Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Au__MO_684444719999_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080053400993348
cohesive_energy=3.9303141206022922
mass=196.9665
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=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.75048867112048e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06388753471942e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.8571615914122e-19, 1.9324813688654397e-19, 7.75272444896358e-20, -6.808321432052279e-20, -2.52634416002388e-19, -4.88748788731602e-19, -7.94386412139978e-19, -1.1952926625592618e-18, -1.72852428335724e-18, -2.4493275292274997e-18]
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: 0.011899075856269564
Energy: 0.012939727909483733
Energy: 0.43000812425425894
Energy: 0.012939727909483733
Energy: 0.012939727909976115
Energy: 0.4428850287459464
Energy: 0.012939727909483733
Energy: 0.4428850287449616
Energy: 0.43000812425425894
Energy: 0.012939727909976115
Energy: 0.011899075856269564
Energy: 0.012939727909976115
Energy: 0.012939727909483733
Energy: 0.4428850287444966
Energy: 0.012939727909976115
Energy: 0.4428850287459464

minimum gb energy = 0.011899075856269564 eV
minimum distance =  2.79621633670427 Angstroms
sigma value = 1


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

Energy: 0.822503525344369
Energy: 0.544314237732512
Energy: 0.5812283679799319
Energy: 0.5443142377343034
Energy: 0.5538738850651611
Energy: 0.5903595084579902
Energy: 0.5482337475088688
Energy: 0.5903595084585873
Energy: 0.5813142504784763
Energy: 0.5807199393318742
Energy: 0.8962877041773698
Energy: 0.5807199393312771
Energy: 0.550213625338759
Energy: 0.5498822810753095
Energy: 0.5483018522915325
Energy: 0.5498822810741151
Energy: 0.7639471133019895
Energy: 0.547592614869571
Energy: 0.549704289822461
Energy: 0.547592614869571
Energy: 0.5716390985962779
Energy: 0.5716869503369997
Energy: 0.5488423602877044
Energy: 0.5716869503364026
Energy: 0.5727455947404261
Energy: 0.5709665558476
Energy: 0.5705330411112399
Energy: 0.5709665558476
Energy: 0.5741672086810934
Energy: 0.5793065414284575
Energy: 0.5927395899402353
Energy: 0.5793065414278603
Energy: 0.5811607564364292
Energy: 0.5766982570098065
Energy: 0.5817201879312749
Energy: 0.5766982570098065
Energy: 0.589272117262985
Energy: 0.5788562323404389
Energy: 0.5827120137265626
Energy: 0.5788562323398417
Energy: 0.5801890078269901
Energy: 0.57658503029216
Energy: 0.5815489326205486
Energy: 0.57658503029216
Energy: 0.5763763859219362
Energy: 0.5754254901330405
Energy: 0.5911392534095042
Energy: 0.5754254901324435
Energy: 0.5834695759827908
Energy: 0.5704033655530107
Energy: 0.5550350087994975
Energy: 0.5704033655536078
Energy: 0.5720061728221463
Energy: 0.5711004271848639
Energy: 0.5725432173514328
Energy: 0.5711004271848639
Energy: 0.555610893693431
Energy: 0.5476928150781027
Energy: 0.5484252295912998
Energy: 0.5476928150769086
Energy: 0.5615589518661571
Energy: 0.5504105084469408
Energy: 0.5491608280430256
Energy: 0.5504105084457465
Energy: 0.5810194980904696
Energy: 0.5807913285230685
Energy: 0.5407105818861161
Energy: 0.5807913285236657
Energy: 0.5480643371029552
Energy: 0.5480743343373715
Energy: 0.5540668558498159
Energy: 0.5480743343367744
Energy: 0.5487338388702883
Energy: 0.5805011100071171
Energy: 0.5818101039138125
Energy: 0.5805011100065199
Energy: 0.5717576270634911
Energy: 0.5499303379169446
Energy: 0.5497449928287018
Energy: 0.5499303379163474
Energy: 0.5504212478383109
Energy: 0.5493072189660422
Energy: 0.5698296104401879
Energy: 0.5493072189660422
Energy: 0.5489704926525263
Energy: 0.5489201612887369
Energy: 0.571307542328335
Energy: 0.5489201612887369
Energy: 0.5698651512690283
Energy: 0.5711568406786813
Energy: 0.5711540154567839
Energy: 0.5711568406786813
Energy: 0.5870263388573294
Energy: 0.5742796818352363
Energy: 0.5721252682613658
Energy: 0.5742796818358332
Energy: 0.5819010635403421
Energy: 0.576897982782732
Energy: 0.6570735800337519
Energy: 0.576897982782732
Energy: 0.5827321761149419
Energy: 0.574927377670727
Energy: 0.5901229458413738
Energy: 0.5749273776701299
Energy: 0.581740686994979
Energy: 0.5765918537118583
Energy: 0.5800132459345461
Energy: 0.5765918537118583
Energy: 0.5916209052594443
Energy: 0.5753013172428844
Energy: 0.5716303019862042
Energy: 0.5753013172434814
Energy: 0.5550349965985166
Energy: 0.5704624948006286
Energy: 0.5838696993250375
Energy: 0.5704624948018229
Energy: 0.5725861529269892
Energy: 0.5721031641171378
Energy: 0.5729611295561041
Energy: 0.5721031641171378
Energy: 0.547933522075797
Energy: 0.5477795603945212
Energy: 0.5544589596122035
Energy: 0.5477795603933269
Energy: 0.5490380315404751
Energy: 0.5478492748364355
Energy: 0.5616572693791417
Energy: 0.5478492748370326
Energy: 0.5409348163796187
Energy: 0.5492603664017262
Energy: 0.5816192049242453
Energy: 0.549260366401129

minimum gb energy = 0.5407105818861161 eV
minimum distance =  2.54999719974373 Angstroms
sigma value = 1


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

Energy: 0.9391168703300798
Energy: 0.5663853210460799
Energy: 0.6078587837674474
Energy: 0.5663853210392714
Energy: 0.5833214114527983
Energy: 0.6153976312575254
Energy: 0.5744886365595709
Energy: 0.6153976312541212
Energy: 0.6076205639571519
Energy: 0.6085083216388794
Energy: 0.5738441966875504
Energy: 0.6085083216368369
Energy: 0.5754318305717986
Energy: 0.573904599266825
Energy: 0.5742979869577418
Energy: 0.5739045992647824
Energy: 0.5743980333084925
Energy: 0.5735522145764516
Energy: 0.5742321373634742
Energy: 0.5735522145812176
Energy: 0.6003990895971436
Energy: 0.640803827533136
Energy: 0.5743331908700638
Energy: 0.6408038275344977
Energy: 0.6016844833894299
Energy: 0.6023620674764679
Energy: 0.5998568916341641
Energy: 0.6023620674744253
Energy: 0.6016892002277185
Energy: 0.6192413465781248
Energy: 0.6215024408786951
Energy: 0.6192413465794865
Energy: 0.6013958303735302
Energy: 0.6076522352945684
Energy: 0.6088131345647442
Energy: 0.6076522352925259
Energy: 0.6200784198796556
Energy: 0.6084283258689557
Energy: 0.6038662472627128
Energy: 0.6084283258662323
Energy: 0.5854397031030988
Energy: 0.6017234831154916
Energy: 0.6212007050658758
Energy: 0.601723483113449
Energy: 0.5846939697340651
Energy: 0.6044536633074398
Energy: 0.6008831938015944
Energy: 0.6044536633047164
Energy: 0.574409621586167
Energy: 0.5736089060877891
Energy: 0.5841484007809022
Energy: 0.57360890608847
Energy: 0.5741482875173057
Energy: 0.5736923801125992
Energy: 0.5634962821465965
Energy: 0.5736923801071522
Energy: 0.5624695314484861
Energy: 0.6081075315848041
Energy: 0.6075554842642715
Energy: 0.6081075315834423
Energy: 0.5836247417627292
Energy: 0.5736387324741914
Energy: 0.5742499449700613
Energy: 0.573638732471468
Energy: 0.6093518962282016
Energy: 0.6083768210505481
Energy: 0.5747396498770004
Energy: 0.6083768210485055
Energy: 0.5752607119698327
Energy: 0.5736599810009532
Energy: 0.6005695676981874
Energy: 0.5736599810043574
Energy: 0.5745660171613604
Energy: 0.5757567784236073
Energy: 0.5765878857935763
Energy: 0.5757567784202029
Energy: 0.6006590250781547
Energy: 0.5736304300217668
Energy: 0.57396940161563
Energy: 0.5736304300231285
Energy: 0.6012036329955056
Energy: 0.6188336913334991
Energy: 0.6001146596774019
Energy: 0.6188336913375533
Energy: 0.6002066186453339
Energy: 0.6057948399161673
Energy: 0.615790081906272
Energy: 0.6057948399168481
Energy: 0.6011254707500413
Energy: 0.6078059684797225
Energy: 0.6083585891876846
Energy: 0.6078059684797225
Energy: 0.61927844237267
Energy: 0.6076650976624349
Energy: 0.6010661644318892
Energy: 0.6076650976651583
Energy: 0.5848498057578213
Energy: 0.6017507260320071
Energy: 0.6217414768641858
Energy: 0.6017507260306454
Energy: 0.5842040955386335
Energy: 0.6031454010996482
Energy: 0.6026702480567689
Energy: 0.6031454011010099
Energy: 0.5738577689703627
Energy: 0.5734627864066238
Energy: 0.5833374209498303
Energy: 0.573462786405943
Energy: 0.5742636236526374
Energy: 0.5737645670375427
Energy: 0.5634045575060086
Energy: 0.5737645670327768
Energy: 0.5624433886798413
Energy: 0.5753834283250404
Energy: 0.6082162218363961
Energy: 0.5753834283291255

minimum gb energy = 0.5624433886798413 eV
minimum distance =  2.54884734492917 Angstroms
sigma value = 25


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

Energy: 0.8954899567436223
Energy: 0.5891800610483353
Energy: 0.6383516788406542
Energy: 0.5891800610483353
Energy: 0.6184388871960713
Energy: 0.641995744808572
Energy: 0.6029938619146243
Energy: 0.641995744808572
Energy: 0.6378530396532293
Energy: 0.6381962058865162
Energy: 0.6021157846351863
Energy: 0.6381962058865162
Energy: 0.6049907994595516
Energy: 0.6022464106238126
Energy: 0.6028460343015468
Energy: 0.6022464106230212
Energy: 0.60258806777913
Energy: 0.6019170563338052
Energy: 0.6027548763584919
Energy: 0.6019170563338052
Energy: 0.6286642812100021
Energy: 0.6616863614796369
Energy: 0.6034675774158561
Energy: 0.6616863614780539
Energy: 0.6320068317770974
Energy: 0.6496543317005076
Energy: 0.6274578591213369
Energy: 0.6496543317012992
Energy: 0.6284867412051839
Energy: 0.6433585471679567
Energy: 0.6214326295528031
Energy: 0.6433585471671651
Energy: 0.6300673089709029
Energy: 0.6484241526943998
Energy: 0.6196681918173721
Energy: 0.6484241526951914
Energy: 0.6286108250052235
Energy: 0.6469974906344436
Energy: 0.6025586527087842
Energy: 0.6469974906352349
Energy: 0.5848710050725948
Energy: 0.6021369732685253
Energy: 0.601239798235739
Energy: 0.6021369732685253
Energy: 0.5848917247873104
Energy: 0.6023238926690172
Energy: 0.6025478070471421
Energy: 0.6023238926682258
Energy: 0.637392864313025
Energy: 0.6387271253801269
Energy: 0.58443729211831
Energy: 0.6387271253801269
Energy: 0.6027239534340252
Energy: 0.6022736939906599
Energy: 0.6192433605869979
Energy: 0.602273693995409
Energy: 0.6021303374028125
Energy: 0.6389216959444403
Energy: 0.6403466705609753
Energy: 0.6389216959436488
Energy: 0.628684764611411
Energy: 0.6025906582826448
Energy: 0.604598813644647
Energy: 0.6025906582826448
Energy: 0.6055639709009132
Energy: 0.6049380088496282
Energy: 0.6026433533278986
Energy: 0.6049380088464623
Energy: 0.6031289393558605
Energy: 0.6022437978379998
Energy: 0.629467016041698
Energy: 0.602243797838791
Energy: 0.6267129839426478
Energy: 0.6529702622622253
Energy: 0.6305063566074276
Energy: 0.6529702622614341
Energy: 0.622484241791784
Energy: 0.6467305361294315
Energy: 0.6294477317443596
Energy: 0.6467305361310144
Energy: 0.6185680294830772
Energy: 0.6482965140796425
Energy: 0.6285812463937954
Energy: 0.6482965140796425
Energy: 0.6191278837762773
Energy: 0.6482404050933622
Energy: 0.6287515123664587
Energy: 0.6482404050941538
Energy: 0.6007698189659877
Energy: 0.602209233947757
Energy: 0.5846600807310743
Energy: 0.602209233947757
Energy: 0.6026616815014224
Energy: 0.6022965784179621
Energy: 0.5848192288271179
Energy: 0.6022965784171705
Energy: 0.5842205802999109
Energy: 0.604497492655216
Energy: 0.6395297927891962
Energy: 0.604497492655216

minimum gb energy = 0.5842205802999109 eV
minimum distance =  2.5419434873498 Angstroms
sigma value = 9


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

Energy: 0.8296915018645784
Energy: 0.610263811874143
Energy: 0.6694547451032725
Energy: 0.6102638118731989
Energy: 0.6596996863043086
Energy: 0.6673244458208502
Energy: 0.6369509257008974
Energy: 0.6673244458227384
Energy: 0.6688491847579018
Energy: 0.668649991903778
Energy: 0.6669677743292113
Energy: 0.6686499919075548
Energy: 0.6343312132787721
Energy: 0.6372566278501469
Energy: 0.6364867982980636
Energy: 0.6372566278492028
Energy: 0.6339509031233992
Energy: 0.63761573688536
Energy: 0.6355565614060836
Energy: 0.6376157368834717
Energy: 0.6353114430988756
Energy: 0.6976496281172
Energy: 0.6383287317335175
Energy: 0.6976496281162559
Energy: 0.6619152691360096
Energy: 0.6910624957956606
Energy: 0.6366856358678911
Energy: 0.6910624957984932
Energy: 0.6372671292613661
Energy: 0.6922542851021928
Energy: 0.6390775094063531
Energy: 0.6922542851012485
Energy: 0.6350261546799131
Energy: 0.6375754633740046
Energy: 0.6047562729569113
Energy: 0.6375754633721162
Energy: 0.6366522324206798
Energy: 0.6369131271730514
Energy: 0.6043166089543809
Energy: 0.6369131271739955
Energy: 0.6033752641504567
Energy: 0.668999053953429
Energy: 0.6681597348965288
Energy: 0.6689990539505966
Energy: 0.6600888213336158
Energy: 0.6366869532902254
Energy: 0.6370729625133051
Energy: 0.6366869532892812
Energy: 0.6696900281741887
Energy: 0.6689367588945061
Energy: 0.6670454344139803
Energy: 0.6689367588954501
Energy: 0.6338783028020197
Energy: 0.6367078977588573
Energy: 0.6320103648334793
Energy: 0.6367078977598013
Energy: 0.6339995756119474
Energy: 0.6352006174990026
Energy: 0.637714773974777
Energy: 0.6352006174999467
Energy: 0.6354161641169613
Energy: 0.6380615665934356
Energy: 0.6367202832484972
Energy: 0.638061566595324
Energy: 0.6604556222995721
Energy: 0.6937211504362991
Energy: 0.6364235002927547
Energy: 0.6937211504372433
Energy: 0.6592604711960299
Energy: 0.6921815415856285
Energy: 0.6376758346422644
Energy: 0.6921815415856285
Energy: 0.6348336797487513
Energy: 0.6377323644050442
Energy: 0.604170649742481
Energy: 0.6377323644059884
Energy: 0.6365270858762101
Energy: 0.6372506587662922
Energy: 0.6041367476873585
Energy: 0.6372506587662922
Energy: 0.6032345674449846
Energy: 0.6344285086214985
Energy: 0.669426658546846
Energy: 0.6344285086205542

minimum gb energy = 0.6032345674449846 eV
minimum distance =  2.55763138867108 Angstroms
sigma value = 25


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

Energy: 0.7382486483202032
Energy: 0.6310718461111469
Energy: 0.7030641043011943
Energy: 0.6310718461123145
Energy: 0.6246431599221721
Energy: 0.6715840891343147
Energy: 0.6415497912259602
Energy: 0.6715840891343147
Energy: 0.702028282354722
Energy: 0.7020063886557928
Energy: 0.6996092885480939
Energy: 0.7020063886569605
Energy: 0.6275883325011528
Energy: 0.6720366239340424
Energy: 0.6421790702489284
Energy: 0.6720366239340424
Energy: 0.6393440047796687
Energy: 0.6919475790719107
Energy: 0.6442251202133739
Energy: 0.6919475790719107
Energy: 0.6266825379734057
Energy: 0.6959002065448168
Energy: 0.6412342688677842
Energy: 0.6959002065448168
Energy: 0.624065126931362
Energy: 0.6913519837598677
Energy: 0.6422120150269681
Energy: 0.6913519837598677
Energy: 0.6236697883530756
Energy: 0.6899400651411952
Energy: 0.6439510666126803
Energy: 0.689940065142363
Energy: 0.7013277199532071
Energy: 0.7024142407703297
Energy: 0.7705207802059502
Energy: 0.7024142407703297
Energy: 0.6437147928273651
Energy: 0.6910093476718451
Energy: 0.6238335151271724
Energy: 0.6910093476741803
Energy: 0.6995037269856642
Energy: 0.7023957409368194
Energy: 0.7071446849655586
Energy: 0.7023957409379871
Energy: 0.6253192531603537
Energy: 0.6733301118573345
Energy: 0.7144602883179201
Energy: 0.6733301118573345
Energy: 0.641708685113715
Energy: 0.6950844897502153
Energy: 0.6390017958133328
Energy: 0.6950844897490476
Energy: 0.6435089864046453
Energy: 0.6913744623518119
Energy: 0.6283177767535784
Energy: 0.6913744623518119
Energy: 0.6808616341196104
Energy: 0.6903189063803808
Energy: 0.6236610856567689
Energy: 0.6903189063815485
Energy: 0.6418129271931858
Energy: 0.6906750713189367
Energy: 0.623768776650079
Energy: 0.6906750713189367
Energy: 0.700350304982771
Energy: 0.6284068723404509
Energy: 0.7035262822938971
Energy: 0.6284068723392832

minimum gb energy = 0.6236610856567689 eV
minimum distance =  2.61874150014174 Angstroms
sigma value = 17


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

Energy: 1.0296465515826465
Energy: 0.7237250912450516
Energy: 0.766459019557771
Energy: 0.7237250912450516
Energy: 0.6418638991350158
Energy: 0.6845410114075612
Energy: 0.6826556775473188
Energy: 0.6845410114068998
Energy: 0.6844758640085851
Energy: 0.6824089323187956
Energy: 0.7196463870215728
Energy: 0.6824089323187956
Energy: 0.6816629684661176
Energy: 0.7084815935145828
Energy: 0.681927853711233
Energy: 0.7084815935159053
Energy: 0.6836743570810113
Energy: 0.7366257644722997
Energy: 0.6426537261695646
Energy: 0.7366257644709769
Energy: 0.6835144648481246
Energy: 0.7322900774014035
Energy: 0.6833272543467096
Energy: 0.7322900773994195
Energy: 0.7176136138425212
Energy: 0.6820148049780723
Energy: 0.6814453846006082
Energy: 0.6820148049787337
Energy: 0.7239212276358524
Energy: 0.6829166894997123
Energy: 0.6574375431353858
Energy: 0.6829166894997123
Energy: 0.7705784060534862
Energy: 0.7678767035887301
Energy: 0.7202013761636311
Energy: 0.7678767035887301
Energy: 0.7762922794412079
Energy: 0.7218602327398893
Energy: 0.6830805402600162
Energy: 0.7218602327385667
Energy: 0.6818081127274414
Energy: 0.6576209710036731
Energy: 0.6544414119803106
Energy: 0.6576209710030118
Energy: 0.7216871655335885
Energy: 0.674556488908858
Energy: 0.6583525455656214
Energy: 0.6745564889081966
Energy: 0.7203651032646228
Energy: 0.6759577897293699
Energy: 0.6747463566921266
Energy: 0.6759577897287086
Energy: 0.7194207098107852
Energy: 0.6756322720311003
Energy: 0.6551103528975416
Energy: 0.6756322720311003
Energy: 0.7716217600532576
Energy: 0.7229096295588106
Energy: 0.7238749742726441
Energy: 0.7229096295581492
Energy: 0.7672832757436219
Energy: 0.7233315021041167
Energy: 0.7242828664711272
Energy: 0.7233315021034553
Energy: 0.7236305564544436
Energy: 0.6825255102070585
Energy: 0.6821739855655589
Energy: 0.6825255102077198
Energy: 0.7239023070679701
Energy: 0.6824031925118347
Energy: 0.6808625709810942
Energy: 0.6824031925111733
Energy: 0.6868002481534213
Energy: 0.7359775747701854
Energy: 0.6839559515044872
Energy: 0.7359775747701854
Energy: 0.7055918569902031
Energy: 0.7351713625527447
Energy: 0.6839130131032102
Energy: 0.7351713625534062
Energy: 0.6832355423413944
Energy: 0.6843084240720105
Energy: 0.722150407740613
Energy: 0.6843084240713492
Energy: 0.682636684226381
Energy: 0.6827264160729807
Energy: 0.7185914338311891
Energy: 0.6827264160716582
Energy: 0.6823087206086617
Energy: 0.7230579244938421
Energy: 0.6828844850081525
Energy: 0.7230579244945036
Energy: 0.7266005126348749
Energy: 0.7678876411586736
Energy: 0.7671682161565371
Energy: 0.7678876411586736
Energy: 0.6579768692566019
Energy: 0.6755591148501424
Energy: 0.7229174699357193
Energy: 0.6755591148488198
Energy: 0.6576823134562891
Energy: 0.674861404271881
Energy: 0.6819396821834731
Energy: 0.674861404271881
Energy: 0.6534631208812481
Energy: 0.6603363691277602
Energy: 0.7221457023928514
Energy: 0.6603363691277602
Energy: 0.658264187413108
Energy: 0.6742879557865747
Energy: 0.7195350157601497
Energy: 0.6742879557872361
Energy: 0.6586581552831848
Energy: 0.6760105478671088
Energy: 0.7187147777616317
Energy: 0.6760105478684314
Energy: 0.7198047221929895
Energy: 0.768689299854776
Energy: 0.7656104703223932
Energy: 0.76868929985676

minimum gb energy = 0.6418638991350158 eV
minimum distance =  2.60863729894803 Angstroms
sigma value = 53


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

Energy: 0.9314377347397366
Energy: 0.6164536643679455
Energy: 0.7164390947983399
Energy: 0.6164536643649006
Energy: 0.827793940399791
Energy: 0.6485673137338438
Energy: 0.7142803904238607
Energy: 0.6485673137170969
Energy: 0.7147989666726167
Energy: 0.7154497855798253
Energy: 0.7297322787198663
Energy: 0.7154497855798253
Energy: 0.7178986205367429
Energy: 0.6490759606661783
Energy: 0.7227151183571331
Energy: 0.649075960678358
Energy: 0.7166920272263433
Energy: 0.6490198733436294
Energy: 0.6128863801153502
Energy: 0.6490198733497192
Energy: 0.7274698236978892
Energy: 0.6501319621371698
Energy: 0.6175910529619024
Energy: 0.6501319621432595
Energy: 0.8233587784372963
Energy: 0.7155329716869575
Energy: 0.7138101181553511
Energy: 0.7155329716869575
Energy: 0.8066095671763276
Energy: 0.6494514244453377
Energy: 0.7239945878204944
Energy: 0.6494514244453377
Energy: 0.7152904055978517
Energy: 0.7153238270822568
Energy: 0.7304384455783818
Energy: 0.7153238270807345
Energy: 0.7208058908603473
Energy: 0.6496151831910711
Energy: 0.7277811744882625
Energy: 0.6496151831910711
Energy: 0.7148156959910553
Energy: 0.652268896033976
Energy: 0.6201782939034296
Energy: 0.6522688960507229
Energy: 0.726737867372235
Energy: 0.6485503046132297
Energy: 0.6088112012534392
Energy: 0.6485503046147519
Energy: 0.8067216493920145
Energy: 0.6500080060010253
Energy: 0.7231067410002042
Energy: 0.6500080059964578

minimum gb energy = 0.6088112012534392 eV
minimum distance =  2.60813479190062 Angstroms
sigma value = 9


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

Energy: 0.9078895480645167
Energy: 0.7464855615148599
Energy: 0.7997808025692229
Energy: 0.7464855615148599
Energy: 0.7058185794601552
Energy: 0.6684031506010734
Energy: 0.8044944209787255
Energy: 0.6684031506044544
Energy: 0.6724452054089474
Energy: 0.6695474563728494
Energy: 0.7959067582211931
Energy: 0.6695474563756668
Energy: 0.669796941994479
Energy: 0.6691321436173783
Energy: 0.8544213960514658
Energy: 0.6691321436185053
Energy: 0.6676477210109316
Energy: 0.6672918915909203
Energy: 0.859461482197338
Energy: 0.6672918915920473
Energy: 0.6677546622295666
Energy: 0.6667872702650234
Energy: 0.8566611219044963
Energy: 0.6667872702655867
Energy: 0.802226384615476
Energy: 0.7957639427198802
Energy: 0.8058850301393671
Energy: 0.7957639427187533
Energy: 0.8027053300448306
Energy: 0.7338982138691426
Energy: 0.7953895032310287
Energy: 0.7338982138702695
Energy: 0.7035239200614782
Energy: 0.7434983317045631
Energy: 0.7207258258938923
Energy: 0.7434983317051266
Energy: 0.6678314479821094
Energy: 0.73351793392764
Energy: 0.797543795797654
Energy: 0.733517933928767
Energy: 0.7026874406760714
Energy: 0.7042579945878487
Energy: 0.7585687620985393
Energy: 0.7042579945889755
Energy: 0.7095483018608728
Energy: 0.7478137135723787
Energy: 0.8497540476594794
Energy: 0.7478137135735057
Energy: 0.8039159698883601
Energy: 0.7034934144397985
Energy: 0.7131159297173607
Energy: 0.7034934144414888
Energy: 0.8029533282455009
Energy: 0.7036124078091711
Energy: 0.7024123534838558
Energy: 0.7036124078080442
Energy: 0.7946820006662163
Energy: 0.6983417663404214
Energy: 0.7085683950912817
Energy: 0.698341766339858
Energy: 0.7392132132724367
Energy: 0.7438818199468987
Energy: 0.7098768912054322
Energy: 0.7438818199457717
Energy: 0.7966178602899303
Energy: 0.6682756360930322
Energy: 0.704314884988442
Energy: 0.6682756360919052
Energy: 0.7985717771872393
Energy: 0.7987533631067752
Energy: 0.8518562758503051
Energy: 0.7987533631090292
Energy: 0.8051839558656816
Energy: 0.6687882321854476
Energy: 0.7053015268538266
Energy: 0.668788232183757
Energy: 0.8440694855331833
Energy: 0.6705817618143262
Energy: 0.6722787853623605
Energy: 0.6705817618131992
Energy: 0.8071755086258898
Energy: 0.6684552994517785
Energy: 0.6689926407672425
Energy: 0.668455299450088
Energy: 0.8570157278841506
Energy: 0.6669388204694247
Energy: 0.6670997087855093
Energy: 0.6669388204688612
Energy: 0.8588483444277801
Energy: 0.6672168856131666
Energy: 0.6677426638636164
Energy: 0.6672168856131666
Energy: 0.806934472657389
Energy: 0.7964487632949621
Energy: 0.8025995969556359
Energy: 0.7964487632938351
Energy: 0.7959535469590437
Energy: 0.7379948643875354
Energy: 0.802514473510355
Energy: 0.7379948643869718
Energy: 0.7118931676383732
Energy: 0.7417918279472676
Energy: 0.7023779331300729
Energy: 0.7417918279472676
Energy: 0.7984503589393313
Energy: 0.7330811047105948
Energy: 0.6677206820394265
Energy: 0.7330811047083409
Energy: 0.7582242823576439
Energy: 0.7007054269356195
Energy: 0.7026724616663741
Energy: 0.7007054269350561
Energy: 0.8520888022815414
Energy: 0.7086680186032867
Energy: 0.7124768027506047
Energy: 0.7086680186038501
Energy: 0.7142317163478964
Energy: 0.6947249624125931
Energy: 0.8094239916993132
Energy: 0.6947249624131565
Energy: 0.703658745703219
Energy: 0.7031532865387768
Energy: 0.7946018926108983
Energy: 0.7031532865382134
Energy: 0.7062666408210779
Energy: 0.6987806988293978
Energy: 0.7974068820958282
Energy: 0.6987806988277072
Energy: 0.710402119307267
Energy: 0.7429431482508126
Energy: 0.738862012073017
Energy: 0.7429431482496857
Energy: 0.7031904933076111
Energy: 0.6698522176029152
Energy: 0.7421829903854756
Energy: 0.6698522176000978
Energy: 0.8508702454935877
Energy: 0.7960096205380967
Energy: 0.7977445230850021
Energy: 0.7960096205364063

minimum gb energy = 0.6667872702650234 eV
minimum distance =  2.59189431983756 Angstroms
sigma value = 73


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

Energy: 0.960522017525201
Energy: 0.71073483939538
Energy: 0.7699070827305282
Energy: 0.710734839397168
Energy: 0.709669992859783
Energy: 0.6782906426511476
Energy: 0.7601598903159276
Energy: 0.6782906426511476
Energy: 0.680628241386141
Energy: 0.6798544891165583
Energy: 0.7837385362165236
Energy: 0.6798544891165583
Energy: 0.6776755616458797
Energy: 0.678650349950679
Energy: 0.8391869616772042
Energy: 0.678650349951573
Energy: 0.6793130705933988
Energy: 0.6799989276343841
Energy: 0.8137388998188974
Energy: 0.67999892763349
Energy: 0.7188527655491505
Energy: 0.6800092877415298
Energy: 0.7996339007834078
Energy: 0.6800092877406358
Energy: 0.7551862582343005
Energy: 0.7808932632773162
Energy: 0.7915814720084772
Energy: 0.7808932632782103
Energy: 0.7170814077788675
Energy: 0.744033453249945
Energy: 0.7804607278160809
Energy: 0.7440334532490509
Energy: 0.711404215918632
Energy: 0.7454464863494276
Energy: 0.7817063966880505
Energy: 0.7454464863485334
Energy: 0.7161150200306236
Energy: 0.6967434817628646
Energy: 0.7808520976283189
Energy: 0.6967434817601826
Energy: 0.7028505602491533
Energy: 0.6626172117891914
Energy: 0.6706706984208126
Energy: 0.6626172117882974
Energy: 0.7016314431178483
Energy: 0.6633363622123241
Energy: 0.8248287234158548
Energy: 0.663336362213218
Energy: 0.7863318100031047
Energy: 0.7060086624534717
Energy: 0.7030615387496238
Energy: 0.7060086624516837
Energy: 0.7832262269397224
Energy: 0.7062105232438117
Energy: 0.7028063301098615
Energy: 0.7062105232455997
Energy: 0.7913771605021881
Energy: 0.7351869504808105
Energy: 0.7022427411598269
Energy: 0.7351869504808105
Energy: 0.8334520079867719
Energy: 0.703210039395272
Energy: 0.7022345012247857
Energy: 0.7032100393908021
Energy: 0.8347033032798872
Energy: 0.7389975412740212
Energy: 0.703010937113292
Energy: 0.7389975412722332
Energy: 0.7711683821153366
Energy: 0.7660011227074687
Energy: 0.7552525486445024
Energy: 0.7660011227056807
Energy: 0.7577508889367566
Energy: 0.7219828856053961
Energy: 0.7539977144469636
Energy: 0.7219828856062902
Energy: 0.7746319561202076
Energy: 0.7217897747765749
Energy: 0.7574424755948849
Energy: 0.7217897747765749
Energy: 0.7587062989935541
Energy: 0.722961965353098
Energy: 0.7101378115915341
Energy: 0.722961965353098
Energy: 0.7981793410778428
Energy: 0.7548062159953259
Energy: 0.7552801965408759
Energy: 0.754806215992644

minimum gb energy = 0.6626172117882974 eV
minimum distance =  2.55910238577828 Angstroms
sigma value = 7


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

Energy: 1.1127962380609109
Energy: 0.6890115295017357
Energy: 0.773074072734736
Energy: 0.6890115294992071
Energy: 0.7411963178386572
Energy: 0.6819197213775529
Energy: 0.7531694163990774
Energy: 0.6819197213750242
Energy: 0.6781928412196173
Energy: 0.6810426216020896
Energy: 0.7533388514139387
Energy: 0.6810426215957679
Energy: 0.6795176712665901
Energy: 0.680317533339291
Energy: 0.8224518057572152
Energy: 0.6803175333367624
Energy: 0.6796369366354853
Energy: 0.6797502499608953
Energy: 0.8096701181630311
Energy: 0.6797502499627919
Energy: 0.6809125199399033
Energy: 0.6807390490557833
Energy: 0.808032908181517
Energy: 0.6807390490576798
Energy: 0.7533059905868781
Energy: 0.6796812240614233
Energy: 0.680674066460946
Energy: 0.6796812240607911
Energy: 0.7507366796596685
Energy: 0.6803388079220252
Energy: 0.679698724407927
Energy: 0.680338807920761
Energy: 0.8224266326578763
Energy: 0.6804425183084136
Energy: 0.6796506573286749
Energy: 0.6804425183090458
Energy: 0.8230258748042608
Energy: 0.6813091816515251
Energy: 0.6786341966759111
Energy: 0.6813091816527893
Energy: 0.7541419278050591
Energy: 0.7239615449996222
Energy: 0.6806583666310148
Energy: 0.723961545002783
Energy: 0.7531464940324697
Energy: 0.751495246047144
Energy: 0.7495748352819488
Energy: 0.7514952460490405
Energy: 0.748813128845306
Energy: 0.7193198246583049
Energy: 0.7513561385360013
Energy: 0.7193198246583049
Energy: 0.7491204193012773
Energy: 0.7193010634270721
Energy: 0.6875993584153014
Energy: 0.7193010634327617
Energy: 0.7513416682090066
Energy: 0.7191696881673474
Energy: 0.6867656533530778
Energy: 0.7191696881667152
Energy: 0.6877732994717032
Energy: 0.7494477188697217
Energy: 0.7529600770407779
Energy: 0.7494477188678252
Energy: 0.688003722956711
Energy: 0.7229933160028267
Energy: 0.7537960347642296
Energy: 0.7229933160047232
Energy: 0.6789038986946776
Energy: 0.6813823510802542
Energy: 0.7556559827797041
Energy: 0.6813823510739325
Energy: 0.6797190924474046
Energy: 0.680668666210437
Energy: 0.8231696029482554
Energy: 0.6806686662079083
Energy: 0.6799770962574828
Energy: 0.6802906949194987
Energy: 0.6890599234981466
Energy: 0.6802906949194987
Energy: 0.6806956206910592
Energy: 0.6797277150210574
Energy: 0.8115250227918537
Energy: 0.6797277150197931
Energy: 0.74967530389776
Energy: 0.6800398705365474
Energy: 0.6809081732177888
Energy: 0.6800398705340187
Energy: 0.750307593792123
Energy: 0.6796956826645114
Energy: 0.6785860286308266
Energy: 0.6796956826569255
Energy: 0.8223913171583276
Energy: 0.6801772340554638
Energy: 0.6796288777866963
Energy: 0.6801772340554638
Energy: 0.820167030035969
Energy: 0.6812043862463038
Energy: 0.6786457860467966
Energy: 0.6812043862469359
Energy: 0.8069834025492714
Energy: 0.6814059453889751
Energy: 0.6808366427461684
Energy: 0.6814059453851823
Energy: 0.7730519935747734
Energy: 0.7734124121071628
Energy: 0.9667589068735389
Energy: 0.7734124121090593
Energy: 0.7479929551171624
Energy: 0.7194350451169885
Energy: 0.7538304710291501
Energy: 0.7194350451157242
Energy: 0.7530899989731492
Energy: 0.7196290828033087
Energy: 0.7487399650371592
Energy: 0.7196290828058375
Energy: 0.7502637483469952
Energy: 0.722161767830101
Energy: 0.6872835573108451
Energy: 0.7221617678345262
Energy: 0.6878146718419883
Energy: 0.749642529471545
Energy: 0.7499098340770293
Energy: 0.7496425294734415

minimum gb energy = 0.6781928412196173 eV
minimum distance =  2.57166420859393 Angstroms
sigma value = 29


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

Energy: 0.6317074560154711
Energy: 0.6336541956974393
Energy: 0.713053516512832
Energy: 0.6336541956931331
Energy: 0.6368371175007216
Energy: 0.688566530318925
Energy: 0.6470342158840334
Energy: 0.688566530318925
Energy: 0.6442362021153236
Energy: 0.6765062079121591
Energy: 0.6345818950026308
Energy: 0.6765062079164653
Energy: 0.6382984194598628
Energy: 0.6429133103882856
Energy: 0.64619172762601
Energy: 0.6429133103947449
Energy: 0.6423493896674631
Energy: 0.6468278246174739
Energy: 0.636453547362138
Energy: 0.6468278246174739
Energy: 0.646783547354006
Energy: 0.6834583401598857
Energy: 0.6378627778610263
Energy: 0.6834583401676417
Energy: 0.6339834343815022
Energy: 0.6752569015860099
Energy: 0.6450952132112471
Energy: 0.675256901571379
Energy: 0.6464511011602977
Energy: 0.6473541766621872
Energy: 0.6418200014936858
Energy: 0.64735417666045
Energy: 0.6361501820902812
Energy: 0.6446218354598658
Energy: 0.648853349372027
Energy: 0.6446218354607223

minimum gb energy = 0.6317074560154711 eV
minimum distance =  2.58347039965021 Angstroms
sigma value = 5


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

Energy: 0.874983648715018
Energy: 0.6139724753428288
Energy: 0.7328479886547707
Energy: 0.6139724753416347
Energy: 0.6502423263612365
Energy: 0.6348895724846482
Energy: 0.7279049034156639
Energy: 0.6348895724834538
Energy: 0.7289142575099553
Energy: 0.6828306359826718
Energy: 0.7460706961441967
Energy: 0.6828306359820747
Energy: 0.6504949777313379
Energy: 0.6874793330811548
Energy: 0.7225151275341709
Energy: 0.6874793330817519
Energy: 0.7388768850525862
Energy: 0.6326303805446813
Energy: 0.7433118330618014
Energy: 0.6326303805440843
Energy: 0.6330390173547551
Energy: 0.6355524009441771
Energy: 0.7430963964133125
Energy: 0.635552400944774
Energy: 0.6324862409087761
Energy: 0.6324177207492743
Energy: 0.7226920666935259
Energy: 0.6324177207480799
Energy: 0.6399456330923807
Energy: 0.6351237294272664
Energy: 0.8045690113530768
Energy: 0.6351237294284606
Energy: 0.6541816092009219
Energy: 0.6475389159494512
Energy: 0.7954936314782849
Energy: 0.6475389159506454
Energy: 0.7616585672534885
Energy: 0.6162941492237974
Energy: 0.6211947018363685
Energy: 0.6162941492232002
Energy: 0.6539065443505174
Energy: 0.615529101030124
Energy: 0.6175745043601627
Energy: 0.6155291010307212
Energy: 0.8305804518353428
Energy: 0.6144890270613116
Energy: 0.614824646728725
Energy: 0.6144890270619088
Energy: 0.8356222681831272
Energy: 0.6147209755841155
Energy: 0.6154267028741903
Energy: 0.6147209755841155
Energy: 0.6337481988817615
Energy: 0.6446385262383296
Energy: 0.7440582263683276
Energy: 0.6446385262383296
Energy: 0.6337245474930928
Energy: 0.6322373183704185
Energy: 0.7436840774698821
Energy: 0.6322373183698213
Energy: 0.6358581377837638
Energy: 0.6336115007366425
Energy: 0.7218298833559915
Energy: 0.6336115007366425
Energy: 0.6336362551345602
Energy: 0.6334586654751945
Energy: 0.649743801874259
Energy: 0.6334586654751945
Energy: 0.753439963331748
Energy: 0.6361130136072713
Energy: 0.650472938153083
Energy: 0.6361130136078684
Energy: 0.7305391577543545
Energy: 0.6840896660564624
Energy: 0.7316019334550684
Energy: 0.684089666055268
Energy: 0.7237084134885714
Energy: 0.6857974832484774
Energy: 0.648732286726783
Energy: 0.6857974832484774
Energy: 0.7437322915163432
Energy: 0.6383168958804167
Energy: 0.7229320897135498
Energy: 0.6383168958792224
Energy: 0.7426734245470626
Energy: 0.632792391797105
Energy: 0.6327922664744537
Energy: 0.6327923917959107
Energy: 0.7222997189674919
Energy: 0.6325177379978693
Energy: 0.6334778276802048
Energy: 0.6325177379990635
Energy: 0.8030562056447276
Energy: 0.6338539966850217
Energy: 0.6368438783493909
Energy: 0.6338539966844245
Energy: 0.8308246322730055
Energy: 0.6451187824862268
Energy: 0.6533013343282225
Energy: 0.6451187824868239
Energy: 0.6172693339495258
Energy: 0.6169684641166079
Energy: 0.7617137222236088
Energy: 0.6169684641172052
Energy: 0.6194615676680383
Energy: 0.6164785430138344
Energy: 0.6543719052081605
Energy: 0.6164785430132372
Energy: 0.6150268295337323
Energy: 0.6162056917105105
Energy: 0.6767715938418293
Energy: 0.6162056917117049
Energy: 0.6151692155051721
Energy: 0.6154636080132119
Energy: 0.7916359529405927
Energy: 0.6154636080138091
Energy: 0.743792720897269
Energy: 0.6443319418785234
Energy: 0.6524364592568341
Energy: 0.6443319418785234
Energy: 0.7439146517634093
Energy: 0.632770907744406
Energy: 0.6341019404755045
Energy: 0.6327709077450032
Energy: 0.7216483303785732
Energy: 0.633685540595788
Energy: 0.633311318474086
Energy: 0.6336855405951907
Energy: 0.6509255548249706
Energy: 0.6323568034408926
Energy: 0.6329687405189097
Energy: 0.632356803438504

minimum gb energy = 0.6139724753416347 eV
minimum distance =  2.57116755990684 Angstroms
sigma value = 1


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

Energy: 0.9313166661200735
Energy: 0.578028510372549
Energy: 0.7090834310674404
Energy: 0.5780285103708975
Energy: 0.6219035236799498
Energy: 0.6018774225199507
Energy: 0.7297875428393804
Energy: 0.601877422521602
Energy: 0.7303398320538701
Energy: 0.6641517108935348
Energy: 0.7324722818714382
Energy: 0.6641517108935348
Energy: 0.6190989788552042
Energy: 0.6648358508193523
Energy: 0.7235162090564803
Energy: 0.6648358508177008
Energy: 0.6008617825976433
Energy: 0.5995932212736204
Energy: 0.7275131869918076
Energy: 0.5995932212752717
Energy: 0.6003788365247343
Energy: 0.6018134010142303
Energy: 0.728375405975974
Energy: 0.6018134010175331
Energy: 0.5978322996253799
Energy: 0.5991072197464669
Energy: 0.7243008194790678
Energy: 0.5991072197464669
Energy: 0.6085297710797082
Energy: 0.6042831988112595
Energy: 0.8233464765335665
Energy: 0.6042831988120851
Energy: 0.7259952185472639
Energy: 0.6244338929362755
Energy: 0.8227501421824596
Energy: 0.6244338929337985
Energy: 0.7327327337804725
Energy: 0.6039014716621075
Energy: 0.6166296279732795
Energy: 0.6039014716621075
Energy: 0.7246681552694689
Energy: 0.5994082655791075
Energy: 0.5983522169610497
Energy: 0.5994082655799332
Energy: 0.8208930238881452
Energy: 0.6055948543591535
Energy: 0.6005663110729185
Energy: 0.6055948543616305
Energy: 0.8204846476555018
Energy: 0.5996814572364695
Energy: 0.6002851341218964
Energy: 0.5996814572331669
Energy: 0.7228263589360082
Energy: 0.6643692918923784
Energy: 0.7311366398752679
Energy: 0.6643692918973323
Energy: 0.6208186304594949
Energy: 0.6633457939974174
Energy: 0.7307621475509986
Energy: 0.6633457939982432
Energy: 0.622845296536062
Energy: 0.600851476480266
Energy: 0.7234142714197093
Energy: 0.6008514764794405
Energy: 0.5996610258226305
Energy: 0.6002543539377365
Energy: 0.7293923864353026
Energy: 0.6002543539377365
Energy: 0.6043460462712233
Energy: 0.6034282000631793
Energy: 0.7213898212147998
Energy: 0.6034282000623535
Energy: 0.5983707060174318
Energy: 0.5997148161000669
Energy: 0.822796250696415
Energy: 0.5997148160992414
Energy: 0.6005913446800181
Energy: 0.6076750899215407
Energy: 0.8226464641012431
Energy: 0.6076750899248058
Energy: 0.7282808139609787
Energy: 0.6209836494869653
Energy: 0.601101382296206
Energy: 0.620983649487791
Energy: 0.7299266004376568
Energy: 0.6009518594939117
Energy: 0.6037206956543115
Energy: 0.6009518594922604
Energy: 0.7235479135087041
Energy: 0.5996185776790675
Energy: 0.5995141356238854
Energy: 0.5996185776790675
Energy: 0.8203191927750897
Energy: 0.5998875003566965
Energy: 0.5998284196338464
Energy: 0.5998875003566965

minimum gb energy = 0.5780285103708975 eV
minimum distance =  2.57580159863421 Angstroms
sigma value = 17


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

Energy: 0.9986518284298083
Energy: 0.5836900721235148
Energy: 0.7138775151772225
Energy: 0.5836900721219838
Energy: 0.6312343465043321
Energy: 0.5978962926590515
Energy: 0.6806508499346542
Energy: 0.5978962926595618
Energy: 0.7438072575490539
Energy: 0.6032575758318115
Energy: 0.6990256695982439
Energy: 0.6032575758297701
Energy: 0.7889043916936773
Energy: 0.6250473828514349
Energy: 0.6748813894761079
Energy: 0.6250473828524556
Energy: 0.6623077179050396
Energy: 0.5824628133824294
Energy: 0.7917816964482683
Energy: 0.5824628133814087
Energy: 0.5829365235930094
Energy: 0.581891105135671
Energy: 0.7725982166422097
Energy: 0.581891105135671
Energy: 0.5831240168428101
Energy: 0.5826217294359858
Energy: 0.6095422462310854
Energy: 0.5826217294344547
Energy: 0.5886148856171098
Energy: 0.5837465087924029
Energy: 0.7788991998401684
Energy: 0.5837465087898512
Energy: 0.765520521914669
Energy: 0.5840555371373625
Energy: 0.7428539829891151
Energy: 0.584055537138383
Energy: 0.7014036578162867
Energy: 0.627625631106128
Energy: 0.6880754415887058
Energy: 0.6276256311020455
Energy: 0.7634827521673047
Energy: 0.5959153837140578
Energy: 0.6063660935209304
Energy: 0.595915383712527
Energy: 0.7697548891231102
Energy: 0.59912155189426
Energy: 0.6748995587865168
Energy: 0.5991215518922187
Energy: 0.7763513410015772
Energy: 0.595161852038498
Energy: 0.5963939871488184
Energy: 0.5951618520359465
Energy: 0.6951436202887513
Energy: 0.5956922817351079
Energy: 0.597000541379493
Energy: 0.5956922817345974
Energy: 0.7837529294683042
Energy: 0.5968905778446525
Energy: 0.6027034307986572
Energy: 0.5968905778472041
Energy: 0.78067787332203
Energy: 0.5958469714926731
Energy: 0.5986160779305848
Energy: 0.5958469714916523
Energy: 0.5963362134862084
Energy: 0.6003079443057283
Energy: 0.6897336509052868
Energy: 0.600307923519697
Energy: 0.595644347311087
Energy: 0.5952570979688422
Energy: 0.7670108677929446
Energy: 0.5952570979688422
Energy: 0.6066353045893682
Energy: 0.5977017916276015
Energy: 0.6764295154731244
Energy: 0.5977017916276015
Energy: 0.5964883633605618
Energy: 0.5953554769766833
Energy: 0.6840094536848669
Energy: 0.5953554769766833
Energy: 0.6795734919363503
Energy: 0.5968056330695988
Energy: 0.5963241818930332
Energy: 0.5968056330695988
Energy: 0.6992397424301894
Energy: 0.6011074026136904
Energy: 0.7461057788020096
Energy: 0.6011074026126698
Energy: 0.6748141059149684
Energy: 0.6237161716200592
Energy: 0.7849019768939115
Energy: 0.6237161716190387
Energy: 0.7962520198941963
Energy: 0.5830549825024801
Energy: 0.6618588951832963
Energy: 0.5830549825024801
Energy: 0.7702260528344301
Energy: 0.581982640188904
Energy: 0.5820333524518417
Energy: 0.5819826401868627
Energy: 0.6755176756925996
Energy: 0.5833128329838522
Energy: 0.5859541008751965
Energy: 0.5833128329838522
Energy: 0.5886773680151153
Energy: 0.5840067052448513
Energy: 0.588217810606533
Energy: 0.5840067052468927
Energy: 0.6767630630743801
Energy: 0.5834809360845775
Energy: 0.768021880803296
Energy: 0.5834809360850878
Energy: 0.6816739345697552
Energy: 0.6264824070872518
Energy: 0.6997539140998448
Energy: 0.6264824070887828
Energy: 0.607383804041007
Energy: 0.5951707454318049
Energy: 0.7622953109144335
Energy: 0.5951707454032266
Energy: 0.6743060327404878
Energy: 0.5958203998849244
Energy: 0.772396159557315
Energy: 0.5958203998839039
Energy: 0.5956576222245868
Energy: 0.5956041872109574
Energy: 0.7736469402065522
Energy: 0.5956041872078955
Energy: 0.5954780882269921
Energy: 0.5951209531561765
Energy: 0.6961261567939304
Energy: 0.5951209531561765
Energy: 0.6021657642568407
Energy: 0.598017672747268
Energy: 0.7857092561361805
Energy: 0.5980176727493093
Energy: 0.6997133307959533
Energy: 0.608671351929287
Energy: 0.7947985995902038
Energy: 0.6086713519313284
Energy: 0.8977051179618997
Energy: 0.5992701126006649
Energy: 0.596460821532982
Energy: 0.5992701126011751
Energy: 0.7643782324948878
Energy: 0.5951962261062516
Energy: 0.595982850155482
Energy: 0.5951962261057412
Energy: 0.7439298698303135
Energy: 0.5986444788605517
Energy: 0.5961297251009325
Energy: 0.5986444788590207

minimum gb energy = 0.581891105135671 eV
minimum distance =  2.56563976296747 Angstroms
sigma value = 89


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

Energy: 1.0534275974744316
Energy: 0.5580051856831643
Energy: 0.5425313244084485
Energy: 0.5580051856818289
Energy: 0.5418023343083214
Energy: 0.5887736256437338
Energy: 0.5419394442918335
Energy: 0.5887736256423984
Energy: 0.5360409141802276
Energy: 0.5888269499581462
Energy: 0.5544303777949913
Energy: 0.5888269499581462
Energy: 0.5372412400858988
Energy: 0.5900843286616277
Energy: 0.5410422479962836
Energy: 0.5900843286616277
Energy: 0.5397931088986518
Energy: 0.5398553235420295
Energy: 0.5496625971611571
Energy: 0.5398553235433344
Energy: 0.540920990045809
Energy: 0.5394964933235498
Energy: 0.5491034776293119
Energy: 0.5394964933235498
Energy: 0.5403993989754061
Energy: 0.5390470923863249
Energy: 0.5419970613519876
Energy: 0.5390470923849896
Energy: 0.5419329876868811
Energy: 0.5421662057790482
Energy: 0.5362308145284987
Energy: 0.5421662057790482
Energy: 0.5437373577698442
Energy: 0.541790162915527
Energy: 0.5450730283681587
Energy: 0.5417901629168621
Energy: 0.5561707551746528
Energy: 0.5917074948933008
Energy: 0.5430261864026571
Energy: 0.5917074948919656
Energy: 0.5420253341165279
Energy: 0.5833595062415187
Energy: 0.5348569051621853
Energy: 0.5833595062428539
Energy: 0.5485799168946652
Energy: 0.5414784592401457
Energy: 0.5422542299624744
Energy: 0.5414784592401457
Energy: 0.5507371910673333
Energy: 0.5408628176095981
Energy: 0.5415260131939561
Energy: 0.5408628176109334
Energy: 0.5413444921407176
Energy: 0.5388121820422987
Energy: 0.5390317263210994
Energy: 0.538812182043634
Energy: 0.5359938476524407
Energy: 0.5401109809022548
Energy: 0.5438502834514651
Energy: 0.5401109809022548

minimum gb energy = 0.5348569051621853 eV
minimum distance =  2.59538592943202 Angstroms
sigma value = 13


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

Energy: 0.9240397091562307
Energy: 0.5141600265896079
Energy: 0.6623365416066399
Energy: 0.5141600265840114
Energy: 0.5196523516046961
Energy: 0.5176410953142496
Energy: 0.6115331059126348
Energy: 0.5176410953159286
Energy: 0.535790691487469
Energy: 0.5163433024047613
Energy: 0.6164468980836753
Energy: 0.5163433024008437
Energy: 0.7073500974291218
Energy: 0.5194529507145548
Energy: 0.6055875543986945
Energy: 0.5194529507145548
Energy: 0.6094313412279295
Energy: 0.5176477145359871
Energy: 0.6259787145131671
Energy: 0.5176477145438223
Energy: 0.6072614620667806
Energy: 0.5171009293206555
Energy: 0.6133283306054497
Energy: 0.5171009293223344
Energy: 0.6073186232913867
Energy: 0.5160406069237863
Energy: 0.6037512856479766
Energy: 0.5160406069260249
Energy: 0.6073349646059293
Energy: 0.5155153485653793
Energy: 0.6153151524027375
Energy: 0.5155153485681776
Energy: 0.5150394616348906
Energy: 0.5173504856528885
Energy: 0.6080783968152109
Energy: 0.5173504856534482
Energy: 0.515103976784974
Energy: 0.5165337089262289
Energy: 0.6069051729871775
Energy: 0.5165337089206323
Energy: 0.5174075133351813
Energy: 0.5166296670579053
Energy: 0.924287722183994
Energy: 0.5166296670640615
Energy: 0.7149350389777145
Energy: 0.5157729031993035
Energy: 0.6071154749142244
Energy: 0.5157729031987438
Energy: 0.6190315657116675
Energy: 0.541935900752864
Energy: 0.6031629936225098
Energy: 0.5419359007545429
Energy: 0.6056678693086517
Energy: 0.5437533583799357
Energy: 0.7080517680886371
Energy: 0.5437533583765778
Energy: 0.6133911606943214
Energy: 0.5177717459279076
Energy: 0.6063559469622418
Energy: 0.5177717459267883
Energy: 0.6106013578047902
Energy: 0.5166280185415697
Energy: 0.5187281813600909
Energy: 0.5166280185326151
Energy: 0.7099901955584671
Energy: 0.5168996479822916
Energy: 0.5183367213133828
Energy: 0.5168996479845301
Energy: 0.518134981692408
Energy: 0.5157943931466042
Energy: 0.5176537970682572
Energy: 0.5157943931488428
Energy: 0.6964751517300032
Energy: 0.5188975356218801
Energy: 0.6024354975058445
Energy: 0.518897535626917
Energy: 0.7163773836061141
Energy: 0.5153112548654738
Energy: 0.6144598290604874
Energy: 0.5153112548671526
Energy: 0.7070099632442767
Energy: 0.5166969765367806
Energy: 0.6034367804062618
Energy: 0.5166969765373403
Energy: 0.7157795508371307
Energy: 0.5507139677090175
Energy: 0.6026782734670201
Energy: 0.5507139677073385
Energy: 0.6099251253760049
Energy: 0.5187294729033548
Energy: 0.728090228116656
Energy: 0.5187294729039145
Energy: 0.5198919311315096
Energy: 0.5153684544564047
Energy: 0.6059455797337177
Energy: 0.5153684544552853
Energy: 0.6041180331156539
Energy: 0.5163141806701801
Energy: 0.6121133439524835
Energy: 0.5163141806690608
Energy: 0.5160317028499746
Energy: 0.5154371018059735
Energy: 0.6088797600275307
Energy: 0.5154371018042945
Energy: 0.5159509427819622
Energy: 0.515517121680664
Energy: 0.7121819958502369
Energy: 0.5155171216795448
Energy: 0.5159539170560008
Energy: 0.518188514248997
Energy: 0.521291405691799
Energy: 0.5181885142506759
Energy: 0.7126330164069063
Energy: 0.517263892936397
Energy: 0.6990048652743192
Energy: 0.517263892929681
Energy: 0.6136551152186037
Energy: 0.5440423987341707
Energy: 0.7106575647981983
Energy: 0.5440423987285741
Energy: 0.6062210648329264
Energy: 0.5412714757230914
Energy: 0.7076356914847411
Energy: 0.541271475723651
Energy: 0.6100034130863101
Energy: 0.516343882959548
Energy: 0.7101940935740281
Energy: 0.5163438829601077
Energy: 0.6148293636338946
Energy: 0.5179115728683905
Energy: 0.526543992118042
Energy: 0.517911572866152
Energy: 0.7110852229737699
Energy: 0.5157575162654975
Energy: 0.5158371888310721
Energy: 0.5157575162694152
Energy: 0.6834165450182935
Energy: 0.516259739622882
Energy: 0.5195145084435795
Energy: 0.5162597396245611

minimum gb energy = 0.5141600265840114 eV
minimum distance =  2.59323357325601 Angstroms
sigma value = 37


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

Energy: 0.7948228506557127
Energy: 0.47032748563861093
Energy: 0.471813828836409
Energy: 0.47032748563861093
Energy: 0.7624476581832812
Energy: 0.46970061001545993
Energy: 0.6185819237759829
Energy: 0.469700610014497
Energy: 0.7640591436748468
Energy: 0.4701177688169207
Energy: 0.6210966533572265
Energy: 0.4701177688178836
Energy: 0.7628058604340265
Energy: 0.5172236424528991
Energy: 0.6204166990442523
Energy: 0.517223642453862
Energy: 0.6203005200380013
Energy: 0.521955324260875
Energy: 0.6190663298654958
Energy: 0.521955324260875
Energy: 0.46708906765346897
Energy: 0.4697150557081411
Energy: 0.6315307616237362
Energy: 0.46971505571488126
Energy: 0.47033111132197836
Energy: 0.4685405484698759
Energy: 0.7693870638198362
Energy: 0.4685405484679502
Energy: 0.4756396244657652
Energy: 0.4697266293183122
Energy: 0.7640539891072456
Energy: 0.4697266293173494
Energy: 0.46932981412935204
Energy: 0.4714223710631959
Energy: 0.7641291184565114
Energy: 0.47142237106223306
Energy: 0.4684518043426335
Energy: 0.4698030952186075
Energy: 0.705835288312287
Energy: 0.46980309521766656
Energy: 0.47181382877576944
Energy: 0.470327485637648
Energy: 0.7948228506557127
Energy: 0.470327485637648
Energy: 0.6185819237759829
Energy: 0.469700610014497
Energy: 0.7052078325238558
Energy: 0.46970061001353414
Energy: 0.6210966533572265
Energy: 0.4701177688159578
Energy: 0.7640591436748468
Energy: 0.4701177688159578
Energy: 0.6204166990423268
Energy: 0.5172236424528991
Energy: 0.7628058604340265
Energy: 0.5172236424528991
Energy: 0.6190663298664586
Energy: 0.5219553242618379
Energy: 0.6203005200380013
Energy: 0.5219553242618379
Energy: 0.7044233559216891
Energy: 0.46971505571391836
Energy: 0.46708906765346897
Energy: 0.4697150557196957
Energy: 0.7693870638207991
Energy: 0.468540548468913
Energy: 0.47033111132101546
Energy: 0.4685405484698759
Energy: 0.7640539886856789
Energy: 0.4697266293173494
Energy: 0.4756396244657652
Energy: 0.4697266293173494
Energy: 0.7641291184642144
Energy: 0.4714223710631959
Energy: 0.4693298141303149
Energy: 0.47142237106223306
Energy: 0.7624476579157317
Energy: 0.4698030952186075
Energy: 0.46845180434167066
Energy: 0.4698030952186075

minimum gb energy = 0.46708906765346897 eV
minimum distance =  2.60289359034425 Angstroms
sigma value = 25


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

Energy: 1.0391713536035447
Energy: 0.42933600678669365
Energy: 0.5942462277730441
Energy: 0.4293360067836861
Energy: 0.715435416504329
Energy: 0.4272700837231061
Energy: 0.552030737324649
Energy: 0.4272700837223542
Energy: 0.814357623499405
Energy: 0.42665461412820915
Energy: 0.5508278207073818
Energy: 0.4266546141312167
Energy: 0.7192758654146042
Energy: 0.4277057949364423
Energy: 0.5483931959822996
Energy: 0.4277057949394498
Energy: 0.7719175839027047
Energy: 0.4684120368273404
Energy: 0.7724409395133901
Energy: 0.46841203682809224
Energy: 0.7153929250780431
Energy: 0.4665021799183806
Energy: 0.7696539601567087
Energy: 0.46650217992138815
Energy: 0.7187049186854441
Energy: 0.4247524180558463
Energy: 0.6657544793606676
Energy: 0.4247524180550944
Energy: 0.5451563224262305
Energy: 0.4198197689804269
Energy: 0.8102996489830984
Energy: 0.4198197689804269
Energy: 0.5402861644885449
Energy: 0.4230846191081762
Energy: 0.6626829449083844
Energy: 0.4230846191119356
Energy: 0.540937901418131
Energy: 0.42366015575778493
Energy: 0.8583926757273674
Energy: 0.4236601557615443
Energy: 0.4823722431249433
Energy: 0.42380942095550483
Energy: 0.8819261295637528
Energy: 0.4238094209524973
Energy: 0.4832039233105688
Energy: 0.42095319752055466
Energy: 0.8581512538867454
Energy: 0.4209531975198028
Energy: 0.4851786659162795
Energy: 0.42084259906625787
Energy: 0.6632102340045313
Energy: 0.42084259907152105
Energy: 0.49080054636372594
Energy: 0.42049267278636127
Energy: 0.856377403173943
Energy: 0.42049267278711316
Energy: 0.6029643375667519
Energy: 0.4191008687655524
Energy: 0.6676427878450488
Energy: 0.41910086876705616
Energy: 0.6034165578672249
Energy: 0.42002613072241196
Energy: 0.8150987335393864
Energy: 0.4200261307209082
Energy: 0.665807156641837
Energy: 0.42032542463068523
Energy: 0.8174129835265921
Energy: 0.42032542463068523
Energy: 0.6026780744567388
Energy: 0.46546481443132626
Energy: 0.6694142630769889
Energy: 0.4654648144343338
Energy: 0.7572067728593772
Energy: 0.45872585978455227
Energy: 0.7175919920287395
Energy: 0.45872585978530417
Energy: 0.7695422578819181
Energy: 0.4655518426330911
Energy: 0.7155688655557223
Energy: 0.46555184263685045
Energy: 0.8829663338890609
Energy: 0.4287558534773698
Energy: 0.5522865305746227
Energy: 0.4287558534781217
Energy: 0.7691739932489743
Energy: 0.42622748762471435
Energy: 0.48229708373882696
Energy: 0.4262274876262181
Energy: 0.7163722776634834
Energy: 0.4284361059803117
Energy: 0.5471223969488843
Energy: 0.42843610597955983
Energy: 0.8102228795418472
Energy: 0.4281631699688207
Energy: 0.43224917284872916
Energy: 0.4281631699718282
Energy: 0.8681875298448859
Energy: 0.42657162459951675
Energy: 0.42741025693221674
Energy: 0.42657162459801296
Energy: 0.8137067529134844
Energy: 0.4277039889919069
Energy: 0.4308160065576624
Energy: 0.4277039889956663

minimum gb energy = 0.4191008687655524 eV
minimum distance =  2.59721126859404 Angstroms
sigma value = 41


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

Energy: 1.0590412923623023
Energy: 0.39063999424394064
Energy: 0.5592407121361862
Energy: 0.3906399942433242
Energy: 0.7598377001435569
Energy: 0.38454771635053014
Energy: 0.4838781281536534
Energy: 0.3845477163511466
Energy: 0.9259957367784754
Energy: 0.3835551519542224
Energy: 0.4861976497285084
Energy: 0.3835551519529895
Energy: 0.765680582994552
Energy: 0.38594169540651085
Energy: 0.5935907598254937
Energy: 0.38594169540774365
Energy: 0.7657585996073936
Energy: 0.38300914448802786
Energy: 0.6737207139203636
Energy: 0.38300914443196155
Energy: 0.7605849442315447
Energy: 0.49956109423558254
Energy: 0.674417849630873
Energy: 0.49956109423558254
Energy: 0.7639137462600145
Energy: 0.41816967792621434
Energy: 0.7652540645754534
Energy: 0.41816967792621434
Energy: 0.679864971194922
Energy: 0.4175177221364228
Energy: 0.6736945322778574
Energy: 0.41751772213395716
Energy: 0.583118225955138
Energy: 0.49864774560740743
Energy: 0.8430863459234306
Energy: 0.498647745606791
Energy: 0.5847912244015291
Energy: 0.38292956562108627
Energy: 0.76663231745266
Energy: 0.38292956562108627
Energy: 0.4924529305232161
Energy: 0.3879582243559707
Energy: 0.9329541968254766
Energy: 0.3879582243590528
Energy: 0.48228243269103344
Energy: 0.3828577930793779
Energy: 0.8420848628344144
Energy: 0.3828577930799943
Energy: 0.4843428915119456
Energy: 0.3862487781810982
Energy: 0.8417141608213742
Energy: 0.38624877818233105
Energy: 0.39102832503000157
Energy: 0.3857950327571695
Energy: 0.850181629799223
Energy: 0.3857950327559367
Energy: 0.3838486906617303
Energy: 0.3838699341475564
Energy: 0.7647677576613401
Energy: 0.3838699341475564
Energy: 0.38825215985631795
Energy: 0.3851868045150792
Energy: 0.9279710385426497
Energy: 0.3851868045150792
Energy: 0.4900939626819443
Energy: 0.3868405961099774
Energy: 0.9302731915106778
Energy: 0.38684059611121024
Energy: 0.48117186902970743
Energy: 0.3830088704225453
Energy: 0.7634051390663326
Energy: 0.383008870420696
Energy: 0.48517194663622876
Energy: 0.3855921480177836
Energy: 0.7623753192125851
Energy: 0.38559214801901637
Energy: 0.6744527940802304
Energy: 0.3841571364877192
Energy: 0.7612615433642059
Energy: 0.38415713648710276
Energy: 0.6926129187547598
Energy: 0.3860124654244499
Energy: 0.7627770822293543
Energy: 0.38601246543123047
Energy: 0.6743248611796688
Energy: 0.41665417026604357
Energy: 0.7654858862942315
Energy: 0.41665417026542717
Energy: 0.8436710391118836
Energy: 0.41596676485869305
Energy: 0.7584676863754347
Energy: 0.41596676485992595
Energy: 0.6732096164972774
Energy: 0.4170081130348324
Energy: 0.6744965479090487
Energy: 0.4170081130348324
Energy: 0.8418931078164494
Energy: 0.38450159449920884
Energy: 0.5774527392196861
Energy: 0.38450159449982524
Energy: 0.8435776382688817
Energy: 0.38396790142803133
Energy: 0.6723556547324273
Energy: 0.3839679014261821
Energy: 0.8470292014430165
Energy: 0.3858466212207845
Energy: 0.4856336287807189
Energy: 0.3858466212207845
Energy: 0.7647219640792375
Energy: 0.38346161463940837
Energy: 0.4803583102550052
Energy: 0.38346161463447703
Energy: 0.8460894320670681
Energy: 0.38704275279343164
Energy: 0.4893476758616793
Energy: 0.3870427527946645
Energy: 0.8444007159847721
Energy: 0.3852590800007455
Energy: 0.3849859109432479
Energy: 0.3852590800007455
Energy: 0.7642639288108415
Energy: 0.3838257229505529
Energy: 0.38330070391286175
Energy: 0.38382572294932005
Energy: 0.9197144716427488
Energy: 0.3854279514486327
Energy: 0.39041701269172363
Energy: 0.3854279514467835

minimum gb energy = 0.3828577930793779 eV
minimum distance =  2.60841224347086 Angstroms
sigma value = 15


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

Energy: 0.910091444760793
Energy: 0.3621712009535119
Energy: 0.5367284883682147
Energy: 0.3621712009571672
Energy: 0.8259562658995692
Energy: 0.3560220933212313
Energy: 0.443741364536115
Energy: 0.3560220933175759
Energy: 0.9714870957645585
Energy: 0.3556292876416967
Energy: 0.44225681112680204
Energy: 0.3556292876385635
Energy: 0.836556665556247
Energy: 0.3581733762185466
Energy: 0.6114297594761493
Energy: 0.3581733762180244
Energy: 0.8302661428218395
Energy: 0.3541037095933306
Energy: 0.6031556352786863
Energy: 0.35410370959803034
Energy: 0.8294969269715012
Energy: 0.36117812797145216
Energy: 0.6048455173584534
Energy: 0.3611781279991286
Energy: 0.6832127263271743
Energy: 0.35861743363772264
Energy: 0.7549170989226874
Energy: 0.35861743364503335
Energy: 0.7593390478674981
Energy: 0.3855626093387947
Energy: 0.6018405896249981
Energy: 0.38556260935806846
Energy: 0.6819130008435339
Energy: 0.5540987673377252
Energy: 0.7536580659699668
Energy: 0.5540987673372031
Energy: 0.6802647129611133
Energy: 0.4638488677533774
Energy: 0.8329921964818487
Energy: 0.46384886775233297
Energy: 0.6109797758015969
Energy: 0.3572743707938905
Energy: 0.8082278359102263
Energy: 0.3572743707286635
Energy: 0.5199157987964496
Energy: 0.3608196184855805
Energy: 0.8974821982300581
Energy: 0.3608196184855805
Energy: 0.604608440763087
Energy: 0.3547489297454494
Energy: 0.8994272910678482
Energy: 0.35474892974336064
Energy: 0.44784873120173085
Energy: 0.35814506366696697
Energy: 0.7603575306557773
Energy: 0.35814506366748916
Energy: 0.4368214563988284
Energy: 0.35519690119267233
Energy: 0.8304469572891482
Energy: 0.3551969011921501
Energy: 0.4447789323207347
Energy: 0.3569089501205509
Energy: 0.9004832780286893
Energy: 0.35690895012002866
Energy: 0.3611687143958878
Energy: 0.35644559165633954
Energy: 0.9041010746261716
Energy: 0.35644559165581735
Energy: 0.3555686809001005
Energy: 0.3548880895945121
Energy: 0.830268853120596
Energy: 0.35488808959346774
Energy: 0.3590422226049244
Energy: 0.3580746570916278
Energy: 0.831311894143059
Energy: 0.35807465709215
Energy: 0.44630841273647764
Energy: 0.3581567308122275
Energy: 0.9742089707083186
Energy: 0.3581567308132719
Energy: 0.43555478975416667
Energy: 0.3547098494497052
Energy: 0.8301644303755819
Energy: 0.3547098494497052
Energy: 0.4469606925052544
Energy: 0.3576631801281152
Energy: 0.8338818272419956
Energy: 0.35766318012863746
Energy: 0.6046883368482223
Energy: 0.3549147977491637
Energy: 0.826837880712746
Energy: 0.3549147977460305
Energy: 0.6018717213036011
Energy: 0.359962078648009
Energy: 0.8981416816690654
Energy: 0.35996207863599855
Energy: 0.610317032800568
Energy: 0.3570917821699702
Energy: 0.7046912808902811
Energy: 0.3570917821647482
Energy: 0.75547467812566
Energy: 0.4650553314808938
Energy: 0.8340213232331986
Energy: 0.46505533148402695
Energy: 0.6024418666922828
Energy: 0.3834331661651001
Energy: 0.7541930201385103
Energy: 0.3834331661645779
Energy: 0.7589591013815264
Energy: 0.38523933695414286
Energy: 0.6880387058871721
Energy: 0.38523933697555285
Energy: 0.756632033049877
Energy: 0.35708669638812657
Energy: 0.7553054424107007
Energy: 0.3570866963928263
Energy: 0.7557364800736298
Energy: 0.3613067818848824
Energy: 0.6047441031187891
Energy: 0.36130678175756165
Energy: 0.82930504593563
Energy: 0.35436666318378707
Energy: 0.5199219165127146
Energy: 0.3543666631827427
Energy: 0.7609401469801673
Energy: 0.3575952474604322
Energy: 0.6102262993246008
Energy: 0.3575952474604322
Energy: 0.899650425099414
Energy: 0.3561497113218234
Energy: 0.4426139316186748
Energy: 0.35614971132025686
Energy: 0.8967380061604225
Energy: 0.3557141556966708
Energy: 0.4402306968969365
Energy: 0.3557141556956264
Energy: 0.908535592379014
Energy: 0.3574087904797665
Energy: 0.36369223275779095
Energy: 0.3574087904808109
Energy: 0.8971089018777845
Energy: 0.3576846031150552
Energy: 0.3583907561936418
Energy: 0.3576846031150552
Energy: 0.969124233299486
Energy: 0.3586575205129774
Energy: 0.3566739331561749
Energy: 0.3586575205134996

minimum gb energy = 0.3541037095933306 eV
minimum distance =  2.6118168777069 Angstroms
sigma value = 85


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

Energy: 0.97486033468572
Energy: 0.321478134667732
Energy: 0.32174004757950736
Energy: 0.321478134667732
Energy: 0.8633998314823909
Energy: 0.3196236607277823
Energy: 0.3916077413951774
Energy: 0.3196236607286881
Energy: 0.8645903228449108
Energy: 0.3193247468601685
Energy: 0.3932183917633682
Energy: 0.3193247468601685
Energy: 0.7330138165143403
Energy: 0.32128258991054337
Energy: 0.5373533564634276
Energy: 0.32128258991280795
Energy: 0.8673082440396446
Energy: 0.3185310407336192
Energy: 0.5357831367885316
Energy: 0.3185310407340721
Energy: 0.7354565227120009
Energy: 0.31896023403027995
Energy: 0.5391802399493263
Energy: 0.31896023403118573
Energy: 0.7391171210284341
Energy: 0.3191562493321037
Energy: 0.6746833391321369
Energy: 0.3191562493325566
Energy: 0.8053763432892579
Energy: 0.31954286155348205
Energy: 0.5334329724346886
Energy: 0.3195428615516704
Energy: 0.7382702196097585
Energy: 0.3186601110994871
Energy: 0.6713545490827201
Energy: 0.31866011108861747
Energy: 0.7379714404973322
Energy: 0.5068352697779602
Energy: 0.7994533151280365
Energy: 0.5068352697779602
Energy: 0.6769277751592614
Energy: 0.42825901984639475
Energy: 0.7064025967278305
Energy: 0.42825901984684767
Energy: 0.6082475687627421
Energy: 0.31936108707490873
Energy: 0.8000733921885061
Energy: 0.31936108594543544
Energy: 0.6708727647627677
Energy: 0.32017744642736856
Energy: 0.8001400975280724
Energy: 0.32017744642782153
Energy: 0.5378150739388029
Energy: 0.31961781352147745
Energy: 0.6689186504258584
Energy: 0.31961781352193036
Energy: 0.45786697245158525
Energy: 0.31858179671025105
Energy: 0.8665113970893625
Energy: 0.3185817967097981
Energy: 0.5410858500448383
Energy: 0.31963719200145546
Energy: 0.8014763382996584
Energy: 0.31963719200100255
Energy: 0.3986112302853558
Energy: 0.32008752839593546
Energy: 0.7989578276398409
Energy: 0.32008752839457677
Energy: 0.38885310344097385
Energy: 0.3185146126147491
Energy: 0.8667047162169815
Energy: 0.3185146126161078
Energy: 0.3935003455250165
Energy: 0.3201932787216395
Energy: 0.8641050566785898
Energy: 0.32019327872209236
Energy: 0.3224208885134088
Energy: 0.3221714394607562
Energy: 0.8659337158019661
Energy: 0.3221714394607562
Energy: 0.31918710773816117
Energy: 0.31881867010566983
Energy: 0.8675085232013433
Energy: 0.31881867010566983
Energy: 0.3218237083232684
Energy: 0.32027554859931034
Energy: 0.8618950520193118
Energy: 0.32027554859931034
Energy: 0.3968834269647697
Energy: 0.32009679955759224
Energy: 0.8629981780512572
Energy: 0.32009679955804515
Energy: 0.3905850951251485
Energy: 0.31847947361972534
Energy: 0.8674353577817864
Energy: 0.31847947361972534
Energy: 0.39345461579610524
Energy: 0.32066381390188703
Energy: 0.7339951943296171
Energy: 0.3206638139027928
Energy: 0.5384268312421173
Energy: 0.3187509557922065
Energy: 0.8650606617321746
Energy: 0.3187509557922065
Energy: 0.5365148244816853
Energy: 0.3186935585578205
Energy: 0.8637071782961501
Energy: 0.3186935585591792
Energy: 0.5381812220474849
Energy: 0.320052934189459
Energy: 0.7343086788372356
Energy: 0.320052934189459
Energy: 0.6740604213734891
Energy: 0.31877779145360263
Energy: 0.8682027535273333
Energy: 0.3187777914531498
Energy: 0.6717366238912335
Energy: 0.5048795806501469
Energy: 0.7354588907543256
Energy: 0.5048795806501469
Energy: 0.7424812413423838
Energy: 0.36668267074599015
Energy: 0.6068814157881973
Energy: 0.36668267074870753
Energy: 0.6746932491584161
Energy: 0.36619144875229204
Energy: 0.7408356398183855
Energy: 0.36619144776540025
Energy: 0.8006977706888441
Energy: 0.5046877024087925
Energy: 0.6048322144615355
Energy: 0.5046877024083397
Energy: 0.8689509103639095
Energy: 0.31984828367741863
Energy: 0.6055917719302063
Energy: 0.3198482836751747
Energy: 0.6687476517947075
Energy: 0.3195123655535946
Energy: 0.5376702588104644
Energy: 0.31951236555948226
Energy: 0.9267480482500982
Energy: 0.32009683528015637
Energy: 0.5357859197018365
Energy: 0.3200968352806093
Energy: 0.926741701456904
Energy: 0.31899540788095376
Energy: 0.5384167644757873
Energy: 0.31899540788185954
Energy: 0.7987920389226182
Energy: 0.3219096710165887
Energy: 0.3939140160134359
Energy: 0.3219096710174945
Energy: 0.8676692570977969
Energy: 0.3185536597417292
Energy: 0.3901507037603288
Energy: 0.3185536597412763
Energy: 0.8644927773021593
Energy: 0.3203527031274997
Energy: 0.39703534923430256
Energy: 0.3203527031284056
Energy: 0.7980175036276007
Energy: 0.31969705185988473
Energy: 0.318341644387759
Energy: 0.31969705185897895
Energy: 0.8669878790001624
Energy: 0.3187948238693257
Energy: 0.3188463797680123
Energy: 0.3187948238702315
Energy: 0.8618370817048692
Energy: 0.31982276116082675
Energy: 0.32106518375867016
Energy: 0.31982276116037384

minimum gb energy = 0.318341644387759 eV
minimum distance =  2.61144380524209 Angstroms
sigma value = 113


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

Energy: 0.01346226754301677
Energy: 0.014091796715518757
Energy: 0.7482158312538466
Energy: 0.014091796715170591
Energy: 0.014939863032150592
Energy: 0.0708797739801557
Energy: 0.553625700529772
Energy: 0.07087977397947871
Energy: 0.014027296577985297
Energy: 0.06967129252884392
Energy: 0.5528296376322259
Energy: 0.06967129252543962
Energy: 0.014887755906351616
Energy: 0.07190973052523071
Energy: 0.5541858011473338
Energy: 0.07190973052047243
Energy: 0.5548130548333807
Energy: 0.07085931303565265
Energy: 0.5553914788854877
Energy: 0.07085931303122318
Energy: 0.014031980591645205
Energy: 0.06956666611787285
Energy: 0.5526094981148488
Energy: 0.06956666611822103

minimum gb energy = 0.01346226754301677 eV
minimum distance =  2.84949925596983 Angstroms
sigma value = 1