968546198
Energy: 0.5254510853041087
Energy: 0.5159702968540851
Energy: 0.34673665165829726
Energy: 0.45710403358650326
Energy: 0.3676184119593885
Energy: 0.45710403358650326
Energy: 0.35790350166080104
Energy: 0.5645848679942446
Energy: 0.5857195016396244
Energy: 0.5645848679947791
Energy: 0.3469271740904767
Energy: 0.5661618252379589
Energy: 0.46597687122271064
Energy: 0.5661618252363547
Energy: 0.35622254758287436
Energy: 0.5152876671218515
Energy: 0.5688427196699012
Energy: 0.5152876671218515
Energy: 0.43023301454315394
Energy: 0.4572309845059949
Energy: 0.3675390810444454
Energy: 0.4572309845033214
Energy: 0.35786502788149027
Energy: 0.5674150706856228
Energy: 0.5401094716582514
Energy: 0.5674150706866922
Energy: 0.4269418354451213
Energy: 0.5873341895631994
Energy: 0.3550133582366013
Energy: 0.5873341895637342
Energy: 0.3562939499175929
Energy: 0.5136124278613062
Energy: 0.45285697288789273
Energy: 0.513612427861841
Energy: 0.42536030986174805
Energy: 0.46124476938964404
Energy: 0.35672663301184526
Energy: 0.46124476938803993
Energy: 0.35791442673269874
Energy: 0.5251836803692921
Energy: 0.42826132952120916
Energy: 0.5251836803682227
Energy: 0.4215923776795096
Energy: 0.5760637363503004
Energy: 0.3597213546596979
Energy: 0.5760637363497657
Energy: 0.35630585247620306
Energy: 0.5134751582373918
Energy: 0.3453456934618682
Energy: 0.5134751582373918
Energy: 0.525613101153348
Energy: 0.5168122485383518
Energy: 0.35666907549578675
Energy: 0.5168122485372824
Energy: 0.36894861979813937
Energy: 0.5252674000036487
Energy: 0.3469321287874866
Energy: 0.5252674000057875
Energy: 0.5177798370805301
Energy: 0.5709523258327304
Energy: 0.35956039564712283
Energy: 0.5709523258321957
Energy: 0.46610174183197983
Energy: 0.5642626889498534
Energy: 0.3467733486263325
Energy: 0.5642626889493187
Energy: 0.5689855269106443
Energy: 0.5147720967950871
Energy: 0.3567221283318093
Energy: 0.5147720967950871
Energy: 0.3687405912574235
Energy: 0.6003238557626648
Energy: 0.3504114386995792
Energy: 0.6003238557599911
Energy: 0.4569660167288857
Energy: 0.5650649416577966
Energy: 0.3596374739417159
Energy: 0.565064941657262
Energy: 0.3563343972372327
Energy: 0.5725607813263528
Energy: 0.426677566210519
Energy: 0.5725607813258182
Energy: 0.45297450404780926
Energy: 0.5132593515267523
Energy: 0.3567391698564126
Energy: 0.5132593515256829
Energy: 0.357796506131925
Energy: 0.5873326398623663
Energy: 0.4250824829215476
Energy: 0.5873326398623663
Energy: 0.34746566091567016
Energy: 0.5244353492491444
Energy: 0.35960540047054657
Energy: 0.5244353492502137
Energy: 0.3547959186422064
Energy: 0.5731554967934894
Energy: 0.4216442367719461
Energy: 0.573155496794024
Energy: 0.3453116504369468
Energy: 0.5156186142582548
Energy: 0.35816246099333243
Energy: 0.515618614259859
Energy: 0.35785217253022417
Energy: 0.5869858505461899
Energy: 0.5254891319624787
Energy: 0.5869858505472594

minimum gb energy = 0.3453116504369468 eV
minimum distance =  2.57008129376418 Angstroms
sigma value = 85


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

Energy: 0.47016955994847087
Energy: 0.5408688595880297
Energy: 0.81733070987068
Energy: 0.5408688595880297
Energy: 0.6296438841729067
Energy: 0.45625772361648104
Energy: 0.3275551658183769
Energy: 0.45625772361648104
Energy: 0.4520726568350752
Energy: 0.4298783937623726
Energy: 0.4239403136943153
Energy: 0.4298783937628363
Energy: 0.5926705919841554
Energy: 0.4791425874064878
Energy: 0.3275608725383843
Energy: 0.4791425874055602
Energy: 0.3668705397872424
Energy: 0.4451718477882808
Energy: 0.40233923197178034
Energy: 0.44517184779059954
Energy: 0.4851042789372518
Energy: 0.4291953154018348
Energy: 0.3276320047443684
Energy: 0.4291953154013711
Energy: 0.350174718382958
Energy: 0.4316926864113931
Energy: 0.4010117493783574
Energy: 0.4316926864118568
Energy: 0.4323465167470532
Energy: 0.47889275834201106
Energy: 0.3316563760727543
Energy: 0.4788927583434023
Energy: 0.3312871867216322
Energy: 0.41642952817140044
Energy: 0.4777454968542089
Energy: 0.41642952817232803
Energy: 0.38278109478730504
Energy: 0.42743599462729603
Energy: 0.35052803206523453
Energy: 0.42743599462451354
Energy: 0.32818159739836283
Energy: 0.4820484229696199
Energy: 0.49647409247543095
Energy: 0.4820484229700836
Energy: 0.33738627781417524
Energy: 0.4809383752192242
Energy: 0.36725461658147684
Energy: 0.48093837522061544
Energy: 0.3274994453839453
Energy: 0.41650986123366546
Energy: 0.5588621834939284
Energy: 0.416509861234593
Energy: 0.31642261563743396
Energy: 0.45057881914475106
Energy: 0.4503801644118396
Energy: 0.4505788191470698
Energy: 0.3282204082793575
Energy: 0.4793006150185786
Energy: 0.5734416054426474
Energy: 0.4793006150199699
Energy: 0.3143646046104572
Energy: 0.5065882079995155
Energy: 0.44051484112677886
Energy: 0.5065882079995155
Energy: 0.3272060446934114
Energy: 0.41669102745487796
Energy: 0.5691129917375053
Energy: 0.41669102745441416
Energy: 0.38566666805776384
Energy: 0.4505450057945977
Energy: 0.4502232680327074
Energy: 0.4505450057955252
Energy: 0.32817585255217635
Energy: 0.47900476442361534
Energy: 0.5319728047927881
Energy: 0.4790047644259341
Energy: 0.38489586277329657
Energy: 0.4330694699256259
Energy: 0.3671688047391271
Energy: 0.4330694699283873
Energy: 0.3280938006730323
Energy: 0.4002850114797338
Energy: 0.5086452645540955
Energy: 0.40028501147834256
Energy: 0.4073511877488197
Energy: 0.42625263731109686
Energy: 0.3505210093715908
Energy: 0.4262526373101693
Energy: 0.3324935664299136
Energy: 0.4791047727326276
Energy: 0.4324109572423455
Energy: 0.47910477273123636
Energy: 0.40675914466889773
Energy: 0.5194732259322666
Energy: 0.3317376420824786
Energy: 0.5194732259313392
Energy: 0.35143444926853407
Energy: 0.4031142215645302
Energy: 0.4070007443371427
Energy: 0.40311422156638527
Energy: 0.49646082341175807
Energy: 0.4821195009903302
Energy: 0.3283605171251457
Energy: 0.4821195009880115
Energy: 0.3682387268818363
Energy: 0.5046184026500943
Energy: 0.3373461876292896
Energy: 0.5046184026510218
Energy: 0.49871215595271096
Energy: 0.5161226260761853
Energy: 0.3280177244776245
Energy: 0.516122626076649
Energy: 0.45011868650940995
Energy: 0.4289294553226416
Energy: 0.31618240871511255
Energy: 0.4289294553226416
Energy: 0.5735930827250842
Energy: 0.4792044277829784
Energy: 0.3284539792476841
Energy: 0.47920442778436967
Energy: 0.46877342434806607
Energy: 0.5377325329060606
Energy: 0.31473361523449855
Energy: 0.5377325329055969
Energy: 0.5439350322044093
Energy: 0.5351489955861526
Energy: 0.3277358393222049
Energy: 0.5351489955870802
Energy: 0.4501661027384473
Energy: 0.42941258476234495
Energy: 0.3166992075693335
Energy: 0.42941258475909877
Energy: 0.5320191475439127
Energy: 0.47916249993314136
Energy: 0.32859944085811527
Energy: 0.47916249993314136
Energy: 0.36818175033840045
Energy: 0.48952656179491577
Energy: 0.3848398014828467
Energy: 0.48952656179445203
Energy: 0.44004751645861095
Energy: 0.5201649237095188
Energy: 0.32890546115287844
Energy: 0.5201649237062725
Energy: 0.351414734870716
Energy: 0.4259109600288849
Energy: 0.40658683349204244
Energy: 0.42591096002658724
Energy: 0.43233040381912813
Energy: 0.47922415841046745
Energy: 0.33137791154448976
Energy: 0.4792241584095399
Energy: 0.332492531327573
Energy: 0.539872020333808
Energy: 0.4058549917045655
Energy: 0.539872020333808
Energy: 0.3406458455346583
Energy: 0.5017201844574002
Energy: 0.35036246629500223
Energy: 0.5017201844578639
Energy: 0.32754239537489077
Energy: 0.4815341015897081
Energy: 0.4964997686557069
Energy: 0.4815341015906356
Energy: 0.33677977129696207
Energy: 0.5044172706000223
Energy: 0.36770854804250674
Energy: 0.5044172706004861
Energy: 0.3289128809195324
Energy: 0.539623292746326
Energy: 0.498791625287921
Energy: 0.5396232927453986

minimum gb energy = 0.3143646046104572 eV
minimum distance =  2.56289429692082 Angstroms
sigma value = 113


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

Energy: 0.011811654726137169
Energy: 0.012392683962586998
Energy: 0.892368214332745
Energy: 0.012392683962586998
Energy: 0.678131763955454
Energy: 0.17551717654564428
Energy: 0.17601249102482447
Energy: 0.17551717654459453
Energy: 0.011811654726137169
Energy: 0.012392683962943506
Energy: 0.8923682143310021
Energy: 0.012392683962586998
Energy: 0.6781317639551173
Energy: 0.17551717654564428
Energy: 0.17601249102446798
Energy: 0.17551717654423804
Energy: 0.011811654726137169
Energy: 0.012392683962943506
Energy: 0.8923682143324083
Energy: 0.012392683962586998
Energy: 0.678131763955454
Energy: 0.17551717654564428
Energy: 0.17601249102482447
Energy: 0.17551717654423804

minimum gb energy = 0.011811654726137169 eV
minimum distance =  2.82883861320811 Angstroms
sigma value = 1