Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.063553899526596
cohesive_energy=2.9605994760773475
mass=107.8682
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=[1.067777026435836e-19, 1.60671079387422e-19, 2.03966698568004e-19, 2.40794330677128e-19, 2.72206605763332e-19, 2.99573384848686e-19, 3.23638077891366e-19, 3.4490376835444795e-19, 3.63746967746922e-19, 3.80454465686274e-19, 3.9526178213770194e-19, 4.0836278047391995e-19, 4.1995292624427596e-19, 4.3027895465040597e-19, 4.395219116519519e-19, 4.4756003182473e-19, 4.54324421573478e-19, 4.599384484990139e-19, 4.6452067367225395e-19, 4.68157614631434e-19, 4.70906949735378e-19, 4.7281834645974e-19, 4.739382679269059e-19, 4.74303564199458e-19, 4.739094287474939e-19, 4.72635698323464e-19, 4.70322155263968e-19, 4.66781344902828e-19, 4.61788962511284e-19, 4.55083853297994e-19, 4.463744211155699e-19, 4.353113914578e-19, 4.2137405691863396e-19, 4.03871879368818e-19, 3.8207106190998e-19, 3.55101622629858e-19, 3.2185325312108994e-19, 2.80916037945756e-19, 2.30492334920508e-19, 1.6835031199418399e-19, 9.181721810594519e-20, -3.3181078090139995e-21, -1.227616576150212e-19, -2.7341144259209996e-19, -4.649228200073879e-19, -7.108008571441979e-19, -1.0311064076368439e-18, -1.4538471212242799e-18, -2.0212259326227e-18, -2.8034886741732e-18, -3.90734030970018e-18, -5.51047824968058e-18, -7.91720390221002e-18, -1.1602658769867538e-17]
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: -1.75621268201409e-24 eV

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

Energy: 0.00903618834726688
Energy: 0.009401594478618491
Energy: 0.3800184282524577
Energy: 0.07640961423533842
Energy: 0.009401594478618491
Energy: 0.47218597983781024
Energy: 0.07640961423533842
Energy: 0.47218597983781024
Energy: 0.3800184282524577
Energy: 0.07640961423533842
Energy: 0.00903618834726688
Energy: 0.009401594478618491
Energy: 0.07640961423533842
Energy: 0.47218597983781024
Energy: 0.009401594478618491
Energy: 0.47218597983781024

minimum gb energy = 0.00903618834726688 eV
minimum distance =  2.8333334863376 Angstroms
sigma value = 1


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

Energy: 0.8141199809675717
Energy: 0.5700002365547355
Energy: 0.6008108820304724
Energy: 0.5993619157992109
Energy: 0.5764485507156659
Energy: 0.6297590667278407
Energy: 0.5730947350323393
Energy: 0.6297590667284153
Energy: 0.6003965880893153
Energy: 0.5994081875143614
Energy: 0.6761524551853945
Energy: 0.5994081875143614
Energy: 0.5756006386024418
Energy: 0.5722445691101302
Energy: 0.5732406339190411
Energy: 0.5722445691101302
Energy: 0.6638397651745052
Energy: 0.5731344274185066
Energy: 0.5742671840158681
Energy: 0.5731344274185066
Energy: 0.6009017372918641
Energy: 0.6310734786246761
Energy: 0.573072133973963
Energy: 0.6310734786246761
Energy: 0.5996480211719817
Energy: 0.6179408950068784
Energy: 0.5998395123379803
Energy: 0.6179408950068784
Energy: 0.6014536002040077
Energy: 0.6011333710733471
Energy: 0.6421968307880233
Energy: 0.6011333710733471
Energy: 0.6404145592679968
Energy: 0.6499291110551958
Energy: 0.6216990776584966
Energy: 0.6499291110551958
Energy: 0.6411247317068531
Energy: 0.6427023771255145
Energy: 0.6228470308927967
Energy: 0.6427023771255145
Energy: 0.6189625545215633
Energy: 0.6493975565296696
Energy: 0.62140558556099
Energy: 0.6493975565296696
Energy: 0.6018655549512281
Energy: 0.6491546198114142
Energy: 0.6445149363023613
Energy: 0.6491546198108121
Energy: 0.6046846972504659
Energy: 0.6174472401869031
Energy: 0.5765471329008106
Energy: 0.6174472401869031
Energy: 0.6107508588353978
Energy: 0.6158562683617622
Energy: 0.6099088161062446
Energy: 0.6158562683617622
Energy: 0.5761776813268173
Energy: 0.5722707701051437
Energy: 0.5731678421034445
Energy: 0.5722707701051437
Energy: 0.6033966560169747
Energy: 0.5727903797732674
Energy: 0.5725283182403286
Energy: 0.5727903797732674
Energy: 0.6002948468108478
Energy: 0.5991563355900279
Energy: 0.5670498775335938
Energy: 0.5991563355900279
Energy: 0.5730795406351058
Energy: 0.5760581548021746
Energy: 0.5772357567016201
Energy: 0.5760581548021746
Energy: 0.5726366757252258
Energy: 0.5997138120687323
Energy: 0.5999722168940053
Energy: 0.5997138120687323
Energy: 0.6349371968292132
Energy: 0.5721894189796037
Energy: 0.5755094225942277
Energy: 0.5721894189802058
Energy: 0.5737662128723489
Energy: 0.5731390210535688
Energy: 0.599006038416501
Energy: 0.5731390210535688
Energy: 0.5730281202057023
Energy: 0.5727065210114854
Energy: 0.6128986549552321
Energy: 0.5727065210114854
Energy: 0.6001055409340682
Energy: 0.6195095842665004
Energy: 0.6000298867011039
Energy: 0.6195095842665004
Energy: 0.6423731944798531
Energy: 0.6186976355047211
Energy: 0.6020660872751908
Energy: 0.6186976355047211
Energy: 0.6217941583043993
Energy: 0.6499664215981582
Energy: 0.6681214001808395
Energy: 0.6499664215981582
Energy: 0.6237253687762541
Energy: 0.6496904194851628
Energy: 0.6422075064428365
Energy: 0.6496904194851628
Energy: 0.6214275572800295
Energy: 0.6494363678369948
Energy: 0.6188814223283428
Energy: 0.6494363678369948
Energy: 0.6430635732203823
Energy: 0.6493580655427851
Energy: 0.6021319863422421
Energy: 0.6493580655427851
Energy: 0.5764261050061807
Energy: 0.6173013143817638
Energy: 0.6019820468573966
Energy: 0.6173013143817638
Energy: 0.6099647610145351
Energy: 0.6163331333162287
Energy: 0.611575119186363
Energy: 0.6163331333162287
Energy: 0.5723315802503615
Energy: 0.5722245228930747
Energy: 0.5766493551518362
Energy: 0.5722245228936768
Energy: 0.5724831817576774
Energy: 0.5726399380009304
Energy: 0.6035279929014303
Energy: 0.5726399380009304
Energy: 0.5667590343368116
Energy: 0.5994310330798577
Energy: 0.6010290795003121
Energy: 0.5994310330798577

minimum gb energy = 0.5667590343368116 eV
minimum distance =  2.64872383521347 Angstroms
sigma value = 1


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

Energy: 0.9215160433236498
Energy: 0.592898778518361
Energy: 0.6257118132051183
Energy: 0.6267166261702917
Energy: 0.6060735926100029
Energy: 0.6567338832640279
Energy: 0.5990779845490166
Energy: 0.6567338832640279
Energy: 0.6259625506796735
Energy: 0.6271179192594973
Energy: 0.7052164733971298
Energy: 0.6271179192594973
Energy: 0.600577670291068
Energy: 0.5977861630024053
Energy: 0.5989656177289299
Energy: 0.5977861630024053
Energy: 0.5979104680135705
Energy: 0.5986368175061215
Energy: 0.5982059779906436
Energy: 0.5986368175054353
Energy: 0.6469636085296678
Energy: 0.6416074952719469
Energy: 0.5991258991780608
Energy: 0.6416074952719469
Energy: 0.6346334044879346
Energy: 0.6513075328782514
Energy: 0.6316561373094979
Energy: 0.6513075328782514
Energy: 0.6345934877664863
Energy: 0.6447071288019534
Energy: 0.6761393625588507
Energy: 0.6447071288019534
Energy: 0.6328574674679313
Energy: 0.6834156915944108
Energy: 0.6503864669718911
Energy: 0.6834156915944108
Energy: 0.6753174045716249
Energy: 0.6841201572023524
Energy: 0.6341124177371268
Energy: 0.6841201572023524
Energy: 0.605291050131227
Energy: 0.6506512334979347
Energy: 0.6367001433618191
Energy: 0.6506512334979347
Energy: 0.6415182412091769
Energy: 0.6503789810369531
Energy: 0.6449673679870558
Energy: 0.6503789810369531
Energy: 0.5992553782511459
Energy: 0.5985538376713796
Energy: 0.6044937924713094
Energy: 0.5985538376713796
Energy: 0.5979756414818647
Energy: 0.5979682787122829
Energy: 0.6326559577303855
Energy: 0.5979682787122829
Energy: 0.5890276052828448
Energy: 0.626638693605801
Energy: 0.625271534886476
Energy: 0.626638693605801
Energy: 0.6046913536596531
Energy: 0.6018872953526978
Energy: 0.5985507025368957
Energy: 0.6018872953526978
Energy: 0.6262511214939356
Energy: 0.6273831240510335
Energy: 0.5971985491147711
Energy: 0.6273831240510335
Energy: 0.6020663012601113
Energy: 0.5981002295236338
Energy: 0.6697957396596201
Energy: 0.5981002295229474
Energy: 0.5982175847175661
Energy: 0.5979197301760645
Energy: 0.5994343261567819
Energy: 0.5979197301760645
Energy: 0.6470222542643789
Energy: 0.5983317522344239
Energy: 0.5991215350690331
Energy: 0.5983317522344239
Energy: 0.6342643450759412
Energy: 0.6535987295814452
Energy: 0.6316357078481791
Energy: 0.6535987295814452
Energy: 0.6324621449606637
Energy: 0.652247233297601
Energy: 0.6768184245921443
Energy: 0.652247233297601
Energy: 0.632636462153119
Energy: 0.6830201027821045
Energy: 0.6491594754907111
Energy: 0.6830201027821045
Energy: 0.675601122985804
Energy: 0.684077193224246
Energy: 0.6327591194515096
Energy: 0.684077193224246
Energy: 0.6049762363962897
Energy: 0.650949455470721
Energy: 0.6391613497485273
Energy: 0.650949455470721
Energy: 0.605081004357385
Energy: 0.6502921879348494
Energy: 0.6458468391245985
Energy: 0.6502921879348494
Energy: 0.5983112441774945
Energy: 0.5982911016705837
Energy: 0.603998839362978
Energy: 0.5982911016705837
Energy: 0.5987970511995826
Energy: 0.5983277155169241
Energy: 0.589620610844676
Energy: 0.5983277155169241
Energy: 0.5889959104694359
Energy: 0.6017686714964009
Energy: 0.6259437031379971
Energy: 0.6017686714964009

minimum gb energy = 0.5889959104694359 eV
minimum distance =  2.61502824497762 Angstroms
sigma value = 25


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

Energy: 0.8850249295854208
Energy: 0.6166136118938351
Energy: 0.6548663377572849
Energy: 0.6547204245454769
Energy: 0.6398247812429847
Energy: 0.6846407835576943
Energy: 0.6265589897706594
Energy: 0.6846407835576943
Energy: 0.6543302410594021
Energy: 0.6548766966839402
Energy: 0.7191965540722567
Energy: 0.6548766966839402
Energy: 0.6288087146014527
Energy: 0.6271126520363017
Energy: 0.6268046582962602
Energy: 0.6271126520355038
Energy: 0.6246082769065456
Energy: 0.6268790812220582
Energy: 0.6270170397844875
Energy: 0.6268790812220582
Energy: 0.684857452652958
Energy: 0.6280506051334643
Energy: 0.6264413325294409
Energy: 0.6280506051334643
Energy: 0.6560959783255427
Energy: 0.6934454967123131
Energy: 0.6610550099528617
Energy: 0.6934454967123131
Energy: 0.6550783641046494
Energy: 0.6936056688184505
Energy: 0.7148006780679717
Energy: 0.6936056688184505
Energy: 0.6557580339078848
Energy: 0.6925595050465196
Energy: 0.6394529767543837
Energy: 0.6925595050465196
Energy: 0.6842137183960446
Energy: 0.6928694676747746
Energy: 0.6269909288995069
Energy: 0.6928694676747746
Energy: 0.6119243160415319
Energy: 0.6267788637057263
Energy: 0.6274818932769093
Energy: 0.6267788637057263
Energy: 0.6120781978330666
Energy: 0.6266745540195208
Energy: 0.6266793704987059
Energy: 0.6266745540195208
Energy: 0.6542599895116755
Energy: 0.6545120623093552
Energy: 0.611057239141179
Energy: 0.6545120623093552
Energy: 0.6265566412051995
Energy: 0.629302276956995
Energy: 0.6387166900283345
Energy: 0.629302276956995
Energy: 0.6242293613185141
Energy: 0.6551815089792774
Energy: 0.6555763819547579
Energy: 0.6551815089792774
Energy: 0.6531930386981605
Energy: 0.6265360989168031
Energy: 0.6553261932756576
Energy: 0.6265360989168031
Energy: 0.6277531318047253
Energy: 0.6275574327749307
Energy: 0.6246697239334329
Energy: 0.6275574327749307
Energy: 0.6265237820645146
Energy: 0.6265532787776806
Energy: 0.6836810167398975
Energy: 0.6265532787768826
Energy: 0.6885100114148738
Energy: 0.6956013270608473
Energy: 0.6561085636053365
Energy: 0.6956013270608473
Energy: 0.715683868160928
Energy: 0.6935050391900979
Energy: 0.6566402837608261
Energy: 0.6935050391900979
Energy: 0.6391660463842526
Energy: 0.6920895818745805
Energy: 0.6565362367293126
Energy: 0.6920895818745805
Energy: 0.6392717834777536
Energy: 0.6923817773494229
Energy: 0.684711461011381
Energy: 0.6923817773494229
Energy: 0.6259959728855409
Energy: 0.6267966333507277
Energy: 0.6116593682302726
Energy: 0.6267966333507277
Energy: 0.6265413532439614
Energy: 0.6269725559946869
Energy: 0.6120731804509608
Energy: 0.6269725559946869
Energy: 0.6109004218051064
Energy: 0.6328922917479204
Energy: 0.6549342970383502
Energy: 0.6328922917479204

minimum gb energy = 0.6109004218051064 eV
minimum distance =  2.61569130328154 Angstroms
sigma value = 9


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

Energy: 0.8276877242997526
Energy: 0.6398911161203339
Energy: 0.6847259792414935
Energy: 0.6841793204242663
Energy: 0.7104813757510448
Energy: 0.710219829958398
Energy: 0.6594776888091767
Energy: 0.710219829958398
Energy: 0.6851730898928186
Energy: 0.6844201166084248
Energy: 0.6807106321820294
Energy: 0.6844201166084248
Energy: 0.6589209744274014
Energy: 0.7106416031693651
Energy: 0.6593703697321478
Energy: 0.7106416031693651
Energy: 0.6556143300734228
Energy: 0.6618001463094846
Energy: 0.6591438433533497
Energy: 0.6618001463094846
Energy: 0.6593320521696812
Energy: 0.6604924128626197
Energy: 0.6603505591055648
Energy: 0.6604924128626197
Energy: 0.6781736900737948
Energy: 0.7304587998999674
Energy: 0.658514773532447
Energy: 0.7304587998999674
Energy: 0.6612063045885116
Energy: 0.7308889467876009
Energy: 0.6592185921520184
Energy: 0.7308889467876009
Energy: 0.6579554192323885
Energy: 0.6603269285912536
Energy: 0.6323912226625005
Energy: 0.6603269285912536
Energy: 0.6593668558025269
Energy: 0.6606152376252062
Energy: 0.6320929623972941
Energy: 0.6606152376252062
Energy: 0.6303312098459859
Energy: 0.6841778719233239
Energy: 0.6838211706234586
Energy: 0.6841778719233239
Energy: 0.6805524837741623
Energy: 0.6602378830119057
Energy: 0.6591779756682986
Energy: 0.6602378830119057
Energy: 0.6848214701612355
Energy: 0.6848995315052667
Energy: 0.6810636968266506
Energy: 0.6848995315052667
Energy: 0.6848205337124305
Energy: 0.7097297707814315
Energy: 0.680246287429813
Energy: 0.7097297707814315
Energy: 0.6553813916994531
Energy: 0.6618824673361993
Energy: 0.6599386987161222
Energy: 0.6618824673361993
Energy: 0.6596506028177012
Energy: 0.6599866505006157
Energy: 0.659919885071159
Energy: 0.6599866505006157
Energy: 0.6774627953834857
Energy: 0.7335415552826271
Energy: 0.6588973028155317
Energy: 0.7335415552826271
Energy: 0.677620699533637
Energy: 0.7293775061107511
Energy: 0.6603580762070304
Energy: 0.7293775061107511
Energy: 0.6592123166859863
Energy: 0.662037764261543
Energy: 0.6319266878501064
Energy: 0.662037764261543
Energy: 0.6598945732655256
Energy: 0.660738214797462
Energy: 0.6321782597124351
Energy: 0.660738214797462
Energy: 0.630182071764562
Energy: 0.6599755547038861
Energy: 0.6847486776598358
Energy: 0.6599755547038861

minimum gb energy = 0.630182071764562 eV
minimum distance =  2.61615497664873 Angstroms
sigma value = 25


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

Energy: 0.7419705262437309
Energy: 0.6581408198867371
Energy: 0.7127687232072889
Energy: 0.7121458148539379
Energy: 0.7167501330721867
Energy: 0.7037974945925345
Energy: 0.670410037164888
Energy: 0.7037974945925345
Energy: 0.7100952732476165
Energy: 0.7122110462285013
Energy: 0.706767883074444
Energy: 0.7122110462285013
Energy: 0.7121643933986849
Energy: 0.704013095307553
Energy: 0.6710298388506625
Energy: 0.704013095307553
Energy: 0.6657555835994758
Energy: 0.7029575515008187
Energy: 0.6707047741099278
Energy: 0.7029575515008187
Energy: 0.6512132178360521
Energy: 0.6674061844400859
Energy: 0.6653997695305722
Energy: 0.6674061844389088
Energy: 0.6476732708350421
Energy: 0.6730670319984685
Energy: 0.6684140625601666
Energy: 0.6730670319996456
Energy: 0.6479770215861592
Energy: 0.7044833453057522
Energy: 0.6687860783920949
Energy: 0.7044833453057522
Energy: 0.7106557956121186
Energy: 0.7119753521358962
Energy: 0.7638084918536123
Energy: 0.7119753521358962
Energy: 0.7109429870688804
Energy: 0.7049827931020978
Energy: 0.7140092782014061
Energy: 0.7049827931020978
Energy: 0.706642957754279
Energy: 0.7125073280190003
Energy: 0.7126617213734201
Energy: 0.7125073280190003
Energy: 0.7062471481594589
Energy: 0.7053223114376349
Energy: 0.7120326514665961
Energy: 0.7053223114376349
Energy: 0.6692969721113827
Energy: 0.6668402041724165
Energy: 0.6626924757746324
Energy: 0.6668402041735937
Energy: 0.6676380632199604
Energy: 0.6671129147503466
Energy: 0.6521649858198699
Energy: 0.6671129147503466
Energy: 0.6956831073559161
Energy: 0.670113526156037
Energy: 0.6477902197813378
Energy: 0.670113526156037
Energy: 0.6662139127356349
Energy: 0.7373339672749047
Energy: 0.6475306143662458
Energy: 0.7373339672749047
Energy: 0.7156639480167339
Energy: 0.652585848372936
Energy: 0.7119460439085961
Energy: 0.652585848372936

minimum gb energy = 0.6475306143662458 eV
minimum distance =  2.68381883032712 Angstroms
sigma value = 17


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

Energy: 1.0170752852099474
Energy: 0.7322935714125266
Energy: 0.7636527669105151
Energy: 0.7665302083830489
Energy: 0.705195184710157
Energy: 0.7178532877422875
Energy: 0.7652511894686433
Energy: 0.7178532877422875
Energy: 0.6954695958293344
Energy: 0.6980866589726594
Energy: 0.7633189937261986
Energy: 0.6980866589719927
Energy: 0.6994139682631424
Energy: 0.7480392515926864
Energy: 0.70946848091944
Energy: 0.7480392515926864
Energy: 0.702317164759628
Energy: 0.7541632548954266
Energy: 0.6650165457242506
Energy: 0.75416325489476
Energy: 0.710575943270424
Energy: 0.7535275923163843
Energy: 0.6982721151787226
Energy: 0.753527592317051
Energy: 0.7252151956029629
Energy: 0.6980985904568275
Energy: 0.6942837097932333
Energy: 0.6980985904568275
Energy: 0.772670203776506
Energy: 0.7119218660528722
Energy: 0.6973049969943538
Energy: 0.7119218660528722
Energy: 0.7651167958972707
Energy: 0.7648143060912849
Energy: 0.7609416307011492
Energy: 0.7648143060912849
Energy: 0.7680501426151551
Energy: 0.7527611157414124
Energy: 0.7517154202667973
Energy: 0.7527611157414124
Energy: 0.6983580690723754
Energy: 0.6792554209697336
Energy: 0.6754528402944117
Energy: 0.679255420969067
Energy: 0.7459338588863653
Energy: 0.6759337548921172
Energy: 0.681329677458169
Energy: 0.6759337548921172
Energy: 0.7281012912494251
Energy: 0.6911647303874038
Energy: 0.6896722406935719
Energy: 0.6911647303874038
Energy: 0.7280870924976319
Energy: 0.7123305750301536
Energy: 0.6741066511461278
Energy: 0.7123305750301536
Energy: 0.7665725191577009
Energy: 0.776057646910186
Energy: 0.792807015990823
Energy: 0.776057646910186
Energy: 0.7654728108317873
Energy: 0.7720437806732359
Energy: 0.7963995640945283
Energy: 0.7720437806732359
Energy: 0.763691091696575
Energy: 0.6980221099291131
Energy: 0.6961519519622462
Energy: 0.6980221099297796
Energy: 0.7532317196680716
Energy: 0.7108180123113941
Energy: 0.6962067469685708
Energy: 0.7108180123113941
Energy: 0.7114607626084184
Energy: 0.7675489598649164
Energy: 0.6993516912232682
Energy: 0.7675489598649164
Energy: 0.7161956347585032
Energy: 0.7366466557767211
Energy: 0.6986568790278676
Energy: 0.7366466557767211
Energy: 0.6980919815452054
Energy: 0.7137315404350955
Energy: 0.7640035736014604
Energy: 0.7137315404344289
Energy: 0.6971279496604657
Energy: 0.697931429027608
Energy: 0.7256193916462168
Energy: 0.6979314290269413
Energy: 0.7170976397242025
Energy: 0.7508852189147416
Energy: 0.7659116956599848
Energy: 0.7508852189147416
Energy: 0.7609060640541699
Energy: 0.76623319306289
Energy: 0.7644010451965897
Energy: 0.76623319306289
Energy: 0.6769370256793324
Energy: 0.7126491813523111
Energy: 0.7556347901471389
Energy: 0.7126491813523111
Energy: 0.6830037814831726
Energy: 0.6912048402633364
Energy: 0.6959054590602342
Energy: 0.6912048402633364
Energy: 0.6732436722056064
Energy: 0.6762559976911047
Energy: 0.7563581384275087
Energy: 0.6762559976911047
Energy: 0.6786445781581124
Energy: 0.6914751142765616
Energy: 0.728225140259919
Energy: 0.6914751142758949
Energy: 0.6755119665883347
Energy: 0.7153894445446284
Energy: 0.7285080512103985
Energy: 0.7153894445446284
Energy: 0.7961779353957295
Energy: 0.7662917915371343
Energy: 0.7628624505530314
Energy: 0.7662917915371343

minimum gb energy = 0.6650165457242506 eV
minimum distance =  2.62816279536883 Angstroms
sigma value = 53


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

Energy: 0.9264151790794765
Energy: 0.6272507249265392
Energy: 0.7130873999815055
Energy: 0.7156433979464226
Energy: 0.7932675893734669
Energy: 0.6733035792859549
Energy: 0.7215059699322188
Energy: 0.6733035792859549
Energy: 0.7135054441456512
Energy: 0.7166937123038728
Energy: 0.770754798569986
Energy: 0.7166937123040298
Energy: 0.7198608361147374
Energy: 0.6733258918563263
Energy: 0.7231046605473986
Energy: 0.6733258918563263
Energy: 0.7169886775094249
Energy: 0.6739254488857122
Energy: 0.6236457502112726
Energy: 0.6739254488857122
Energy: 0.7627019729945245
Energy: 0.6740285266884375
Energy: 0.6233790163374808
Energy: 0.6740285266884375
Energy: 0.7937487329699751
Energy: 0.7172382122935884
Energy: 0.7149061060165092
Energy: 0.7172382122940418
Energy: 0.7932353065288335
Energy: 0.674529797567556
Energy: 0.7183909836257059
Energy: 0.6745297975673992
Energy: 0.7146424801127916
Energy: 0.7160965261807705
Energy: 0.7079954908957351
Energy: 0.7160965261809273
Energy: 0.7221035719466721
Energy: 0.6748792153058053
Energy: 0.718701881561454
Energy: 0.6748792153058053
Energy: 0.7166889040415709
Energy: 0.6751409040780869
Energy: 0.6230367740404317
Energy: 0.6751409040780869
Energy: 0.7214730583613808
Energy: 0.6732102240659773
Energy: 0.6234862745489451
Energy: 0.6732102240659773
Energy: 0.7936658093054002
Energy: 0.6758848838126319
Energy: 0.718995400660447
Energy: 0.6758848838126319

minimum gb energy = 0.6230367740404317 eV
minimum distance =  2.66647085335829 Angstroms
sigma value = 9


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

Energy: 0.907881802667079
Energy: 0.7576356460919201
Energy: 0.7943481496795465
Energy: 0.7956446874262668
Energy: 0.7276750093227761
Energy: 0.6841698966449606
Energy: 0.7968860838361893
Energy: 0.6841698966449606
Energy: 0.6841983301513546
Energy: 0.683960967832589
Energy: 0.844001566772723
Energy: 0.683960967832589
Energy: 0.6808330488811791
Energy: 0.6828155014680056
Energy: 0.8063044521024874
Energy: 0.6828155014680056
Energy: 0.6835356822829559
Energy: 0.6869820600628082
Energy: 0.8364788297063126
Energy: 0.6869820600628082
Energy: 0.6921734495431328
Energy: 0.6855837008958955
Energy: 0.8371125672077021
Energy: 0.6855837008958955
Energy: 0.7925540602023771
Energy: 0.795171110499851
Energy: 0.7983078465238307
Energy: 0.7951711104992829
Energy: 0.7922743282019495
Energy: 0.6843590697581129
Energy: 0.7999220191646773
Energy: 0.6843590697581129
Energy: 0.7219491564815527
Energy: 0.7613304599674173
Energy: 0.7300902938314378
Energy: 0.7613304599674173
Energy: 0.6812779947008797
Energy: 0.7567310780847234
Energy: 0.7992084104164792
Energy: 0.7567310780847234
Energy: 0.7221932811337824
Energy: 0.7215165767471071
Energy: 0.7527978747755575
Energy: 0.7215165767471071
Energy: 0.7212362614625152
Energy: 0.7254850698438639
Energy: 0.8344482325402994
Energy: 0.7254850698438639
Energy: 0.7934978444267734
Energy: 0.721591161150899
Energy: 0.721492586199185
Energy: 0.721591161150899
Energy: 0.7941448081065836
Energy: 0.719213897986089
Energy: 0.718792455032559
Energy: 0.7192138979866571
Energy: 0.7989347534130233
Energy: 0.7246499461009972
Energy: 0.7254910385558693
Energy: 0.7246499461009972
Energy: 0.7791923749497952
Energy: 0.7558655729054445
Energy: 0.7258176398423597
Energy: 0.7558655729054445
Energy: 0.7981636886295551
Energy: 0.6856539674413589
Energy: 0.7182675713138008
Energy: 0.6856539674413589
Energy: 0.7934893126716053
Energy: 0.7951843797465382
Energy: 0.9070321271049138
Energy: 0.7951843797465382
Energy: 0.7968278076522376
Energy: 0.6835398097166749
Energy: 0.6846396134459455
Energy: 0.6835398097166749
Energy: 0.8473794962456511
Energy: 0.6845021344681004
Energy: 0.6855312412553946
Energy: 0.6845021344675323
Energy: 0.8064708630746121
Energy: 0.6830346799534242
Energy: 0.6819287740625607
Energy: 0.6830346799534242
Energy: 0.8371583575485783
Energy: 0.686782667268688
Energy: 0.6835374071486477
Energy: 0.6867826672692561
Energy: 0.8371866493552741
Energy: 0.6871398322844805
Energy: 0.6905589050132886
Energy: 0.6871398322844805
Energy: 0.7990482361014525
Energy: 0.7957558469222831
Energy: 0.7926854347740614
Energy: 0.795755846921715
Energy: 0.798025074062608
Energy: 0.7576562786638601
Energy: 0.7923797434925611
Energy: 0.7576562786638601
Energy: 0.728512037673907
Energy: 0.6911145885962339
Energy: 0.7214697535501439
Energy: 0.6911145885962339
Energy: 0.7980895745269954
Energy: 0.7573123310395276
Energy: 0.6837672919503521
Energy: 0.7573123310395276
Energy: 0.7689499297601304
Energy: 0.7212044331927735
Energy: 0.7220518861250285
Energy: 0.7212044331927735
Energy: 0.9049112168853242
Energy: 0.7210260904691373
Energy: 0.721231296361812
Energy: 0.7210260904691373
Energy: 0.7197829313820588
Energy: 0.7196402486017566
Energy: 0.8049351237585863
Energy: 0.7196402486017566
Energy: 0.7194647144143734
Energy: 0.7191867549290667
Energy: 0.7923523909578867
Energy: 0.7191867549290667
Energy: 0.7244830932264421
Energy: 0.7224877446378538
Energy: 0.7976725847860892
Energy: 0.7224877446378538
Energy: 0.724712364153159
Energy: 0.7589019341160053
Energy: 0.7758295813400442
Energy: 0.7589019341160053
Energy: 0.7181989805145167
Energy: 0.685878453606391
Energy: 0.7648289741007237
Energy: 0.685878453606391
Energy: 0.8312999664880137
Energy: 0.7948564997929072
Energy: 0.7959067527172619
Energy: 0.7948564997934752

minimum gb energy = 0.6808330488811791 eV
minimum distance =  2.62480369797841 Angstroms
sigma value = 73


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

Energy: 0.9286505603742194
Energy: 0.7324935095294733
Energy: 0.7757375582990874
Energy: 0.7756368311721339
Energy: 0.7352705684055449
Energy: 0.6994349883132762
Energy: 0.7729657782687839
Energy: 0.6994349882727389
Energy: 0.7008465770757728
Energy: 0.7003135266547121
Energy: 0.8179303577053807
Energy: 0.7003135266547121
Energy: 0.6938165194365274
Energy: 0.6981188880304321
Energy: 0.8455570465130561
Energy: 0.6981188880304321
Energy: 0.6991303809792107
Energy: 0.7028218303117033
Energy: 0.8042852266642903
Energy: 0.7028218303117033
Energy: 0.7003270382363188
Energy: 0.7016319410654986
Energy: 0.803919713399744
Energy: 0.7016319410654986
Energy: 0.7286469919324704
Energy: 0.7927516629765715
Energy: 0.7948592613635951
Energy: 0.7927516629765715
Energy: 0.7279895909944553
Energy: 0.7112383605457661
Energy: 0.7934676810599643
Energy: 0.7112383605457661
Energy: 0.7214086047167971
Energy: 0.6811800361979686
Energy: 0.7966712641906913
Energy: 0.6811800361979686
Energy: 0.7285064174729694
Energy: 0.7763396796983366
Energy: 0.810977792336865
Energy: 0.7763396796983366
Energy: 0.727204100738411
Energy: 0.6817808542229191
Energy: 0.6858137744040219
Energy: 0.6817808542229191
Energy: 0.7208087009902441
Energy: 0.6902567416007357
Energy: 0.8246213760944322
Energy: 0.6902567416007357
Energy: 0.7972559840930105
Energy: 0.7391627208961649
Energy: 0.7298278678650769
Energy: 0.7391627208961649
Energy: 0.7983252446499294
Energy: 0.756513564737379
Energy: 0.7304167238131254
Energy: 0.756513564737379
Energy: 0.8067850816957772
Energy: 0.7472099065721557
Energy: 0.7184116709564056
Energy: 0.7472099065721557
Energy: 0.8009123076122399
Energy: 0.7186114716063011
Energy: 0.717424538771743
Energy: 0.7186114716063011
Energy: 0.8028906250599521
Energy: 0.7531231906578895
Energy: 0.7187328310905116
Energy: 0.7531231906578895
Energy: 0.774959832853537
Energy: 0.7758693093323819
Energy: 0.7287819513104257
Energy: 0.7758693093314806
Energy: 0.7757490154955414
Energy: 0.7494897232563562
Energy: 0.7486922223066764
Energy: 0.7494897232563562
Energy: 0.7883988304959989
Energy: 0.7472121505074955
Energy: 0.7750115795427909
Energy: 0.7472121505074955
Energy: 0.7762403435281257
Energy: 0.7656579034046644
Energy: 0.7250858021163917
Energy: 0.7656579034046644
Energy: 0.7988250699904015
Energy: 0.7758202385168145
Energy: 0.7720294525816773
Energy: 0.7758202385168145

minimum gb energy = 0.6811800361979686 eV
minimum distance =  2.58098843956325 Angstroms
sigma value = 7


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

Energy: 1.021534079226311
Energy: 0.7161094352540818
Energy: 0.7776923389861236
Energy: 0.7779513282773229
Energy: 0.7585894940704597
Energy: 0.697413729723174
Energy: 0.7899038596889055
Energy: 0.6974137297238112
Energy: 0.6970697699632564
Energy: 0.6983208099109659
Energy: 0.764927289065701
Energy: 0.6983208099109659
Energy: 0.6886542873755405
Energy: 0.693700478018501
Energy: 0.7852127171009249
Energy: 0.6937004780191383
Energy: 0.7009339792859796
Energy: 0.6986675597581007
Energy: 0.8251073307259029
Energy: 0.6986675597574634
Energy: 0.6989348566812812
Energy: 0.6955566250386537
Energy: 0.8239408190852815
Energy: 0.6955566250386537
Energy: 0.7776481429813636
Energy: 0.7062292307411945
Energy: 0.6999626198297971
Energy: 0.7062292307411945
Energy: 0.7895427768505764
Energy: 0.6948739149768312
Energy: 0.704066678266918
Energy: 0.6948739149768312
Energy: 0.7872914086964725
Energy: 0.6937167037376415
Energy: 0.6911789475056964
Energy: 0.6937167037376415
Energy: 0.8313027729391573
Energy: 0.6931073096957578
Energy: 0.6923528761548617
Energy: 0.6931073096951206
Energy: 0.7855138593398842
Energy: 0.7020989081927479
Energy: 0.6970143534193624
Energy: 0.7020989071066044
Energy: 0.7733233989140051
Energy: 0.7708483943439577
Energy: 0.7832487247344234
Energy: 0.7708483943439577
Energy: 0.7640905032488521
Energy: 0.7405144175918231
Energy: 0.7745710774590061
Energy: 0.7405144175918231
Energy: 0.7646073483701479
Energy: 0.7406127109457611
Energy: 0.6982933901232609
Energy: 0.7406127109451237
Energy: 0.7743336905126276
Energy: 0.7402294060714388
Energy: 0.6993370763239913
Energy: 0.7402294060720762
Energy: 0.7096930258177276
Energy: 0.7698744002074935
Energy: 0.7742112062438764
Energy: 0.7698744002106802
Energy: 0.707470911322457
Energy: 0.6979953933956923
Energy: 0.7861342263768464
Energy: 0.697995393395055
Energy: 0.7004496617144997
Energy: 0.699069619722968
Energy: 0.765814405845832
Energy: 0.699069619722968
Energy: 0.6910197415542813
Energy: 0.6937035937468653
Energy: 0.7868691355554006
Energy: 0.6937035937468653
Energy: 0.7034967484933581
Energy: 0.6951049508832203
Energy: 0.7095051038423245
Energy: 0.6951049508838577
Energy: 0.7033756776988637
Energy: 0.702162329090173
Energy: 0.8269228685310683
Energy: 0.702162329090173
Energy: 0.7789875193934785
Energy: 0.695356015341838
Energy: 0.7000774575036725
Energy: 0.695356015341838
Energy: 0.77906483198564
Energy: 0.6994602854038016
Energy: 0.7037080283494982
Energy: 0.6994602854038016
Energy: 0.8414921245139106
Energy: 0.6941990902222381
Energy: 0.6895863892296812
Energy: 0.6941990902228755
Energy: 0.8307167039943439
Energy: 0.6976206462250791
Energy: 0.696996330592042
Energy: 0.6976206462250791
Energy: 0.8253285271874816
Energy: 0.6962489738981879
Energy: 0.7052415400187869
Energy: 0.6962489738981879
Energy: 0.7772416167822741
Energy: 0.7780949621769812
Energy: 0.9243502062702063
Energy: 0.7780949621769812
Energy: 0.7669678645850135
Energy: 0.7419278765953208
Energy: 0.7760003618017196
Energy: 0.741927876595958
Energy: 0.7666343327678098
Energy: 0.7392184110138027
Energy: 0.7626827439513988
Energy: 0.7392184110138027
Energy: 0.7709946528760993
Energy: 0.7385813227109886
Energy: 0.6981035901410467
Energy: 0.7385813227109886
Energy: 0.7072885585360099
Energy: 0.7700337854694899
Energy: 0.7746844422988851
Energy: 0.7700337854694899

minimum gb energy = 0.6886542873755405 eV
minimum distance =  2.59625006464399 Angstroms
sigma value = 29


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

Energy: 0.6418639086780255
Energy: 0.6477869061263851
Energy: 0.7212202453891441
Energy: 0.7636516976936266
Energy: 0.6470745216095205
Energy: 0.7086728650338554
Energy: 0.6901105019637994
Energy: 0.7086728650336335
Energy: 0.6649226243980595
Energy: 0.7145455687934194
Energy: 0.6434613649915936
Energy: 0.7145455687934194
Energy: 0.6592117277812248
Energy: 0.659029537972842
Energy: 0.6634885057972701
Energy: 0.659029537972842
Energy: 0.6541954206355493
Energy: 0.6604642436295459
Energy: 0.645933005466538
Energy: 0.6604642436269559
Energy: 0.6639543333713729
Energy: 0.7124003048689089
Energy: 0.6469609488879897
Energy: 0.7124003048687115
Energy: 0.6442866332694736
Energy: 0.7138422590511493
Energy: 0.6637107884306255
Energy: 0.7138422590511493
Energy: 0.6899824693145655
Energy: 0.6610205245906744
Energy: 0.6575976987629566
Energy: 0.6610205245906744
Energy: 0.6470831892526377
Energy: 0.6607760234116405
Energy: 0.6579447408178491
Energy: 0.6607760234116405

minimum gb energy = 0.6418639086780255 eV
minimum distance =  2.63629471036879 Angstroms
sigma value = 5


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

Energy: 0.8914493553052365
Energy: 0.6936385530940884
Energy: 0.7607925101036547
Energy: 0.6632741241164443
Energy: 0.7114825735791177
Energy: 0.6629122085865405
Energy: 0.7642116454959275
Energy: 0.6629122085865405
Energy: 0.7633889050478466
Energy: 0.7172493187123086
Energy: 0.7653656376036401
Energy: 0.7172493187123086
Energy: 0.7179368373794603
Energy: 0.7402023343808789
Energy: 0.7680934777295586
Energy: 0.7402023343814809
Energy: 0.7038233483054199
Energy: 0.6773852997811497
Energy: 0.7225362919993696
Energy: 0.6773852997811497
Energy: 0.6921720847698486
Energy: 0.667887513313635
Energy: 0.7233215817737043
Energy: 0.667887513313635
Energy: 0.6610962119183876
Energy: 0.661729405253658
Energy: 0.7645065696343043
Energy: 0.661729405253658
Energy: 0.667956367646701
Energy: 0.6638252300644818
Energy: 0.8081159885187637
Energy: 0.6638252300644818
Energy: 0.7016746348840948
Energy: 0.6885456160236824
Energy: 0.8061162684578347
Energy: 0.6885456160236824
Energy: 0.8036983801658582
Energy: 0.6596842428273827
Energy: 0.6532359683220492
Energy: 0.6596842428273827
Energy: 0.696435545393895
Energy: 0.6500206328507409
Energy: 0.6515908269401428
Energy: 0.6500206328507409
Energy: 0.8047472064536314
Energy: 0.6515452180225639
Energy: 0.6574310768457381
Energy: 0.651545218023166
Energy: 0.806491230051434
Energy: 0.6563346963292931
Energy: 0.6884784979563765
Energy: 0.6563346963292931
Energy: 0.7071994544205699
Energy: 0.6420400310154697
Energy: 0.8031574935806691
Energy: 0.6420400310154697
Energy: 0.692637891618381
Energy: 0.6444761390863953
Energy: 0.8026103080105396
Energy: 0.6444761390875994
Energy: 0.6950688247829165
Energy: 0.6412871767086186
Energy: 0.6836062855958747
Energy: 0.6412871767086186
Energy: 0.694876270815897
Energy: 0.6852076480177279
Energy: 0.6743714758404771
Energy: 0.6852076480177279
Energy: 0.7833497898843179
Energy: 0.6422609048045521
Energy: 0.6505939672439836
Energy: 0.6422609048045521
Energy: 0.8011301719708566
Energy: 0.6986883803627394
Energy: 0.6741320480544767
Energy: 0.6986883803633414
Energy: 0.7955892199477581
Energy: 0.7380689824806853
Energy: 0.7167026222546293
Energy: 0.7380689824806853
Energy: 0.7241965374608321
Energy: 0.6700524308749881
Energy: 0.6788609719576445
Energy: 0.6700524308743862
Energy: 0.7220397299489348
Energy: 0.6918939341523709
Energy: 0.6783388081221529
Energy: 0.6918939341517688
Energy: 0.8105749969108409
Energy: 0.6655368863123676
Energy: 0.6662698220990649
Energy: 0.6655368863123676
Energy: 0.8074387897217451
Energy: 0.6671623771986358
Energy: 0.6713763787388078
Energy: 0.6671623771986358
Energy: 0.8054077117497872
Energy: 0.6933079660232616
Energy: 0.7112757903229816
Energy: 0.6933079660232616
Energy: 0.6561166211484775
Energy: 0.6503806858753729
Energy: 0.803744821839701
Energy: 0.6503806858753729
Energy: 0.6481265421674314
Energy: 0.6467967905175762
Energy: 0.6621586714560106
Energy: 0.6467967905175762
Energy: 0.6528452435292623
Energy: 0.6466809877185086
Energy: 0.6755768706599028
Energy: 0.6466809877185086
Energy: 0.6551851220730425
Energy: 0.6939982244201973
Energy: 0.8071458175995112
Energy: 0.6939982244201973
Energy: 0.8032357718580043
Energy: 0.6888202286903197
Energy: 0.7159636879991021
Energy: 0.6888202286897177
Energy: 0.803251947020986
Energy: 0.661681342876767
Energy: 0.6646095161502144
Energy: 0.661681342876767
Energy: 0.7305932576696164
Energy: 0.6615664823167059
Energy: 0.6643432736253236
Energy: 0.6615664823167059
Energy: 0.7175773022510511
Energy: 0.6767491868495374
Energy: 0.6715330221403628
Energy: 0.6767491868501395

minimum gb energy = 0.6412871767086186 eV
minimum distance =  2.59946205357291 Angstroms
sigma value = 1


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

Energy: 0.88979401056516
Energy: 0.6224236038531118
Energy: 0.7270710388262351
Energy: 0.6399776287617263
Energy: 0.6479098678488203
Energy: 0.6338584725472443
Energy: 0.6502755805615774
Energy: 0.6338584725472443
Energy: 0.6678473375245808
Energy: 0.7034033167782051
Energy: 0.6680432999025541
Energy: 0.7034033167782051
Energy: 0.6482563212738219
Energy: 0.7040360752298189
Energy: 0.6715514935085809
Energy: 0.7040360752298189
Energy: 0.6690621410626137
Energy: 0.6514906205309158
Energy: 0.6622091197047156
Energy: 0.6514906205309158
Energy: 0.6525132146967675
Energy: 0.6401849854697309
Energy: 0.6618688189989884
Energy: 0.6401849854697309
Energy: 0.6300398155349471
Energy: 0.6312020649893019
Energy: 0.6644568711872656
Energy: 0.6312020649893019
Energy: 0.6340395308431852
Energy: 0.6348806415347916
Energy: 0.6113791636200374
Energy: 0.6348806415347916
Energy: 0.6647287953960922
Energy: 0.6712996708734237
Energy: 0.6110196903972998
Energy: 0.6712996708734237
Energy: 0.7675568952745973
Energy: 0.6358161923955326
Energy: 0.6525571589970633
Energy: 0.6358161923955326
Energy: 0.664440080177633
Energy: 0.6315190672934075
Energy: 0.6302626172927841
Energy: 0.6315190672934075
Energy: 0.6095552268715199
Energy: 0.6369636963768953
Energy: 0.6504678931989892
Energy: 0.6369636963768953
Energy: 0.6093832817830241
Energy: 0.6322356315101326
Energy: 0.667003811380322
Energy: 0.6322356315101326
Energy: 0.6643969125359634
Energy: 0.7043590425253948
Energy: 0.6508539464325628
Energy: 0.7043590425253948
Energy: 0.6497277124344946
Energy: 0.7026366652140368
Energy: 0.6509291418477045
Energy: 0.7026366652140368
Energy: 0.6478344495600216
Energy: 0.6330522194946815
Energy: 0.6332581346322019
Energy: 0.6330522194946815
Energy: 0.6670826056110479
Energy: 0.6532336962167853
Energy: 0.6615905435269226
Energy: 0.6532336962176176
Energy: 0.6375005483423257
Energy: 0.6345961235734779
Energy: 0.6612974309955771
Energy: 0.6345961235734779
Energy: 0.6309862903167252
Energy: 0.6325079790003031
Energy: 0.611213256598676
Energy: 0.6325079790003031
Energy: 0.6340871832339234
Energy: 0.6483178969416169
Energy: 0.611566245724088
Energy: 0.6483178969416169
Energy: 0.6628855549646465
Energy: 0.6725010414995818
Energy: 0.6643497499010086
Energy: 0.6725010414995818
Energy: 0.661842008712085
Energy: 0.6330465657324166
Energy: 0.6339264608196644
Energy: 0.6330465657324166
Energy: 0.6516475813630107
Energy: 0.6316376835324357
Energy: 0.6315339688386231
Energy: 0.6316376835324357
Energy: 0.6093839533085543
Energy: 0.6319968133844845
Energy: 0.6533618168746848
Energy: 0.6319968133786578

minimum gb energy = 0.6093832817830241 eV
minimum distance =  2.6075786625027 Angstroms
sigma value = 17


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

Energy: 0.9374669400207014
Energy: 0.6198870657527263
Energy: 0.7290416210915757
Energy: 0.6343260651542577
Energy: 0.6371839129197504
Energy: 0.6291810648256374
Energy: 0.7177461973421255
Energy: 0.6291810648251228
Energy: 0.7904008327516814
Energy: 0.7292846990179034
Energy: 0.7131669971192808
Energy: 0.7292846990173889
Energy: 0.7855517001837169
Energy: 0.6652925783092771
Energy: 0.7374958615722703
Energy: 0.6652925783092771
Energy: 0.7166026801134876
Energy: 0.6228502174065009
Energy: 0.7188010594438045
Energy: 0.6228502174065009
Energy: 0.6253489910278425
Energy: 0.6226283946951433
Energy: 0.7192601934661271
Energy: 0.6226283946951433
Energy: 0.6158303121343701
Energy: 0.6149540894561984
Energy: 0.6660533696467589
Energy: 0.6149540894561984
Energy: 0.6209649181833473
Energy: 0.6165964461406253
Energy: 0.6293853753739174
Energy: 0.6165964461406253
Energy: 0.711835719161872
Energy: 0.6171278792617227
Energy: 0.7911227979434212
Energy: 0.6171278792617227
Energy: 0.7096929109498625
Energy: 0.6290375236241224
Energy: 0.7222081822397743
Energy: 0.6290375230640893
Energy: 0.721750642916808
Energy: 0.6292029032298497
Energy: 0.635632075540449
Energy: 0.6292029032267629
Energy: 0.7230138323651143
Energy: 0.6295310134956131
Energy: 0.7287963063255668
Energy: 0.6295310134956131
Energy: 0.7265036725051673
Energy: 0.6423000228988439
Energy: 0.6475618453983494
Energy: 0.6423000228983293
Energy: 0.6267841128243898
Energy: 0.6263953386920397
Energy: 0.6278611880338543
Energy: 0.6263953386920397
Energy: 0.784539963821882
Energy: 0.6283814980113299
Energy: 0.6326731134763222
Energy: 0.6283814980113299
Energy: 0.630013907807669
Energy: 0.6273500791918468
Energy: 0.6274747242398921
Energy: 0.6273500791918468
Energy: 0.6297618687902999
Energy: 0.6312060244090403
Energy: 0.8598106649786041
Energy: 0.6312060244090403
Energy: 0.6287329167218996
Energy: 0.6272663855098229
Energy: 0.7197004199036449
Energy: 0.6272663855098229
Energy: 0.6452187503160584
Energy: 0.6278158587680658
Energy: 0.7911359398580537
Energy: 0.6278158587680658
Energy: 0.6480523249586143
Energy: 0.7182467161701199
Energy: 0.933286288846184
Energy: 0.7182467161701199
Energy: 0.7174706577168557
Energy: 0.6281469272515016
Energy: 0.6275677844725618
Energy: 0.6281469272515016
Energy: 0.7153168978347585
Energy: 0.7300022744661162
Energy: 0.7884786565186355
Energy: 0.7300022744666309
Energy: 0.7309467783876498
Energy: 0.6626964424144917
Energy: 0.7866592819693831
Energy: 0.6626964424144917
Energy: 0.7209231570336389
Energy: 0.6246085228607031
Energy: 0.7165181631826404
Energy: 0.6246085228607031
Energy: 0.720187596422679
Energy: 0.6173710723255023
Energy: 0.6234987107503824
Energy: 0.6173710723255023
Energy: 0.725665451030392
Energy: 0.6158136349272579
Energy: 0.6177182127397369
Energy: 0.6158136349272579
Energy: 0.9365791356303567
Energy: 0.6179956629053909
Energy: 0.6245901758927298
Energy: 0.6179956629064199
Energy: 0.7363974206456001
Energy: 0.6160624723933741
Energy: 0.7207267474352655
Energy: 0.6160624723928596
Energy: 0.7188436494415185
Energy: 0.6291023080418502
Energy: 0.7107300904728842
Energy: 0.6291023080433937
Energy: 0.6366782092087734
Energy: 0.6285041778228316
Energy: 0.7200082363292903
Energy: 0.6285041778233462
Energy: 0.7355821248432128
Energy: 0.6380445761292941
Energy: 0.7196928439513584
Energy: 0.6380445761287797
Energy: 0.6458415417364808
Energy: 0.6436171853446329
Energy: 0.7199299182522431
Energy: 0.6436171853446329
Energy: 0.626520905596357
Energy: 0.6259317756766356
Energy: 0.6275769911125277
Energy: 0.6259317756766356
Energy: 0.632833727603888
Energy: 0.6290682896244961
Energy: 0.7837653787255857
Energy: 0.6290682896280974
Energy: 0.6276351294081411
Energy: 0.6517390452208064
Energy: 0.614094777534557
Energy: 0.6517390452208064
Energy: 0.8617420480568928
Energy: 0.6298409036182133
Energy: 0.6485191915506807
Energy: 0.6298409036182133
Energy: 0.7194712245147056
Energy: 0.626568282818391
Energy: 0.6267712808518696
Energy: 0.626568282818391
Energy: 0.7895103845355469
Energy: 0.6286527422646814
Energy: 0.6556822648809321
Energy: 0.6286527422646814

minimum gb energy = 0.614094777534557 eV
minimum distance =  2.59812799744743 Angstroms
sigma value = 89


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

Energy: 0.9701443168990164
Energy: 0.5997349175377369
Energy: 0.5816911214367542
Energy: 0.5785220207306297
Energy: 0.5710297794131374
Energy: 0.6366951595441821
Energy: 0.5916853783506814
Energy: 0.6366951595441821
Energy: 0.5709916223666359
Energy: 0.6369852281025984
Energy: 0.5926977302663984
Energy: 0.6369852281027208
Energy: 0.572151832809709
Energy: 0.637894910208387
Energy: 0.5917640242082434
Energy: 0.6378949102082494
Energy: 0.5919625214046804
Energy: 0.5771458521898912
Energy: 0.6139976189927677
Energy: 0.5771458521898912
Energy: 0.577996904794899
Energy: 0.5769361039003894
Energy: 0.6142421238652035
Energy: 0.5769361039001141
Energy: 0.5753819438121748
Energy: 0.5751393913588453
Energy: 0.619322336213842
Energy: 0.5751393913588453
Energy: 0.5785183302519479
Energy: 0.5791531032902376
Energy: 0.5764896534794384
Energy: 0.5791531032900998
Energy: 0.5913022135612406
Energy: 0.5777342205106853
Energy: 0.5709972104857387
Energy: 0.5777342205108231
Energy: 0.5941733257350033
Energy: 0.6385481324608079
Energy: 0.6204048578374158
Energy: 0.6385481324606702
Energy: 0.6198594923368794
Energy: 0.6388593768598874
Energy: 0.5694412439636555
Energy: 0.6388593768598874
Energy: 0.614447096671856
Energy: 0.5784837124901523
Energy: 0.5923756733082574
Energy: 0.5784837124901523
Energy: 0.614525503415538
Energy: 0.5772453833561754
Energy: 0.5781817483113243
Energy: 0.5772453833561754
Energy: 0.6185355860680554
Energy: 0.5746642311038357
Energy: 0.5744976339096606
Energy: 0.5746642311038357
Energy: 0.5785627839850016
Energy: 0.5769659107927547
Energy: 0.5771919110922024
Energy: 0.5769659107927547

minimum gb energy = 0.5694412439636555 eV
minimum distance =  2.62399894085478 Angstroms
sigma value = 13


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

Energy: 0.8723956992102222
Energy: 0.558985437391197
Energy: 0.6885256052602327
Energy: 0.5561220511888763
Energy: 0.5548947362141075
Energy: 0.5519774353148391
Energy: 0.6381380098631462
Energy: 0.5519774353148391
Energy: 0.5593681000111277
Energy: 0.5513597466435206
Energy: 0.6355124081347834
Energy: 0.5513597466435206
Energy: 0.7081158429084679
Energy: 0.5670386948245316
Energy: 0.6357940304614259
Energy: 0.5670386948239674
Energy: 0.6561918820045625
Energy: 0.552520286782279
Energy: 0.6589630701435211
Energy: 0.552520286782279
Energy: 0.636698192791661
Energy: 0.5522975978267062
Energy: 0.6591766991749426
Energy: 0.5522975978267062
Energy: 0.6339805578961594
Energy: 0.5517073658337045
Energy: 0.6360633452046555
Energy: 0.5517073658337045
Energy: 0.5786663071115095
Energy: 0.5529434155965849
Energy: 0.6336537184470742
Energy: 0.552943415597149
Energy: 0.5569719442433513
Energy: 0.5528049061499395
Energy: 0.6397471416672998
Energy: 0.5528049061505037
Energy: 0.5534135809461231
Energy: 0.5518173766246285
Energy: 0.6386718500401039
Energy: 0.5518173766246285
Energy: 0.5518065728559021
Energy: 0.5557498926875502
Energy: 0.8731885948139186
Energy: 0.5557498926881145
Energy: 0.6446347603201806
Energy: 0.5510296301602353
Energy: 0.6433266874419602
Energy: 0.5510296301602353
Energy: 0.646147658049314
Energy: 0.5864400584197628
Energy: 0.6439282708891443
Energy: 0.5864400584203269
Energy: 0.6621301763935641
Energy: 0.588136869440639
Energy: 0.7096079931193784
Energy: 0.5881368694400747
Energy: 0.633750761420432
Energy: 0.5538427604021025
Energy: 0.6442593477427005
Energy: 0.5538427604021025
Energy: 0.6439812739555114
Energy: 0.5526179506068197
Energy: 0.5547465286223191
Energy: 0.5526179506056914
Energy: 0.6613279741365445
Energy: 0.5520227896075683
Energy: 0.5541488535303875
Energy: 0.5520227896075683
Energy: 0.8683779721998262
Energy: 0.5523578412950795
Energy: 0.5566394507045168
Energy: 0.5523578412950795
Energy: 0.711960992409275
Energy: 0.5528162269519752
Energy: 0.65026233275044
Energy: 0.5528162269519752
Energy: 0.6504684033342552
Energy: 0.550674686660522
Energy: 0.6320622280692407
Energy: 0.5506746866599578
Energy: 0.7068183814982121
Energy: 0.5556591215891945
Energy: 0.6549707029293673
Energy: 0.555659121588066
Energy: 0.6453648210125287
Energy: 0.5938713682319076
Energy: 0.6621670069551617
Energy: 0.5938713682319076
Energy: 0.6410216105001216
Energy: 0.5527258214664159
Energy: 0.65811547856802
Energy: 0.5527258214658518
Energy: 0.5545869173919842
Energy: 0.5505941918946247
Energy: 0.6465588572810569
Energy: 0.5505941918934963
Energy: 0.6426226254022317
Energy: 0.5630204777592523
Energy: 0.6353314885065267
Energy: 0.5630204777592523
Energy: 0.5662352806765323
Energy: 0.5549305135479653
Energy: 0.6331471784138565
Energy: 0.5549305135479653
Energy: 0.551202876444045
Energy: 0.55076573569854
Energy: 0.6363994905728635
Energy: 0.55076573569854
Energy: 0.5517405479998823
Energy: 0.5539758886061397
Energy: 0.5539163312102426
Energy: 0.5539758886061397
Energy: 0.6343611322486364
Energy: 0.552032725166043
Energy: 0.7117964743401912
Energy: 0.552032725166043
Energy: 0.630899241852175
Energy: 0.5887508004012404
Energy: 0.6627118474521885
Energy: 0.5887508004018046
Energy: 0.6656564201370032
Energy: 0.5918635700057935
Energy: 0.7077688667935945
Energy: 0.5918635700057935
Energy: 0.638990355672771
Energy: 0.5526042718941733
Energy: 0.6611096166104306
Energy: 0.5526042718941733
Energy: 0.6336143668734424
Energy: 0.5531619326045665
Energy: 0.557843548175363
Energy: 0.5531619326045665
Energy: 0.6566031172275104
Energy: 0.550787716236725
Energy: 0.5515327019645365
Energy: 0.550787716236725
Energy: 0.7152457277070686
Energy: 0.5518030239515542
Energy: 0.5545854371913486
Energy: 0.5518030239515542

minimum gb energy = 0.5505941918934963 eV
minimum distance =  2.61279722592847 Angstroms
sigma value = 37


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

Energy: 0.769774281763499
Energy: 0.5387557013064447
Energy: 0.508301610283404
Energy: 0.507410409557121
Energy: 0.5071735436029461
Energy: 0.5071045282743634
Energy: 0.646282890524249
Energy: 0.5071045282743634
Energy: 0.7744313694792316
Energy: 0.5711811109036898
Energy: 0.6437144193780249
Energy: 0.5711811109036898
Energy: 0.7725886449325019
Energy: 0.5717443805295492
Energy: 0.6441202887256492
Energy: 0.5717443805295492
Energy: 0.64669814998314
Energy: 0.5719284016850084
Energy: 0.6379345809237201
Energy: 0.5719284016850084
Energy: 0.6460984332189719
Energy: 0.5076631441481622
Energy: 0.5029758742153109
Energy: 0.5076631441471915
Energy: 0.503184587194556
Energy: 0.5061124458372936
Energy: 0.7832357944947353
Energy: 0.5061124458372936
Energy: 0.5143527474883374
Energy: 0.507134501756492
Energy: 0.6416452271663329
Energy: 0.507134501756492
Energy: 0.5072307712880432
Energy: 0.5089646076437844
Energy: 0.6380090889771846
Energy: 0.5089646076437844
Energy: 0.5069934559294328
Energy: 0.5070808241879612
Energy: 0.6412731347563231
Energy: 0.5070808241879612
Energy: 0.5081307351139358
Energy: 0.5074104096017519
Energy: 0.769774281763499
Energy: 0.5387557013064447
Energy: 0.646282890524249
Energy: 0.5071045282743634
Energy: 0.5071735436029461
Energy: 0.5071045282743634
Energy: 0.6437144193780249
Energy: 0.5711811109036898
Energy: 0.7744313694792316
Energy: 0.5711811109036898
Energy: 0.6441202887256492
Energy: 0.5717443805285786
Energy: 0.7725886449325019
Energy: 0.5717443805285786
Energy: 0.6379345809237201
Energy: 0.5719284016850084
Energy: 0.6466981499841107
Energy: 0.5719284016850084
Energy: 0.5029758742172523
Energy: 0.5076631441471915
Energy: 0.6460984332189719
Energy: 0.5076631441471915
Energy: 0.7832357944947353
Energy: 0.5061124458372936
Energy: 0.503184587194556
Energy: 0.5061124458363229
Energy: 0.6416452271546842
Energy: 0.5071345017574627
Energy: 0.5143527474893081
Energy: 0.507134501756492
Energy: 0.6380090135249208
Energy: 0.5089646076437844
Energy: 0.5072307712880432
Energy: 0.5089646076437844
Energy: 0.6412731359740199
Energy: 0.5070808241879612
Energy: 0.5069934559294328
Energy: 0.5070808241879612

minimum gb energy = 0.5029758742153109 eV
minimum distance =  2.62674149859087 Angstroms
sigma value = 25


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

Energy: 0.9365674376426559
Energy: 0.49008803351036306
Energy: 0.4608145256767553
Energy: 0.4656709693036021
Energy: 0.6134602783847392
Energy: 0.4618059928311026
Energy: 0.5687769845701236
Energy: 0.4618059928311026
Energy: 0.7960134915046096
Energy: 0.46118886593387515
Energy: 0.5661369103829911
Energy: 0.4611888659331171
Energy: 0.7097847732766414
Energy: 0.5114387113941631
Energy: 0.5917658000261388
Energy: 0.5114387113941631
Energy: 0.6741229620133605
Energy: 0.5583957339572088
Energy: 0.7571485526546059
Energy: 0.5583957339572088
Energy: 0.713111963790935
Energy: 0.5126860984819555
Energy: 0.7607955781540295
Energy: 0.5126860984819555
Energy: 0.7112023988262896
Energy: 0.4590368774356336
Energy: 0.660642871984485
Energy: 0.45903687742805355
Energy: 0.5594491923353903
Energy: 0.46035232251406893
Energy: 0.7936910639174093
Energy: 0.46035232251406893
Energy: 0.5658915358715361
Energy: 0.4581602166897539
Energy: 0.6587031178534898
Energy: 0.4581602166897539
Energy: 0.5675871413622612
Energy: 0.4587021641178894
Energy: 0.8315702175578885
Energy: 0.4587021641178894
Energy: 0.5055271890653109
Energy: 0.4544909620665712
Energy: 0.8208512976903681
Energy: 0.45449096195822863
Energy: 0.5098921153186847
Energy: 0.4591283725767232
Energy: 0.8331025290844153
Energy: 0.4591283725767232
Energy: 0.5098411811552708
Energy: 0.45410244555966817
Energy: 0.65807538715391
Energy: 0.45410244555966817
Energy: 0.5379101862626535
Energy: 0.4527701209032785
Energy: 0.6550047712404903
Energy: 0.4527701209032785
Energy: 0.6096724951044307
Energy: 0.45290936449615365
Energy: 0.658724361241974
Energy: 0.45290936449615365
Energy: 0.6120179093127811
Energy: 0.4594322307911671
Energy: 0.7145717216651282
Energy: 0.45943223079040907
Energy: 0.6908141031536278
Energy: 0.46041402816327015
Energy: 0.6976945638892694
Energy: 0.46041402816327015
Energy: 0.6054937364944764
Energy: 0.5127158508558262
Energy: 0.6607898182016706
Energy: 0.5127158508558262
Energy: 0.7517090637123603
Energy: 0.5103636381177443
Energy: 0.7111009234109972
Energy: 0.5103636381177443
Energy: 0.7595586900607595
Energy: 0.5097201479360624
Energy: 0.7127479902627226
Energy: 0.5097201479360624
Energy: 0.8225727156300389
Energy: 0.46646049884847146
Energy: 0.5702154259305453
Energy: 0.46646049884847146
Energy: 0.7601823088227213
Energy: 0.460685048903334
Energy: 0.5054912359915674
Energy: 0.460685048903334
Energy: 0.7138163755705934
Energy: 0.463067537029307
Energy: 0.5735506340245494
Energy: 0.463067537029307
Energy: 0.7237387687506102
Energy: 0.46055972975551596
Energy: 0.4707328726518745
Energy: 0.46055972975551596
Energy: 0.6734110015620562
Energy: 0.46135989296535235
Energy: 0.4622774941488414
Energy: 0.46135989296535235
Energy: 0.7090229476502328
Energy: 0.46742509724203996
Energy: 0.4650791593726284
Energy: 0.46742509724203996

minimum gb energy = 0.4527701209032785 eV
minimum distance =  2.61970999784884 Angstroms
sigma value = 41


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

Energy: 0.9421695056543032
Energy: 0.4398418922942896
Energy: 0.4195616803648081
Energy: 0.4190825269031378
Energy: 0.7448336982699132
Energy: 0.4153102677189836
Energy: 0.500796468495768
Energy: 0.4153102677189836
Energy: 0.8583100967482017
Energy: 0.41446462835997816
Energy: 0.5014107916403254
Energy: 0.41446462835997816
Energy: 0.7450994309095732
Energy: 0.4185984111738243
Energy: 0.6060822358821624
Energy: 0.4185984111738243
Energy: 0.7992763840040022
Energy: 0.4135543023764067
Energy: 0.6638675474604712
Energy: 0.4135543023764067
Energy: 0.7427087626534213
Energy: 0.415082706644073
Energy: 0.6663563317212454
Energy: 0.4150827066415872
Energy: 0.743573538240851
Energy: 0.45924067592230955
Energy: 0.7405438076594486
Energy: 0.45924067592230955
Energy: 0.6616641503236981
Energy: 0.45973923966685865
Energy: 0.6629074651322484
Energy: 0.4597392396656158
Energy: 0.5827878215658319
Energy: 0.45661865972717436
Energy: 0.7971915313777543
Energy: 0.45661865972717436
Energy: 0.5850005824846004
Energy: 0.4137997143915379
Energy: 0.7404581705212491
Energy: 0.4137997143915379
Energy: 0.5083093496062105
Energy: 0.42016334075935513
Energy: 0.8480885342338251
Energy: 0.42016334075935513
Energy: 0.4963145470090514
Energy: 0.41427187415106853
Energy: 0.7964470897322463
Energy: 0.41427187415106853
Energy: 0.5080945273599041
Energy: 0.4159898905736079
Energy: 0.7985510014175609
Energy: 0.4159898905736079
Energy: 0.41835527448966725
Energy: 0.42176725131933035
Energy: 0.7467807880742073
Energy: 0.42176725131995174
Energy: 0.41622846919837025
Energy: 0.415070609847709
Energy: 0.7394728041237393
Energy: 0.4150706098470876
Energy: 0.41882875921531515
Energy: 0.4174310441355067
Energy: 0.7391976887502847
Energy: 0.4174310441355067
Energy: 0.4969353915129629
Energy: 0.4174721748483671
Energy: 0.7409397504483937
Energy: 0.417472174839667
Energy: 0.49573967146583
Energy: 0.49529491666160846
Energy: 0.8555653982461952
Energy: 0.49529491666160846
Energy: 0.4957898141641064
Energy: 0.4168078202120194
Energy: 0.7414693834448659
Energy: 0.4168078202120194
Energy: 0.6646565758021836
Energy: 0.4156405299219225
Energy: 0.7403769146373083
Energy: 0.4156405299219225
Energy: 0.6660596159798311
Energy: 0.41472077417973074
Energy: 0.7969844995611065
Energy: 0.41472077417600206
Energy: 0.6657238348568499
Energy: 0.41525090549534327
Energy: 0.7446109956622777
Energy: 0.41525090549534327
Energy: 0.7980582087987679
Energy: 0.4566279195783002
Energy: 0.7341430716912275
Energy: 0.45662791957892157
Energy: 0.6625273133765858
Energy: 0.45687999120588235
Energy: 0.666802571182172
Energy: 0.45687999120588235
Energy: 0.795752827547795
Energy: 0.4142939562030874
Energy: 0.5759053960808465
Energy: 0.4142939562037088
Energy: 0.8001767449047851
Energy: 0.41534402497715395
Energy: 0.6637382443541352
Energy: 0.41534402497653256
Energy: 0.806686996201594
Energy: 0.4171250473545307
Energy: 0.49568264542024876
Energy: 0.4171250473545307
Energy: 0.7972953191006478
Energy: 0.49489716872444417
Energy: 0.4947974448029533
Energy: 0.49489716872444417
Energy: 0.8045843055634192
Energy: 0.4192737436833245
Energy: 0.506198027438185
Energy: 0.4192737436833245
Energy: 0.8017405173788038
Energy: 0.41782123353123474
Energy: 0.4141654907413577
Energy: 0.41782123353123474
Energy: 0.7970820948282722
Energy: 0.41466322014214857
Energy: 0.41553108185424414
Energy: 0.41466322014214857
Energy: 0.7410311157988667
Energy: 0.41899015229613135
Energy: 0.4145435209239149
Energy: 0.4189901522955099

minimum gb energy = 0.4135543023764067 eV
minimum distance =  2.62764254478248 Angstroms
sigma value = 15


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

Energy: 0.8212529704018766
Energy: 0.4051533364809275
Energy: 0.3871392718657218
Energy: 0.3873858275977837
Energy: 0.7844863583790006
Energy: 0.384889033880035
Energy: 0.4570929221601576
Energy: 0.3848890338842465
Energy: 0.880138482338538
Energy: 0.38423745932116726
Energy: 0.45638599481686937
Energy: 0.38423745932116726
Energy: 0.7890035522937554
Energy: 0.3869347384927681
Energy: 0.608776323613619
Energy: 0.3869347384927681
Energy: 0.836762274497482
Energy: 0.38285221092501903
Energy: 0.5945606833186076
Energy: 0.38285221092607186
Energy: 0.776128364562503
Energy: 0.3826239973166406
Energy: 0.5976201886620461
Energy: 0.3826239973166406
Energy: 0.663215040059338
Energy: 0.3859429015693067
Energy: 0.719034900783762
Energy: 0.38594290156983313
Energy: 0.7228712321045936
Energy: 0.42246878142918765
Energy: 0.5917642080619063
Energy: 0.42246878142655553
Energy: 0.6637491506782366
Energy: 0.41888124662778575
Energy: 0.7179466249026882
Energy: 0.41888124662778575
Energy: 0.6640019814441649
Energy: 0.5169082555215301
Energy: 0.8263282408147098
Energy: 0.5169082555215301
Energy: 0.6050469086093709
Energy: 0.386031602919989
Energy: 0.7434054665397187
Energy: 0.3860316029205154
Energy: 0.5203738273925791
Energy: 0.38202226871140216
Energy: 0.8253910967561895
Energy: 0.38202226871140216
Energy: 0.5944603995140846
Energy: 0.3838161068322149
Energy: 0.8267830707047911
Energy: 0.3838161068353736
Energy: 0.4508598531689227
Energy: 0.3868295795194224
Energy: 0.7266527488127098
Energy: 0.3868295795199489
Energy: 0.45197838397850454
Energy: 0.38292710981986466
Energy: 0.8316349824887275
Energy: 0.38292710981986466
Energy: 0.46577848169380565
Energy: 0.38567936939698905
Energy: 0.7877272411088174
Energy: 0.3856793693975155
Energy: 0.382280958244745
Energy: 0.38749894638375915
Energy: 0.7912785020483915
Energy: 0.38749894638375915
Energy: 0.3828562763500779
Energy: 0.3829448075020657
Energy: 0.8335971428012634
Energy: 0.3829448075020657
Energy: 0.39134966297630774
Energy: 0.38691251247467884
Energy: 0.7847992452119835
Energy: 0.38691251247467884
Energy: 0.45842449850987543
Energy: 0.38586874769590795
Energy: 0.8821254001343641
Energy: 0.38586874769590795
Energy: 0.45041981804157255
Energy: 0.38314191286212923
Energy: 0.8769592868193608
Energy: 0.38314191286212923
Energy: 0.45953467513286084
Energy: 0.3864369192632627
Energy: 0.787643411653645
Energy: 0.3864369192632627
Energy: 0.5956079193819684
Energy: 0.3839668415345076
Energy: 0.7823965049275401
Energy: 0.3839668415345076
Energy: 0.5930486326863874
Energy: 0.3821831267406498
Energy: 0.82580109218211
Energy: 0.38218312680377525
Energy: 0.5952869402902224
Energy: 0.3854738921596377
Energy: 0.6660013874063841
Energy: 0.38547389215911115
Energy: 0.7200616489529286
Energy: 0.5170774000145388
Energy: 0.7857187151884782
Energy: 0.5170774000150652
Energy: 0.5930289264968726
Energy: 0.419143838653912
Energy: 0.7223760829936351
Energy: 0.419143838653912
Energy: 0.7221627749327214
Energy: 0.4216505855598881
Energy: 0.6660189931600674
Energy: 0.4216505855604146
Energy: 0.7257378584167449
Energy: 0.3837549169187356
Energy: 0.7184266728767784
Energy: 0.3837549168892786
Energy: 0.7244624964022632
Energy: 0.38283836234100777
Energy: 0.5948709310614957
Energy: 0.3828383623415342
Energy: 0.8291309673195302
Energy: 0.4518514313055582
Energy: 0.5202339468583295
Energy: 0.4518514313055582
Energy: 0.7259436614296785
Energy: 0.3869419546621109
Energy: 0.5937706800617166
Energy: 0.3869419546621109
Energy: 0.8273371178362966
Energy: 0.38404545606781254
Energy: 0.45522247325065734
Energy: 0.3840454560672861
Energy: 0.8296960895918452
Energy: 0.38426978281503077
Energy: 0.4536885818198264
Energy: 0.38426978281450436
Energy: 0.7850276764108894
Energy: 0.39031567541192486
Energy: 0.39468528319328233
Energy: 0.39031567540823975
Energy: 0.8289602129992041
Energy: 0.3840329169721181
Energy: 0.38610544600642444
Energy: 0.3840329169721181
Energy: 0.8335469074566327
Energy: 0.3846063371706633
Energy: 0.3871950938581101
Energy: 0.3846063371706633

minimum gb energy = 0.38202226871140216 eV
minimum distance =  2.63118028915904 Angstroms
sigma value = 85


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

Energy: 0.8976358695490165
Energy: 0.3776801794835237
Energy: 0.3498915446310919
Energy: 0.350080085047242
Energy: 0.8429771866410589
Energy: 0.3490968350106972
Energy: 0.4072239979864826
Energy: 0.3490968350106972
Energy: 0.8175491358369353
Energy: 0.3487739203574495
Energy: 0.4070952419758285
Energy: 0.3487739203574495
Energy: 0.724925471630401
Energy: 0.3477697026540325
Energy: 0.5364719336870503
Energy: 0.3477697026581418
Energy: 0.8423496786696538
Energy: 0.3768826731373744
Energy: 0.5331855634300176
Energy: 0.3768826731373744
Energy: 0.726900220536468
Energy: 0.3481269108913446
Energy: 0.537573875380791
Energy: 0.34812691089180114
Energy: 0.7229831553553786
Energy: 0.34858603448350745
Energy: 0.649194188288377
Energy: 0.3485860344825943
Energy: 0.7497250493505004
Energy: 0.34769632677314316
Energy: 0.5600466094744504
Energy: 0.3476963267804486
Energy: 0.7219816014968798
Energy: 0.34849160761195874
Energy: 0.6483258801932703
Energy: 0.34849160759597825
Energy: 0.7229194854426544
Energy: 0.4105494996608931
Energy: 0.7475728026907016
Energy: 0.4105494996586102
Energy: 0.6501690476643196
Energy: 0.3476831010960539
Energy: 0.6926393706901051
Energy: 0.3476831011029026
Energy: 0.6237805181588121
Energy: 0.3476960500499534
Energy: 0.747660283788887
Energy: 0.34769605002851467
Energy: 0.6503280795721862
Energy: 0.3473273255185366
Energy: 0.7692897236327731
Energy: 0.34732732551899315
Energy: 0.5323888569359809
Energy: 0.3491038521661022
Energy: 0.6735952540500701
Energy: 0.34910385216564555
Energy: 0.4965989530635074
Energy: 0.3471715449810727
Energy: 0.8370027478504685
Energy: 0.3471715449819859
Energy: 0.5327019968321418
Energy: 0.3489220126374541
Energy: 0.7681227675640688
Energy: 0.3489220126379108
Energy: 0.4112055598570346
Energy: 0.3478504503944134
Energy: 0.7705810324582612
Energy: 0.3478504503944134
Energy: 0.40910434787820416
Energy: 0.34788817504444647
Energy: 0.8604950843450714
Energy: 0.34788817504444647
Energy: 0.4115480452293836
Energy: 0.34722554414879697
Energy: 0.8208517265172003
Energy: 0.34722554414879697
Energy: 0.3761580465321542
Energy: 0.34719373107673146
Energy: 0.8435859712545692
Energy: 0.3471937310762748
Energy: 0.37634729623413316
Energy: 0.37653364387487576
Energy: 0.8852855334863359
Energy: 0.37653364387487576
Energy: 0.3762923947595007
Energy: 0.34569076435131907
Energy: 0.7911884793504497
Energy: 0.34569076435131907
Energy: 0.4355719096777248
Energy: 0.34783889648286714
Energy: 0.8797060480251452
Energy: 0.34783889648286714
Energy: 0.43820293433585134
Energy: 0.34731096167836495
Energy: 0.8819150029156129
Energy: 0.34731096167836495
Energy: 0.4363599280056337
Energy: 0.346950889348207
Energy: 0.7250372011451158
Energy: 0.3469508893477504
Energy: 0.5379674007614534
Energy: 0.3475450444994976
Energy: 0.8011532146753916
Energy: 0.3475450444994976
Energy: 0.5359726919647462
Energy: 0.34708239447727307
Energy: 0.8157731444926275
Energy: 0.34708239447681644
Energy: 0.6071939952272767
Energy: 0.3491626680283553
Energy: 0.7252770759762537
Energy: 0.3491626680288119
Energy: 0.6495487712109077
Energy: 0.3470134450053444
Energy: 0.8160114545800434
Energy: 0.34701344298766873
Energy: 0.6495138669942514
Energy: 0.34698825494574975
Energy: 0.7214524680514821
Energy: 0.34698825493159563
Energy: 0.7472235588096983
Energy: 0.4103096105923975
Energy: 0.6212295176298209
Energy: 0.41030961058828824
Energy: 0.6749291148104948
Energy: 0.41041449171186495
Energy: 0.7297758259955045
Energy: 0.4104144917109518
Energy: 0.7486945366143226
Energy: 0.4562386214053484
Energy: 0.6222759278624108
Energy: 0.4562386214053484
Energy: 0.7980664330500339
Energy: 0.3485473383419915
Energy: 0.6222163987875825
Energy: 0.34854733825345524
Energy: 0.6901727691273285
Energy: 0.34987781455929373
Energy: 0.5350984621841375
Energy: 0.3498778145597503
Energy: 0.8398805010304269
Energy: 0.3476529239392449
Energy: 0.533514199431411
Energy: 0.3476529239392449
Energy: 0.8600731260668892
Energy: 0.34823181542009657
Energy: 0.5363430866160236
Energy: 0.34823181542009657
Energy: 0.7676558731112982
Energy: 0.3478617920464704
Energy: 0.4124381967915046
Energy: 0.3478617920464704
Energy: 0.839359650109636
Energy: 0.34772568664867337
Energy: 0.40856872234629754
Energy: 0.34772568664867337
Energy: 0.796599546728524
Energy: 0.3479443175132747
Energy: 0.4072661952506633
Energy: 0.3479443175132747
Energy: 0.7745878028441457
Energy: 0.34782241243080136
Energy: 0.3478827691125872
Energy: 0.34782241243080136
Energy: 0.8642341301807285
Energy: 0.3478336234403326
Energy: 0.3481730379282995
Energy: 0.3478336234403326
Energy: 0.8158981347767432
Energy: 0.34779790036512026
Energy: 0.3491661198647887
Energy: 0.34779790036512026

minimum gb energy = 0.34569076435131907 eV
minimum distance =  2.61888058446637 Angstroms
sigma value = 113


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

Energy: 0.010223280090488935
Energy: 0.011264638789221484
Energy: 0.6584120433210964
Energy: 0.3034586267787593
Energy: 0.011686394552925502
Energy: 0.08230204938272806
Energy: 0.4348408026648661
Energy: 0.08230204938272806
Energy: 0.010595675377358138
Energy: 0.08186941455250814
Energy: 0.4340172356469317
Energy: 0.08186941455285913
Energy: 0.011552199346437498
Energy: 0.08260806076160007
Energy: 0.43337391538312725
Energy: 0.08260806076195107
Energy: 0.4352402266137801
Energy: 0.08334767137532977
Energy: 0.43490964835756435
Energy: 0.08334767137532977
Energy: 0.010539266508950223
Energy: 0.08156379491607278
Energy: 0.4340347788098263
Energy: 0.08156379491607278

minimum gb energy = 0.010223280090488935 eV
minimum distance =  2.83591435779879 Angstroms
sigma value = 1