Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_Al__MO_315820974149_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.36025423720221
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01037527588333974
Energy: 0.011195538638512402
Energy: 0.6839935924063134
Energy: 0.011195538638512402
Energy: 0.011195538638512402
Energy: 0.5525479229438545
Energy: 0.011195538638012687
Energy: 0.5525479229438545
Energy: 0.6839935924063134
Energy: 0.011195538638512402
Energy: 0.01037527588333974
Energy: 0.011195538638512402
Energy: 0.011195538638512402
Energy: 0.5525479229438545
Energy: 0.011195538638512402
Energy: 0.5525479229438545

minimum gb energy = 0.01037527588333974 eV
minimum distance =  2.67558151334819 Angstroms
sigma value = 1


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

Energy: 0.6485173703435276
Energy: 0.6248217083197348
Energy: 0.6873422052966048
Energy: 0.6248217083197348
Energy: 0.6222962171954532
Energy: 0.6410729963777141
Energy: 0.6236423400994946
Energy: 0.6410729963777141
Energy: 0.6056688192776815
Energy: 0.6165933963810368
Energy: 0.6334271247633779
Energy: 0.6165933963816429
Energy: 0.6221039870377169
Energy: 0.6438307298734376
Energy: 0.6051138635831834
Energy: 0.6438307298734376
Energy: 0.6260073611169636
Energy: 0.6309755630954507
Energy: 0.6160152304299322
Energy: 0.6309755630960567
Energy: 0.5944622925456969
Energy: 0.7009731468629521
Energy: 0.5825133079415835
Energy: 0.7009731468629521
Energy: 0.6225906886705971
Energy: 0.6216520558297453
Energy: 0.5958601748306483
Energy: 0.6216520558291392
Energy: 0.561438362571131
Energy: 0.6290891546669195
Energy: 0.584102519585271
Energy: 0.6290891546669195
Energy: 0.6055489334020335
Energy: 0.7899158853699281
Energy: 0.6188840275870856
Energy: 0.7899158853699281
Energy: 0.588042617054592
Energy: 0.6161324797107544
Energy: 0.5619060660741204
Energy: 0.6161324797107544
Energy: 0.6214985397866312
Energy: 0.64368427675702
Energy: 0.6052452778069755
Energy: 0.64368427675702
Energy: 0.6324831094897457
Energy: 0.6289880050465131
Energy: 0.5923254099899865
Energy: 0.6289880050465131
Energy: 0.6221195327457524
Energy: 0.6145435936676504
Energy: 0.6227917935176556
Energy: 0.6145435936676504
Energy: 0.6305628620975253
Energy: 0.6458980625048225
Energy: 0.6021852288893973
Energy: 0.6458980625042164
Energy: 0.6446922710793284
Energy: 0.6331961455805626
Energy: 0.6220290924929678
Energy: 0.6331961455811688
Energy: 0.6407807071775031
Energy: 0.6268163605196154
Energy: 0.6304903600608468
Energy: 0.6268163605196154
Energy: 0.6335649419160647
Energy: 0.6163764058175105
Energy: 0.5912698601483539
Energy: 0.6163764058175105
Energy: 0.623724317087396
Energy: 0.6147710075083076
Energy: 0.6221018758665374
Energy: 0.6147710075083076
Energy: 0.576787303154627
Energy: 0.6276954303585707
Energy: 0.597153743537943
Energy: 0.6276954303585707
Energy: 0.6236095571638519
Energy: 0.7694057927351047
Energy: 0.607308952746357
Energy: 0.7694057927351047
Energy: 0.5816737205321656
Energy: 0.6163269620803952
Energy: 0.5609402492113573
Energy: 0.6163269620797891
Energy: 0.6050756778218204
Energy: 0.6979347915620132
Energy: 0.635131977663318
Energy: 0.6979347915620132
Energy: 0.6788530275148894
Energy: 0.6312101641348717
Energy: 0.6031108497081966
Energy: 0.6312101641348717
Energy: 0.6169941535162379
Energy: 0.6171128842352264
Energy: 0.594579722341552
Energy: 0.6171128842352264
Energy: 0.5954198384041683
Energy: 0.6983504587179161
Energy: 0.7011620728225876
Energy: 0.6983504587179161
Energy: 0.6277398613557797
Energy: 0.6292100615246506
Energy: 0.6073532180760985
Energy: 0.6292100615246506
Energy: 0.6211695799457698
Energy: 0.7158095741959744
Energy: 0.6056516420126377
Energy: 0.7158095741959744
Energy: 0.6075602284940077
Energy: 0.614388223165323
Energy: 0.6356644897662942
Energy: 0.614388223165323
Energy: 0.6224422942981821
Energy: 0.6488778648134595
Energy: 0.6212241561906205
Energy: 0.6488778648134595
Energy: 0.6470402756373316
Energy: 0.6257581903264251
Energy: 0.6337259286559768
Energy: 0.6257581903264251
Energy: 0.6228505646198303
Energy: 0.6498687550467516
Energy: 0.6218853059886487
Energy: 0.6498687550467516
Energy: 0.6254303352157848
Energy: 0.6189279654922843
Energy: 0.6306455575130662
Energy: 0.6189279654922843
Energy: 0.6256468218819167
Energy: 0.6413234828428925
Energy: 0.6064478530553995
Energy: 0.6413234828428925

minimum gb energy = 0.5609402492113573 eV
minimum distance =  2.5357714673099 Angstroms
sigma value = 1


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

Energy: 0.6805319107070495
Energy: 0.7139443723239087
Energy: 0.6892318675898442
Energy: 0.7139443723252906
Energy: 0.6487757390379061
Energy: 0.6946180381071583
Energy: 0.6468947539094878
Energy: 0.6946180381092312
Energy: 0.633775846189137
Energy: 0.6707950757708859
Energy: 0.6654679978922692
Energy: 0.6707950757701949
Energy: 0.6101370180834444
Energy: 0.6764264876590494
Energy: 0.6127624702275047
Energy: 0.6764264876604316
Energy: 0.6099163555867604
Energy: 0.6587464366615317
Energy: 0.6437137676302755
Energy: 0.6587464366615317
Energy: 0.6639506938049543
Energy: 0.6585444602521537
Energy: 0.7193962160109509
Energy: 0.6585444602528449
Energy: 0.609788167989633
Energy: 0.7093531466077208
Energy: 0.6167128924666695
Energy: 0.7093531466070297
Energy: 0.5823830288397016
Energy: 0.6702566149721559
Energy: 0.6089072408248536
Energy: 0.670256614973538
Energy: 0.6093773608729847
Energy: 0.7997252530449229
Energy: 0.6470753017851351
Energy: 0.799725253044232
Energy: 0.6218889984050073
Energy: 0.672166310339259
Energy: 0.6274443426306564
Energy: 0.6721663103378771
Energy: 0.6193059496434793
Energy: 0.661419599796785
Energy: 0.6422981913482461
Energy: 0.6614195997954032
Energy: 0.5967950475617865
Energy: 0.7084571888039922
Energy: 0.6546261889753402
Energy: 0.7084571888039922
Energy: 0.657140402618498
Energy: 0.6541915029163735
Energy: 0.630955192044327
Energy: 0.6541915029163735
Energy: 0.6569587712180289
Energy: 0.6540366425474312
Energy: 0.6371476921680567
Energy: 0.6540366425467402
Energy: 0.5966355749077998
Energy: 0.6877186524282128
Energy: 0.6656907805935239
Energy: 0.687718652427522
Energy: 0.6192446320338983
Energy: 0.6613466214236344
Energy: 0.6469315048374781
Energy: 0.6613466214222524
Energy: 0.621873562109575
Energy: 0.6719559045055085
Energy: 0.6024824605675041
Energy: 0.6719559045034356
Energy: 0.6092910135624513
Energy: 0.7997310973231526
Energy: 0.6470838917961633
Energy: 0.7997310973217705
Energy: 0.5823838388484641
Energy: 0.6700109543786934
Energy: 0.6107785306864743
Energy: 0.6700109543780023
Energy: 0.6486818689835832
Energy: 0.7094137418577569
Energy: 0.6124789702020259
Energy: 0.709413741856375
Energy: 0.6639248689935583
Energy: 0.6577975630330452
Energy: 0.611463256227784
Energy: 0.6577975630337362
Energy: 0.6099958660042362
Energy: 0.6588176561563298
Energy: 0.6305083054715778
Energy: 0.6588176561570207
Energy: 0.6101372810871005
Energy: 0.6762855503861013
Energy: 0.616347039080428
Energy: 0.6762855503861013
Energy: 0.6337989297759261
Energy: 0.6708781819964542
Energy: 0.665523697066472
Energy: 0.6708781819964542
Energy: 0.6488449283395424
Energy: 0.694515700207176
Energy: 0.6470985691624926
Energy: 0.694515700208558
Energy: 0.6805319107070495
Energy: 0.7139443723239087
Energy: 0.7114829649420705
Energy: 0.7139443723252906
Energy: 0.6487757390379061
Energy: 0.6946180381085402
Energy: 0.6468947539094878
Energy: 0.6946180381092312
Energy: 0.633775846189137
Energy: 0.6707950757708859
Energy: 0.6389408663716198
Energy: 0.6707950757695038
Energy: 0.6101370180834444
Energy: 0.6764264876590494
Energy: 0.6127624702275047
Energy: 0.6764264876597406

minimum gb energy = 0.5823830288397016 eV
minimum distance =  2.51530308841046 Angstroms
sigma value = 25


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

Energy: 0.6531681178936226
Energy: 0.6954097371626333
Energy: 0.7838407748267683
Energy: 0.6954097371626333
Energy: 0.6359917292000231
Energy: 0.7106406617944739
Energy: 0.6349367954327058
Energy: 0.7106406617944739
Energy: 0.6632830404917629
Energy: 0.7435644343932554
Energy: 0.6347978500471536
Energy: 0.7435644343932554
Energy: 0.6383073031358436
Energy: 0.7301249468242109
Energy: 0.6329700942904426
Energy: 0.7301249468242109
Energy: 0.6342112735210628
Energy: 0.700859213768048
Energy: 0.6320613086108646
Energy: 0.700859213768048
Energy: 0.6971510909653374
Energy: 0.7444585582536998
Energy: 0.7423286392034316
Energy: 0.7444585582536998
Energy: 0.6476710838321349
Energy: 0.7274371596597348
Energy: 0.6379456544213563
Energy: 0.727437159660538
Energy: 0.7664142186253502
Energy: 0.6966759274025094
Energy: 0.605692389234594
Energy: 0.6966759274025094
Energy: 0.6483011470236248
Energy: 0.6710211382578405
Energy: 0.6476457789745289
Energy: 0.6710211382578405
Energy: 0.636808003970836
Energy: 0.721737851513116
Energy: 0.6189448953391534
Energy: 0.721737851513116
Energy: 0.6376363472333095
Energy: 0.6942630072515338
Energy: 0.6351823526438891
Energy: 0.6942630072515338
Energy: 0.6326788875948923
Energy: 0.6952169423472946
Energy: 0.6347528235123361
Energy: 0.6952169423472946
Energy: 0.6346961257835263
Energy: 0.7051114090506122
Energy: 0.6197783105704787
Energy: 0.7051114090514156
Energy: 0.6482882795965581
Energy: 0.7066510606756664
Energy: 0.6359411848896489
Energy: 0.7066510606756664
Energy: 0.6292637185807664
Energy: 0.7019407061791217
Energy: 0.6043500980127283
Energy: 0.7019407061791217
Energy: 0.6355928989046815
Energy: 0.8387333109238589
Energy: 0.6243276057962535
Energy: 0.8387333109238589
Energy: 0.60698255059132
Energy: 0.7464871089275568
Energy: 0.6034537329636052
Energy: 0.7464871089275568
Energy: 0.6332365021290937
Energy: 0.696320997106096
Energy: 0.6387028539151697
Energy: 0.696320997106096
Energy: 0.6194899438283953
Energy: 0.729427524863073
Energy: 0.633730664425127
Energy: 0.729427524863073
Energy: 0.6351426900979313
Energy: 0.7442669829720847
Energy: 0.6356656130487737
Energy: 0.7442669829712815
Energy: 0.651189125558881
Energy: 0.709392270926544
Energy: 0.6384665767864224
Energy: 0.7093922709257406
Energy: 0.6504331530091728
Energy: 0.7000642464636039
Energy: 0.704143117709599
Energy: 0.7000642464636039
Energy: 0.647526123626875
Energy: 0.6854640283776136
Energy: 0.6350658910406293
Energy: 0.6854640283776136
Energy: 0.6667482952160201
Energy: 0.7267438245702245
Energy: 0.6367342778422175
Energy: 0.7267438245702245
Energy: 0.6360575261236174
Energy: 0.80644603645387
Energy: 0.6233193857990291
Energy: 0.8064460364546732

minimum gb energy = 0.6034537329636052 eV
minimum distance =  2.54533082484759 Angstroms
sigma value = 9


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

Energy: 0.7026352007788762
Energy: 0.7656597787067171
Energy: 0.8500877267776269
Energy: 0.7656597787067171
Energy: 0.6536491560548525
Energy: 0.726791907310459
Energy: 0.6628643233785436
Energy: 0.726791907310459
Energy: 0.6211405390439082
Energy: 0.7410013475932209
Energy: 0.6631773273334812
Energy: 0.7410013475932209
Energy: 0.7247358759656711
Energy: 0.7995440150611948
Energy: 0.6309470834684284
Energy: 0.7995440150621532
Energy: 0.7051752280790071
Energy: 0.702802585215966
Energy: 0.6635875521499348
Energy: 0.7028025852150077
Energy: 0.6360573161845213
Energy: 0.7590184732500433
Energy: 0.6250591836962679
Energy: 0.7590184732500433
Energy: 0.6617747295655088
Energy: 0.6302515512606507
Energy: 0.6295307904597347
Energy: 0.6302515512606507
Energy: 0.67984702150154
Energy: 0.7602620301419537
Energy: 0.6451218736947416
Energy: 0.760262030142912
Energy: 0.6630475340105789
Energy: 0.7023885386083197
Energy: 0.6578549049202248
Energy: 0.7023885386083197
Energy: 0.657445065484014
Energy: 0.783093101639961
Energy: 0.6308613801624672
Energy: 0.7830931016390029
Energy: 0.6567268324766808
Energy: 0.7315898141917603
Energy: 0.6737983314210615
Energy: 0.7315898141917603
Energy: 0.6620060427858487
Energy: 0.7058886180886882
Energy: 0.6665741673146398
Energy: 0.7058886180886882
Energy: 0.6361618820573004
Energy: 0.7669319632619888
Energy: 0.6237079097285757
Energy: 0.7669319632610305
Energy: 0.6591241079768607
Energy: 0.7514104909924675
Energy: 0.6636440293483588
Energy: 0.7514104909934257
Energy: 0.6409210313158831
Energy: 0.7804631715985397
Energy: 0.6916995345580107
Energy: 0.7804631715985397
Energy: 0.7245183545150478
Energy: 0.7824254309825373
Energy: 0.6309027279907777
Energy: 0.7824254309825373
Energy: 0.6882277434155503
Energy: 0.7374917280491234
Energy: 0.6631522644473803
Energy: 0.7374917280491234
Energy: 0.682513737235022
Energy: 0.744260503976966
Energy: 0.6634039353079042
Energy: 0.744260503976966
Energy: 0.6665148484007128
Energy: 0.7078351474305579
Energy: 0.6593597154194969
Energy: 0.7078351474315161
Energy: 0.7462790967908383
Energy: 0.7424129265514019
Energy: 0.6450602646428445
Energy: 0.7424129265514019
Energy: 0.6626469308482067
Energy: 0.7453977791318608
Energy: 0.6664961415587161
Energy: 0.7453977791309027

minimum gb energy = 0.6211405390439082 eV
minimum distance =  2.56888287601039 Angstroms
sigma value = 25


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

Energy: 0.6308209418533319
Energy: 0.7340241469191149
Energy: 0.7771210835028888
Energy: 0.7340241469202999
Energy: 0.620981186085745
Energy: 0.6903871957507999
Energy: 0.623190373537644
Energy: 0.6903871957507999
Energy: 0.6223374708289261
Energy: 0.7322213683938094
Energy: 0.6253637834838497
Energy: 0.7322213683938094
Energy: 0.6334770440857721
Energy: 0.7178263460947936
Energy: 0.7720318394810187
Energy: 0.7178263460947936
Energy: 0.7436635138690763
Energy: 0.6954991388864388
Energy: 0.6618360232844216
Energy: 0.6954991388864388
Energy: 0.6219647691885575
Energy: 0.7575209051428293
Energy: 0.6233151511810491
Energy: 0.7575209051428293
Energy: 0.650439318632204
Energy: 0.7089389883924985
Energy: 0.6225589570730011
Energy: 0.7089389883924985
Energy: 0.7807590458383985
Energy: 0.7352175450792691
Energy: 0.6341515096292002
Energy: 0.7352175450792691
Energy: 0.6252354592572344
Energy: 0.6905158935162465
Energy: 0.6229227798148524
Energy: 0.6905158935162465
Energy: 0.771952003080728
Energy: 0.708001603328415
Energy: 0.6219464469568473
Energy: 0.708001603328415
Energy: 0.6915599417089976
Energy: 0.7336461539073289
Energy: 0.8624622881102969
Energy: 0.7336461539073289
Energy: 0.6228305013195217
Energy: 0.638330066840472
Energy: 0.7469184957210145
Energy: 0.6383300668309916
Energy: 0.7769104008565606
Energy: 0.7338501576350195
Energy: 0.6231712869080439
Energy: 0.7338501576350195
Energy: 0.6853502402216446
Energy: 0.6964577116669256
Energy: 0.6332784203966224
Energy: 0.6964577116669256
Energy: 0.6239169919082008
Energy: 0.7479376077458483
Energy: 0.7400392104479862
Energy: 0.7479376077458483
Energy: 0.6254256366842346
Energy: 0.7054155444009379
Energy: 0.6219337443992403
Energy: 0.7054155444009379
Energy: 0.6238345549219707
Energy: 0.7353978575961891
Energy: 0.7451572890164371
Energy: 0.7353978575961891

minimum gb energy = 0.620981186085745 eV
minimum distance =  2.5875345445887 Angstroms
sigma value = 17


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

Energy: 0.7150326229154926
Energy: 0.7713937851358089
Energy: 0.9259396546605738
Energy: 0.7713937851358089
Energy: 0.7444543825511313
Energy: 0.6797803031887281
Energy: 0.6703938964009835
Energy: 0.6797803031887281
Energy: 0.7489299919224874
Energy: 0.761596054016204
Energy: 0.6461987434577413
Energy: 0.761596054016204
Energy: 0.6423265234679851
Energy: 0.7829267644376936
Energy: 0.7356465554126386
Energy: 0.7829267644376936
Energy: 0.7622167474388838
Energy: 0.7536575564854745
Energy: 0.6493051213748755
Energy: 0.7536575564854745
Energy: 0.6439038841013663
Energy: 0.7543189090895459
Energy: 0.8890216881426695
Energy: 0.754318909090217
Energy: 0.6418497654623722
Energy: 0.7167406054898149
Energy: 0.6689826796734297
Energy: 0.7167406054898149
Energy: 0.7509937957487722
Energy: 0.7683171404625307
Energy: 0.6448026510266407
Energy: 0.7683171404625307
Energy: 0.6461957596723725
Energy: 0.7460472736163288
Energy: 0.7687078897247371
Energy: 0.7460472736163288
Energy: 0.816961323739275
Energy: 0.728583672823665
Energy: 0.6435516170279272
Energy: 0.728583672823665
Energy: 0.6411716353619613
Energy: 0.7631788981743536
Energy: 0.7424044741917206
Energy: 0.7631788981736826
Energy: 0.6449763864026624
Energy: 0.7160253381971872
Energy: 0.6593785949757865
Energy: 0.7160253381978583
Energy: 0.8632025965482581
Energy: 0.7639450932371303
Energy: 0.6916209563456861
Energy: 0.7639450932364592
Energy: 0.6437093927414635
Energy: 0.7800278526835086
Energy: 0.7441206096906314
Energy: 0.7800278526828373
Energy: 0.7157135036101656
Energy: 0.7033138413192266
Energy: 0.6467552129086596
Energy: 0.7033138413198978
Energy: 0.744208875690052
Energy: 0.7486975185015866
Energy: 0.7509169303139414
Energy: 0.7486975185015866
Energy: 0.6665470933744755
Energy: 0.7203857388043738
Energy: 0.8047340245565403
Energy: 0.7203857388037027
Energy: 0.8555879807259306
Energy: 0.7434196001549079
Energy: 0.6439895650636528
Energy: 0.7434196001555791
Energy: 0.6881568422838176
Energy: 0.7206962020161605
Energy: 0.7088555663804895
Energy: 0.7206962020161605
Energy: 0.6896233218177101
Energy: 0.7653890117059696
Energy: 0.6428764131797814
Energy: 0.7653890117052985
Energy: 0.7021527019693464
Energy: 0.7640735261068754
Energy: 0.7486498839085844
Energy: 0.7640735261068754
Energy: 0.6691399063952911
Energy: 0.7574267931364341
Energy: 0.8213305082907486
Energy: 0.7574267931364341
Energy: 0.7987941181801059
Energy: 0.7879179689837585
Energy: 0.6418122028540578
Energy: 0.7879179689837585
Energy: 0.6901511081544961
Energy: 0.7035941443468844
Energy: 0.7516155768982787
Energy: 0.7035941443462133
Energy: 0.6884360156003828
Energy: 0.7794918631225245
Energy: 0.7307479780829371
Energy: 0.7794918631225245
Energy: 0.7978284812220041
Energy: 0.7829805847097008
Energy: 0.6428890093526616
Energy: 0.7829805847097008
Energy: 0.6492911892543062
Energy: 0.7633552489162181
Energy: 0.8434603645070146
Energy: 0.7633552489162181
Energy: 0.75200177213757
Energy: 0.7674832035175824
Energy: 0.7463683882427686
Energy: 0.7674832035182536
Energy: 0.7832336293320825
Energy: 0.8077358248181652
Energy: 0.6417744605022031
Energy: 0.8077358248181652
Energy: 0.6446161842398925
Energy: 0.7594360578853172
Energy: 0.8577334647410738
Energy: 0.7594360578853172

minimum gb energy = 0.6411716353619613 eV
minimum distance =  2.51334579927638 Angstroms
sigma value = 53


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

Energy: 0.6029420328654005
Energy: 0.7481722286629874
Energy: 1.006722033337582
Energy: 0.7481722286629874
Energy: 0.7481269826750839
Energy: 0.668257213620692
Energy: 0.6833970810918465
Energy: 0.6682572136222371
Energy: 0.6034545069399923
Energy: 0.678547968864262
Energy: 0.7780208194849322
Energy: 0.678547968864262
Energy: 0.6034182333725997
Energy: 0.6034415463455314
Energy: 0.7355202607609779
Energy: 0.6034415463455314
Energy: 0.7481036835187538
Energy: 0.6682730048616431
Energy: 0.7318534663887596
Energy: 0.6682730048616431
Energy: 0.6029420328654005
Energy: 0.7481722286629874
Energy: 0.8542209170991515
Energy: 0.7481722286629874
Energy: 0.7481283355410916
Energy: 0.668257213620692
Energy: 0.7353363441753185
Energy: 0.668257213620692
Energy: 0.6034545069229958
Energy: 0.678547968864262
Energy: 0.778020819492658
Energy: 0.678547968864262
Energy: 0.6034182333973218
Energy: 0.6034415463455314
Energy: 0.6790051854085697
Energy: 0.6034415463455314
Energy: 0.7481088225479504
Energy: 0.6682730048631883
Energy: 0.7326508809664001
Energy: 0.6682730048616431
Energy: 0.6029420328654005
Energy: 0.7481722286645325
Energy: 0.914361370086844
Energy: 0.7481722286629874
Energy: 0.7481269466216373
Energy: 0.668257213620692
Energy: 0.73551292926866
Energy: 0.668257213620692
Energy: 0.603454506924541
Energy: 0.678547968864262
Energy: 0.7780208195034737
Energy: 0.678547968864262

minimum gb energy = 0.6029420328654005 eV
minimum distance =  2.55367799794104 Angstroms
sigma value = 9


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

Energy: 0.6899499804836331
Energy: 0.7597584889096696
Energy: 0.9382283982128526
Energy: 0.7597584889102414
Energy: 0.7947393590953951
Energy: 0.7119212776273465
Energy: 0.7057110862200032
Energy: 0.7119212776273465
Energy: 0.6546316784118388
Energy: 0.7137028162942202
Energy: 0.6743122562934183
Energy: 0.7137028162942202
Energy: 0.755701122139939
Energy: 0.7611513538958322
Energy: 0.6627959456751614
Energy: 0.7611513538958322
Energy: 0.8536666198619067
Energy: 0.7310835993122031
Energy: 0.6718466363824309
Energy: 0.7310835993122031
Energy: 0.6850482034481093
Energy: 0.7404056677176218
Energy: 0.8760305543084816
Energy: 0.7404056677176218
Energy: 0.8806106851285785
Energy: 0.7402785112665963
Energy: 0.6916693475545969
Energy: 0.7402785112665963
Energy: 0.6546927794843739
Energy: 0.7743465493366801
Energy: 0.7642370436890659
Energy: 0.7743465493372519
Energy: 0.656461614716393
Energy: 0.7746348380196917
Energy: 0.6869472095025365
Energy: 0.7746348380202637
Energy: 0.6546630978901179
Energy: 0.7305968515425822
Energy: 0.6700549129270766
Energy: 0.7305968515420104
Energy: 0.656290052134579
Energy: 0.7627610362389774
Energy: 0.8726269186449799
Energy: 0.7627610362395493
Energy: 0.793386610813884
Energy: 0.7846948729651134
Energy: 0.6594551951307854
Energy: 0.7846948729645417
Energy: 0.6570526812060076
Energy: 0.7607691051755772
Energy: 0.8084756398003932
Energy: 0.760769105176149
Energy: 0.7426327412455457
Energy: 0.7744243830882938
Energy: 0.6897039981017621
Energy: 0.7744243830888655
Energy: 0.6559000481127878
Energy: 0.7576956730614332
Energy: 0.74558987636727
Energy: 0.757695673062005
Energy: 0.6595067873538315
Energy: 0.7750899642040499
Energy: 0.7648296760299987
Energy: 0.7750899642040499
Energy: 0.7039509672659842
Energy: 0.7227869801456275
Energy: 0.6563071195261163
Energy: 0.7227869801456275
Energy: 0.6584713835298279
Energy: 0.7580000302440988
Energy: 0.8746759006564597
Energy: 0.7580000302440988
Energy: 0.7648446284628977
Energy: 0.7475073893765032
Energy: 0.6854985035673156
Energy: 0.7475073893759313
Energy: 0.6591416501300925
Energy: 0.7287104977318724
Energy: 0.7269539412543925
Energy: 0.7287104977318724
Energy: 0.760445795644183
Energy: 0.7659883585354261
Energy: 0.7568288772959229
Energy: 0.7659883585354261
Energy: 0.711432846900213
Energy: 0.7493651027315296
Energy: 0.6555014911303422
Energy: 0.7493651027315296
Energy: 0.686815957991633
Energy: 0.7522435831405193
Energy: 0.6582280785054899
Energy: 0.7522435831405193
Energy: 0.8636194281598565
Energy: 0.7546437402755375
Energy: 0.6543217117394508
Energy: 0.7546437402755375
Energy: 0.6759125070543394
Energy: 0.8258995038175757
Energy: 0.8504690872431906
Energy: 0.8258995038181476
Energy: 0.7163079690068495
Energy: 0.7530850480347194
Energy: 0.6554354636899082
Energy: 0.7530850480352913
Energy: 0.725985970258282
Energy: 0.7513775164685748
Energy: 0.7449351682736219
Energy: 0.7513775164691466
Energy: 0.6873889716251702
Energy: 0.7702530391584042
Energy: 0.7457189957344895
Energy: 0.7702530391584042
Energy: 0.7289988570336065
Energy: 0.7357144549021783
Energy: 0.6547004885749149
Energy: 0.7357144549021783
Energy: 0.7055627230241501
Energy: 0.9029003889254176
Energy: 0.8506307172259828
Energy: 0.9029003889254176
Energy: 0.8718789931703766
Energy: 0.7531698033037754
Energy: 0.6536004216219847
Energy: 0.7531698033037754
Energy: 0.67360116006334
Energy: 0.7500876549533265
Energy: 0.6560565830083299
Energy: 0.7500876549527545
Energy: 0.6813911437307753
Energy: 0.7654239803384681
Energy: 0.6547594413382477
Energy: 0.7654239803384681
Energy: 0.7626220058839307
Energy: 0.7647640473845254
Energy: 0.7559895985411609
Energy: 0.7647640473850973
Energy: 0.6743095420435284
Energy: 0.7669764505776249
Energy: 0.8768321984277136
Energy: 0.766976450577053

minimum gb energy = 0.6536004216219847 eV
minimum distance =  2.51579014711369 Angstroms
sigma value = 73


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

Energy: 0.7602966458076573
Energy: 0.7544871542875472
Energy: 0.8991990737204587
Energy: 0.7544871542875472
Energy: 0.6605772343517671
Energy: 0.8265878657719272
Energy: 0.6855318597538431
Energy: 0.8265878657728345
Energy: 0.6478580232633142
Energy: 0.7120507162914623
Energy: 0.6659193953385222
Energy: 0.7120507162914623
Energy: 0.6524928616414846
Energy: 0.7559126066193185
Energy: 0.6679267692452874
Energy: 0.7559126066193185
Energy: 0.7035536755703455
Energy: 0.7345990103451643
Energy: 0.6638988454919815
Energy: 0.7345990103451643
Energy: 0.6671676307509852
Energy: 0.7567549541413053
Energy: 0.8464575583641787
Energy: 0.7567549541413053
Energy: 0.8496151105725287
Energy: 0.8083801015927163
Energy: 0.6480647123785509
Energy: 0.8083801015927163
Energy: 0.6652526881915398
Energy: 0.7259778938397233
Energy: 0.8224450668794427
Energy: 0.7259778938397233
Energy: 0.8514835781808645
Energy: 0.7289100057724753
Energy: 0.6955502683669357
Energy: 0.7289100057724753
Energy: 0.6491531968424592
Energy: 0.7293024767462768
Energy: 0.6476247521007139
Energy: 0.7293024767462768
Energy: 0.6681845049049258
Energy: 0.7444824677722587
Energy: 0.7956393070722809
Energy: 0.7444824677722587
Energy: 0.7530350152800436
Energy: 0.7616462224921339
Energy: 0.6528224220223099
Energy: 0.7616462224921339
Energy: 0.6671084719516417
Energy: 0.7489157791783028
Energy: 0.9769623288892231
Energy: 0.7489157791773954
Energy: 0.8619913120608773
Energy: 0.7705230572133909
Energy: 0.6682207594696801
Energy: 0.7705230572124835
Energy: 0.6729161404957421
Energy: 0.763028563337477
Energy: 0.8214318332259721
Energy: 0.763028563337477
Energy: 0.8210863467441424
Energy: 0.7445309329294059
Energy: 0.6657630629401915
Energy: 0.7445309329303132
Energy: 0.7214653125429185
Energy: 0.7715144434395702
Energy: 0.6478357530497432
Energy: 0.7715144434386627
Energy: 0.7335832367139169
Energy: 0.7477811909995995
Energy: 0.6489818194583431
Energy: 0.7477811909995995
Energy: 0.6510093740246867
Energy: 0.7365511800192577
Energy: 0.6648392905011433
Energy: 0.7365511800192577
Energy: 0.7123329588780124
Energy: 0.8377566569577901
Energy: 0.8431617467940776
Energy: 0.8377566569577901
Energy: 0.8379829308681213
Energy: 0.7580810452914412
Energy: 0.6667161560997739
Energy: 0.7580810452914412
Energy: 0.6724810221338146
Energy: 0.7338844371876824
Energy: 0.746469257389793
Energy: 0.7338844371876824

minimum gb energy = 0.6476247521007139 eV
minimum distance =  2.5219435047403 Angstroms
sigma value = 7


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

Energy: 0.731546647815633
Energy: 0.7599521025410201
Energy: 0.900446453633831
Energy: 0.7599521025403785
Energy: 0.7574120510105804
Energy: 0.8206590838364785
Energy: 0.733602896212995
Energy: 0.8206590838364785
Energy: 0.6867506268209628
Energy: 0.7722534246457137
Energy: 0.7023314016772274
Energy: 0.7722534246444305
Energy: 0.6805960224583554
Energy: 0.7563863821326559
Energy: 0.6988690522365094
Energy: 0.7563863821332972
Energy: 0.7168047406689059
Energy: 0.7485369193196334
Energy: 0.6835558082102585
Energy: 0.7485369193209166
Energy: 0.6781761366242536
Energy: 0.7656552019989267
Energy: 0.8329010044367094
Energy: 0.76565520200021
Energy: 0.7851773203449914
Energy: 0.8485727585481446
Energy: 0.6941083723964399
Energy: 0.848572758547503
Energy: 0.6783460662074693
Energy: 0.7511297457070255
Energy: 0.8960381025452351
Energy: 0.7511297457076671
Energy: 0.9134013450425494
Energy: 0.7576894087837492
Energy: 0.6790220202469638
Energy: 0.7576894087837492
Energy: 0.7157488276470237
Energy: 0.7603584404203806
Energy: 0.7638396249666337
Energy: 0.7603584404210222
Energy: 0.7089534242668725
Energy: 0.7626945850977361
Energy: 0.7109570287798415
Energy: 0.7626945850951699
Energy: 0.6885491105572515
Energy: 0.741573441981738
Energy: 0.669930903183766
Energy: 0.7415734419810964
Energy: 0.7160451871112767
Energy: 0.7668292684057538
Energy: 0.6711794740357367
Energy: 0.7668292684057538
Energy: 0.7015930709622143
Energy: 0.7647097804376571
Energy: 0.6701442451185131
Energy: 0.7647097804382986
Energy: 0.7096041918404906
Energy: 0.7536981854160892
Energy: 0.7611477560968233
Energy: 0.7536981854186264
Energy: 0.8934048191875325
Energy: 0.7477474520584082
Energy: 0.6759764994415315
Energy: 0.7477474520590497
Energy: 0.6998464633456574
Energy: 0.726493290699526
Energy: 0.7160237402569785
Energy: 0.7264932907001675
Energy: 0.68389601629092
Energy: 0.813411737358395
Energy: 0.6701808450884665
Energy: 0.8134117373603197
Energy: 0.6977600068259261
Energy: 0.7713610061868899
Energy: 0.6730069234830725
Energy: 0.7713610061862483
Energy: 0.7140420203978721
Energy: 0.7355633058129305
Energy: 0.6703433718765768
Energy: 0.7355633058129305
Energy: 0.8617760477638905
Energy: 0.7593107306942676
Energy: 0.679275777034292
Energy: 0.759310730693626
Energy: 0.6858334496614968
Energy: 0.769674951073486
Energy: 0.7819430370879371
Energy: 0.7696749510728444
Energy: 0.8223175777419393
Energy: 0.7615817817742618
Energy: 0.6732365669775129
Energy: 0.7615817817755449
Energy: 0.7327920669944277
Energy: 0.749703443721063
Energy: 0.856908761615221
Energy: 0.7497034437191674
Energy: 0.6914215810426644
Energy: 0.7350874439773689
Energy: 0.6724441663321394
Energy: 0.7350874439767273
Energy: 0.680602042392315
Energy: 0.7727557922066424
Energy: 0.7039238630844236
Energy: 0.7727557922060008
Energy: 0.71623941212907
Energy: 0.7554742904807954
Energy: 0.7464452285455986
Energy: 0.7554742904807954
Energy: 0.6808678790387482
Energy: 0.7264187306695528
Energy: 0.6844937420379096
Energy: 0.7264187306714777
Energy: 0.6752153644585895
Energy: 0.7568087842478107
Energy: 0.8253286555449745
Energy: 0.7568087842478107
Energy: 0.7117891142686497
Energy: 0.6901152384703529
Energy: 0.7506066887372687
Energy: 0.690115238471636
Energy: 0.6752202621374587
Energy: 0.7568525867789634
Energy: 0.8074101385856073
Energy: 0.7568525867802465

minimum gb energy = 0.669930903183766 eV
minimum distance =  2.49173347068636 Angstroms
sigma value = 29


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

Energy: 0.6526318867484606
Energy: 0.7206692136156657
Energy: 0.7417099040023957
Energy: 0.7206692136156657
Energy: 0.6459231566501775
Energy: 0.6785742809787567
Energy: 0.6873331206827356
Energy: 0.6785742809787567
Energy: 0.659877071582456
Energy: 0.7089681960062902
Energy: 0.6726122709260519
Energy: 0.7089681960062902
Energy: 0.6542850960212504
Energy: 0.6878994976371868
Energy: 0.6535295211641629
Energy: 0.6878994976371868
Energy: 0.6534799859010203
Energy: 0.6836826594766138
Energy: 0.6724547171593412
Energy: 0.6836826594766138
Energy: 0.6603482070159563
Energy: 0.7151045901747676
Energy: 0.6603175517036208
Energy: 0.7151045901752145
Energy: 0.6596773307031019
Energy: 0.6836812822737792
Energy: 0.6534767409702504
Energy: 0.6836812822740028
Energy: 0.6535430998175333
Energy: 0.6879231712848979
Energy: 0.654279946237307
Energy: 0.6879231712848979
Energy: 0.6727157838044777
Energy: 0.7089358782566149
Energy: 0.6723250604975499
Energy: 0.7089358782563914

minimum gb energy = 0.6459231566501775 eV
minimum distance =  2.56748714052752 Angstroms
sigma value = 5


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

Energy: 0.6660865886997999
Energy: 0.7142103607437263
Energy: 0.8498885034296987
Energy: 0.7142103607437263
Energy: 0.7547838050538973
Energy: 0.7867223222552067
Energy: 0.6412711893836545
Energy: 0.7867223222546006
Energy: 0.6330655701988385
Energy: 0.7386410352238778
Energy: 0.8005924639138136
Energy: 0.7386410352238778
Energy: 0.6506812681429149
Energy: 0.7365824839457629
Energy: 0.6543651078661804
Energy: 0.7365824839451568
Energy: 0.6487698534807702
Energy: 0.7646973807255247
Energy: 0.7340161773412757
Energy: 0.7646973807255247
Energy: 0.709249266239066
Energy: 0.7616850897881341
Energy: 0.6529603814088836
Energy: 0.761685089787528
Energy: 0.6462077857371391
Energy: 0.7208563231592763
Energy: 0.6496055221959433
Energy: 0.7208563231592763
Energy: 0.650091917275669
Energy: 0.7798658564108399
Energy: 0.6556647404915217
Energy: 0.7798658564102339
Energy: 0.649119633557943
Energy: 0.782243595427241
Energy: 0.6585607451957253
Energy: 0.7822435954278472
Energy: 0.6477250998344245
Energy: 0.7229314250609601
Energy: 0.6560683164408736
Energy: 0.7229314250615662
Energy: 0.6863507875999263
Energy: 0.8186360349443585
Energy: 0.6352061838126586
Energy: 0.8186360349443585
Energy: 0.6449308470783285
Energy: 0.7710313260913746
Energy: 0.7080701817026415
Energy: 0.7710313260913746
Energy: 0.7000718392364967
Energy: 0.746504443341851
Energy: 0.6917058210979045
Energy: 0.7465044433412449
Energy: 0.6418200299287796
Energy: 0.778822392620651
Energy: 0.7471693921225472
Energy: 0.778822392620651
Energy: 0.6706628725264571
Energy: 0.7665010650248261
Energy: 0.6395540961504236
Energy: 0.7665010650242199
Energy: 0.6568963268873546
Energy: 0.7321194930114783
Energy: 0.6980295482450404
Energy: 0.7321194930114783
Energy: 0.7601290124335648
Energy: 0.7600174597908989
Energy: 0.6393733758551545
Energy: 0.7600174597908989
Energy: 0.6367007852483744
Energy: 0.7399473976613171
Energy: 0.7438750698754022
Energy: 0.7399473976619231
Energy: 0.6382792159888492
Energy: 0.7304936017057443
Energy: 0.654289074360052
Energy: 0.7304936017057443
Energy: 0.6483676612584652
Energy: 0.8378070315806582
Energy: 0.6796176875444061
Energy: 0.8378070315812641
Energy: 0.6467318194457163
Energy: 0.7866567858614248
Energy: 0.6562884019580217
Energy: 0.7866567858620309
Energy: 0.6507204029027623
Energy: 0.7192470095513276
Energy: 0.6505996702721965
Energy: 0.7192470095513276
Energy: 0.6438475558555005
Energy: 0.7889887440045702
Energy: 0.6488836572448657
Energy: 0.7889887440045702
Energy: 0.7031347780618142
Energy: 0.7554498190797354
Energy: 0.6482692375747163
Energy: 0.7554498190803414
Energy: 0.7103743119118795
Energy: 0.7141924617285724
Energy: 0.6543536879605467
Energy: 0.7141924617291786
Energy: 0.6758098054830759
Energy: 0.7608243448751865
Energy: 0.6505578829030383
Energy: 0.7608243448751865
Energy: 0.6438762886227657
Energy: 0.7387657856515445
Energy: 0.6863210895213231
Energy: 0.7387657856509385
Energy: 0.7151129827319265
Energy: 0.8235587553257494
Energy: 0.656897818712318
Energy: 0.8235587553257494
Energy: 0.6392430728905485
Energy: 0.8430802245103919
Energy: 0.7596906427365582
Energy: 0.8430802245103919
Energy: 0.7663911786143678
Energy: 0.7641194507405603
Energy: 0.6367805707834204
Energy: 0.7641194507405603
Energy: 0.651509212335797
Energy: 0.6991905483382324
Energy: 0.7406913753515335
Energy: 0.6991905483382324
Energy: 0.7706286035506968
Energy: 0.8021795061566726
Energy: 0.6383878714872211
Energy: 0.8021795061572785
Energy: 0.6590186426559674
Energy: 0.821984953343932
Energy: 0.8118196194101805
Energy: 0.821984953343932

minimum gb energy = 0.6330655701988385 eV
minimum distance =  2.50664560342423 Angstroms
sigma value = 1


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

Energy: 0.7527257263051227
Energy: 0.7474720513350367
Energy: 0.7609353893210354
Energy: 0.7474720513341987
Energy: 0.6816959276057812
Energy: 0.8423241191565188
Energy: 0.6186626145184252
Energy: 0.8423241191565188
Energy: 0.628936362140953
Energy: 0.7247836564929379
Energy: 0.7450285691924843
Energy: 0.7247836564937759
Energy: 0.6238354774807204
Energy: 0.7733009631396854
Energy: 0.6332853251786792
Energy: 0.7733009631396854
Energy: 0.6208898385228764
Energy: 0.7562637573954825
Energy: 0.7422501684554069
Energy: 0.7562637573954825
Energy: 0.6196094445601372
Energy: 0.7858489618729431
Energy: 0.633383498947412
Energy: 0.7858489618729431
Energy: 0.6350426397271997
Energy: 0.7174443796864378
Energy: 0.6646626765841621
Energy: 0.7174443796864378
Energy: 0.6281589205831719
Energy: 0.7017233912661737
Energy: 0.6463802855106756
Energy: 0.7017233912661737
Energy: 0.6873289293960586
Energy: 0.7049068162278026
Energy: 0.6839305294832689
Energy: 0.7049068162278026
Energy: 0.6869415170349591
Energy: 0.7187447579970422
Energy: 0.6448266690824649
Energy: 0.7187447579970422
Energy: 0.6278911428760212
Energy: 0.717566982556872
Energy: 0.6663105402709117
Energy: 0.7175669825577101
Energy: 0.6274377342542202
Energy: 0.7446489664719076
Energy: 0.6623687997413112
Energy: 0.7446489664719076
Energy: 0.614288057310424
Energy: 0.798456066510962
Energy: 0.6350092186184626
Energy: 0.798456066510124
Energy: 0.612369369745548
Energy: 0.7432232859139775
Energy: 0.6819656177868831
Energy: 0.7432232859131394
Energy: 0.6738964232777213
Energy: 0.7395551413012912
Energy: 0.6415424428457273
Energy: 0.7395551413021291
Energy: 0.6289611932405869
Energy: 0.7010315820985094
Energy: 0.6595520801624327
Energy: 0.7010315820976715
Energy: 0.7235861898514642
Energy: 0.8446531311813965
Energy: 0.6158603911798305
Energy: 0.8446531311813965
Energy: 0.7527257263051227
Energy: 0.7474720513341987
Energy: 0.7834079589044203
Energy: 0.7474720513341987
Energy: 0.6816959276057812
Energy: 0.8423241191565188
Energy: 0.6186626145184252
Energy: 0.8423241191556808
Energy: 0.628936362141772
Energy: 0.7247836564929379
Energy: 0.7450285691924843
Energy: 0.7247836564937759
Energy: 0.6238354774807204
Energy: 0.7733009631396854
Energy: 0.6332853251786792
Energy: 0.7733009631396854
Energy: 0.6208898385228764
Energy: 0.7562637573954825
Energy: 0.7422501684554069
Energy: 0.7562637573954825
Energy: 0.6196094445592992
Energy: 0.7858489618729431
Energy: 0.6333834989482501
Energy: 0.7858489618729431
Energy: 0.6350426397280375
Energy: 0.7174443796864378
Energy: 0.6876061296255288
Energy: 0.7174443796864378

minimum gb energy = 0.612369369745548 eV
minimum distance =  2.54012119658518 Angstroms
sigma value = 17


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

Energy: 0.6656613874569235
Energy: 0.6662931912373433
Energy: 0.7850478668720089
Energy: 0.6662931912373433
Energy: 0.8046797079913943
Energy: 0.7744474994526016
Energy: 0.628210708565124
Energy: 0.7744474994526016
Energy: 0.6303854649611889
Energy: 0.6932027763452414
Energy: 0.7951505513231933
Energy: 0.6932027763447235
Energy: 0.6937598073400466
Energy: 0.7341639539179039
Energy: 0.6238095546286404
Energy: 0.7341639539179039
Energy: 0.629414709136294
Energy: 0.7537921192641119
Energy: 0.7458711290936282
Energy: 0.7537921192641119
Energy: 0.636174875445312
Energy: 0.8268417711779953
Energy: 0.6293981261481408
Energy: 0.8268417711779953
Energy: 0.633891528186263
Energy: 0.7262679547322246
Energy: 0.6812029141322167
Energy: 0.7262679547322246
Energy: 0.6256995517209443
Energy: 0.7304440718830632
Energy: 0.6307506106024849
Energy: 0.7304440718825452
Energy: 0.6732775323616355
Energy: 0.7419210470438129
Energy: 0.672139200616788
Energy: 0.7419210470438129
Energy: 0.6737758929765414
Energy: 0.8051704220616905
Energy: 0.635280463181867
Energy: 0.8051704220616905
Energy: 0.6319821120953312
Energy: 0.7870037179438084
Energy: 0.6352307044889312
Energy: 0.7870037179438084
Energy: 0.6338752228342421
Energy: 0.6739991079803322
Energy: 0.6341473005224193
Energy: 0.6739991079803322
Energy: 0.6332389753027108
Energy: 0.8046348236373164
Energy: 0.6285458380345902
Energy: 0.8046348236378345
Energy: 0.6358655245472901
Energy: 0.7483448487538064
Energy: 0.685740597192863
Energy: 0.7483448487538064
Energy: 0.6352615244263403
Energy: 0.7716501508604628
Energy: 0.672479736245316
Energy: 0.7716501508604628
Energy: 0.632425771507211
Energy: 0.7279866453481333
Energy: 0.7459960297992569
Energy: 0.7279866453491692
Energy: 0.661937191387913
Energy: 0.7292414823842645
Energy: 0.6284350769011683
Energy: 0.7292414823842645
Energy: 0.6184047890114827
Energy: 0.6973741931372763
Energy: 0.6539609027555547
Energy: 0.6973741931372763
Energy: 0.7507463342263865
Energy: 0.7936220551679998
Energy: 0.6286358439897729
Energy: 0.7936220551669639
Energy: 0.6233410068349922
Energy: 0.6614184600531662
Energy: 0.7998637290732228
Energy: 0.6614184600526483
Energy: 0.8472594001538603
Energy: 0.717463285991659
Energy: 0.6238805587970753
Energy: 0.717463285991659
Energy: 0.6237302295118953
Energy: 0.7478286816777227
Energy: 0.7156181246513085
Energy: 0.7478286816777227
Energy: 0.8483249600649695
Energy: 0.7269686412604771
Energy: 0.62472579395591
Energy: 0.7269686412604771
Energy: 0.6294910788491982
Energy: 0.7315297008364654
Energy: 0.7698093142708238
Energy: 0.731529700838019
Energy: 0.6889503458862083
Energy: 0.6973020874762804
Energy: 0.6192208041646041
Energy: 0.6973020874762804
Energy: 0.6295590567460383
Energy: 0.701038406624063
Energy: 0.6603865836648964
Energy: 0.701038406624581
Energy: 0.7238076047700438
Energy: 0.8104022306206985
Energy: 0.6307164604892668
Energy: 0.8104022306212164
Energy: 0.6751978348353784
Energy: 0.7604276736906893
Energy: 0.6337435835899777
Energy: 0.7604276736906893
Energy: 0.6823219742820529
Energy: 0.734631209941062
Energy: 0.6364388017878003
Energy: 0.7346312099405442
Energy: 0.6238595213621273
Energy: 0.7777935947231029
Energy: 0.680236915856343
Energy: 0.7777935947231029
Energy: 0.633117763818824
Energy: 0.7066504032746372
Energy: 0.63550932543642
Energy: 0.7066504032751552
Energy: 0.6309860393583668
Energy: 0.7827438665275981
Energy: 0.6270500159640252
Energy: 0.7827438665275981
Energy: 0.6327413155982111
Energy: 0.795008160106617
Energy: 0.7459909516864444
Energy: 0.795008160106617
Energy: 0.6761309522033914
Energy: 0.7431409124707304
Energy: 0.6346082050352045
Energy: 0.7431409124722842
Energy: 0.6299998611661841
Energy: 0.7331130483564564
Energy: 0.6563596263105512
Energy: 0.7331130483564564
Energy: 0.6909081278973237
Energy: 0.7473217854119423
Energy: 0.6301471583448401
Energy: 0.7473217854119423
Energy: 0.6247359829486714
Energy: 0.8236640620563428
Energy: 0.7947372813439388
Energy: 0.8236640620563428
Energy: 0.7805523602755594
Energy: 0.7476480609195412
Energy: 0.6297100527485855
Energy: 0.7476480609195412

minimum gb energy = 0.6184047890114827 eV
minimum distance =  2.53650279734714 Angstroms
sigma value = 89


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

Energy: 0.5812279466626853
Energy: 0.5813389574160626
Energy: 0.6490279182378844
Energy: 0.5813389574160626
Energy: 0.5828260394345054
Energy: 0.5964446867665465
Energy: 0.5929081064329511
Energy: 0.5964446867665465
Energy: 0.590671152284611
Energy: 0.7060830978907262
Energy: 0.6564226067442201
Energy: 0.7060830978907262
Energy: 0.612121573148634
Energy: 0.5958330841318518
Energy: 0.5928250056935197
Energy: 0.5958330841318518
Energy: 0.5913766890545412
Energy: 0.6700877154665141
Energy: 0.8370718238919433
Energy: 0.6700877154665141
Energy: 0.5908471258251421
Energy: 0.5816015814580806
Energy: 0.584676808945217
Energy: 0.5816015814580806
Energy: 0.5905929106797912
Energy: 0.7070210247497133
Energy: 0.5825164827816126
Energy: 0.7070210247510685
Energy: 0.6311973405285085
Energy: 0.7060756890097862
Energy: 0.5927464774776492
Energy: 0.7060756890097862
Energy: 0.5910526250545975
Energy: 0.6324385300139794
Energy: 0.6100935215321445
Energy: 0.6324385300139794
Energy: 0.6161712966884706
Energy: 0.6699698056064612
Energy: 0.5843346818977349
Energy: 0.6699698056064612
Energy: 0.5814648695242476
Energy: 0.5962239783696204
Energy: 0.590466444165808
Energy: 0.5962239783696204
Energy: 0.5821162855110927
Energy: 0.6680320043304925
Energy: 0.5922690108521365
Energy: 0.6680320043318476
Energy: 0.5910155093834882
Energy: 0.6702911809616453
Energy: 0.632008439184369
Energy: 0.6702911809616453
Energy: 0.5912112373639752
Energy: 0.6308857535224937
Energy: 0.5912064935678386
Energy: 0.6308857535211384
Energy: 0.6092257390965292
Energy: 0.6703685855184677
Energy: 0.5909913291695144
Energy: 0.6703685855184677

minimum gb energy = 0.5812279466626853 eV
minimum distance =  2.55337448721611 Angstroms
sigma value = 13


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

Energy: 0.5814650954750565
Energy: 0.7043989593104405
Energy: 0.8963801438926537
Energy: 0.7043989593087365
Energy: 0.7438754175181704
Energy: 0.7121625197109751
Energy: 0.5691737543737562
Energy: 0.7121625197092712
Energy: 0.5692382412907306
Energy: 0.735820206082401
Energy: 0.8181780108659622
Energy: 0.7358202060829689
Energy: 0.5730232265251202
Energy: 0.7119414959089685
Energy: 0.5705861789963007
Energy: 0.7119414959350706
Energy: 0.5786490814766257
Energy: 0.7581448786448104
Energy: 0.6055414728601404
Energy: 0.7581448786431063
Energy: 0.8303670830449928
Energy: 0.6465491967837294
Energy: 0.5721470127030923
Energy: 0.6465491967831614
Energy: 0.5784835597147786
Energy: 0.7488114996384654
Energy: 0.7077538946738697
Energy: 0.7488114996384654
Energy: 0.572757979200059
Energy: 0.7418067929188561
Energy: 0.572057749136169
Energy: 0.7418067929171521
Energy: 0.5776752400544625
Energy: 0.7481875668202115
Energy: 0.6861024977079728
Energy: 0.7481875668196435
Energy: 0.6724547318869871
Energy: 0.766117453324757
Energy: 0.5707507261584578
Energy: 0.7661174533236209
Energy: 0.5785641520386262
Energy: 0.7044909922592751
Energy: 0.6160304980353567
Energy: 0.7044909922604112
Energy: 0.7047397063214875
Energy: 0.7454646839159818
Energy: 0.5761789331102997
Energy: 0.7454646839148459
Energy: 0.5893986226815721
Energy: 0.7589435355631148
Energy: 0.5717088646863027
Energy: 0.7589435355625468
Energy: 0.7150404659280779
Energy: 0.7542059443740429
Energy: 0.576462283807996
Energy: 0.7542059443734749
Energy: 0.5785951729757453
Energy: 0.7269738659118842
Energy: 0.5743415924948547
Energy: 0.7269738659124522
Energy: 0.5662601135453984
Energy: 0.6740889281906106
Energy: 0.5764955083115171
Energy: 0.6740889281889068
Energy: 0.5767149754193864
Energy: 0.7267409584705895
Energy: 0.5765521799302735
Energy: 0.7267409584722934
Energy: 0.5904657469207605
Energy: 0.7802109286412292
Energy: 0.5809579327646479
Energy: 0.780210928638415
Energy: 0.5750846788593933
Energy: 0.7710561904230443
Energy: 0.5812600752701694
Energy: 0.7710561904241804
Energy: 0.5750329118672248
Energy: 0.7707201861446586
Energy: 0.5807844095388963
Energy: 0.7707201861429546
Energy: 0.5904772650364684
Energy: 0.7802355031172834
Energy: 0.5807409241341143
Energy: 0.7802355031161473
Energy: 0.574765716609243
Energy: 0.7267719558421799
Energy: 0.576596124851596
Energy: 0.7267719558438839
Energy: 0.5662416152900003
Energy: 0.674100760194935
Energy: 0.5764917073695369
Energy: 0.6741007601971813
Energy: 0.5785890643117171
Energy: 0.7269825484287571
Energy: 0.5930542597210718
Energy: 0.7269825484287571
Energy: 0.7150301671160298
Energy: 0.7542710204686857
Energy: 0.5764398267312391
Energy: 0.7542710204669817
Energy: 0.5889013850438439
Energy: 0.759127784169905
Energy: 0.5933492820728614
Energy: 0.759127784168769
Energy: 0.7045952643517641
Energy: 0.7452422838012936
Energy: 0.5760349226415903
Energy: 0.7452422838029977
Energy: 0.5772766558833561
Energy: 0.704712117943662
Energy: 0.6159365981680922
Energy: 0.704712117943094
Energy: 0.6724875633470594
Energy: 0.7659210399270128
Energy: 0.570742385324285
Energy: 0.7659210399247407
Energy: 0.5775210233591864
Energy: 0.7484460791332546
Energy: 0.7116026003956875
Energy: 0.7484460791338226
Energy: 0.572472811842064
Energy: 0.7423857451184569
Energy: 0.5720581721839715
Energy: 0.7423857451190249
Energy: 0.5785283681808788
Energy: 0.7479776211870712
Energy: 0.7782288223837437
Energy: 0.7479776211887752
Energy: 0.8299596019270938
Energy: 0.6466214896003515
Energy: 0.5720376858020984
Energy: 0.6466214896014875
Energy: 0.5784696762858024
Energy: 0.7577059935097643
Energy: 0.6146634563093843
Energy: 0.7577059935074923
Energy: 0.5735946726215527
Energy: 0.7120906373075069
Energy: 0.5705918951840799
Energy: 0.7120906373086429

minimum gb energy = 0.5662416152900003 eV
minimum distance =  2.40872652633234 Angstroms
sigma value = 37


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

Energy: 0.6069045254069838
Energy: 0.5974361566674623
Energy: 0.9191605809919988
Energy: 0.5974361566674623
Energy: 0.7850430403320138
Energy: 0.6432414989161329
Energy: 0.5252079712486395
Energy: 0.6432414989161329
Energy: 0.5334931580747122
Energy: 0.7852226584451832
Energy: 0.7382946793754733
Energy: 0.785222658444206
Energy: 0.5734621972174936
Energy: 0.5927350750717425
Energy: 0.5275018929977686
Energy: 0.5927350750717425
Energy: 0.5253360168493958
Energy: 0.6390720441010118
Energy: 0.6868290103859293
Energy: 0.6390720441019891
Energy: 0.5435288518426921
Energy: 0.7016012696276754
Energy: 0.5876869557397033
Energy: 0.7016012696266982
Energy: 0.5321376047605817
Energy: 0.7817476803394539
Energy: 0.7047943492344759
Energy: 0.7817476803394539
Energy: 0.5145687816983149
Energy: 0.5329777731019617
Energy: 0.5347555302388851
Energy: 0.5329777731019617
Energy: 0.5269222949922616
Energy: 0.6434753567293892
Energy: 0.6380944310627713
Energy: 0.6434753567293892
Energy: 0.6962488240614799
Energy: 0.763460395309485
Energy: 0.5876713005936305
Energy: 0.7634603953085078
Energy: 0.533754534367652
Energy: 0.7293755882724067
Energy: 0.5876061469381582
Energy: 0.7293755882724067
Energy: 0.6704938531902513
Energy: 0.63907535035768
Energy: 0.5274192621563624
Energy: 0.6390753503567028
Energy: 0.5856727898909466
Energy: 0.6970177168118908
Energy: 0.5295720395208575
Energy: 0.6970177168118908
Energy: 0.7059799274318362
Energy: 0.7814170941340046
Energy: 0.5197428806357409
Energy: 0.7814170941340046
Energy: 0.6069125546145325
Energy: 0.6096736151698715
Energy: 0.5245144189002587
Energy: 0.6096736151698715
Energy: 0.6081121519586229
Energy: 0.632806952609858
Energy: 0.5250622690526321
Energy: 0.632806952609858
Energy: 0.5856134738588219
Energy: 0.750062916267886
Energy: 0.5198187243404288
Energy: 0.750062916267886
Energy: 0.587840578743896
Energy: 0.7374956558429653
Energy: 0.5255930375389941
Energy: 0.7374956558429653
Energy: 0.5256686984124576
Energy: 0.6391751481631177
Energy: 0.5253542130528838
Energy: 0.6391751481631177
Energy: 0.5251883529432229
Energy: 0.7093584746634675
Energy: 0.5856628147132326
Energy: 0.7093584746624901

minimum gb energy = 0.5145687816983149 eV
minimum distance =  2.52847358507586 Angstroms
sigma value = 25


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

Energy: 0.5494766759158328
Energy: 0.730973155103464
Energy: 0.8919904055856703
Energy: 0.730973155102701
Energy: 0.7069146005868573
Energy: 0.6458569533354804
Energy: 0.47547378960802494
Energy: 0.6458569533362434
Energy: 0.5246548443737709
Energy: 0.5183503379118494
Energy: 0.6764134275071932
Energy: 0.5183503379110864
Energy: 0.604970665043909
Energy: 0.6136865286260673
Energy: 0.4763161807524613
Energy: 0.6136865286260673
Energy: 0.4809937431519042
Energy: 0.6463540616841343
Energy: 0.5112470999697107
Energy: 0.6463540616833712
Energy: 0.5087876113548537
Energy: 0.645815959257366
Energy: 0.48274478458657405
Energy: 0.645815959257366
Energy: 0.47560555904774876
Energy: 0.5577766933919706
Energy: 0.659525107050005
Energy: 0.5577766933919706
Energy: 0.4790283806211994
Energy: 0.6165470729789281
Energy: 0.5256900794206799
Energy: 0.6165470729789281
Energy: 0.4747894574210784
Energy: 0.6473491749398006
Energy: 0.7921337338637574
Energy: 0.6473491749405635
Energy: 0.4630235221130779
Energy: 0.6404856293371165
Energy: 0.4948923665397674
Energy: 0.6404856293371165
Energy: 0.47567975370558047
Energy: 0.5571618190676809
Energy: 0.6454434986058178
Energy: 0.5571618190676809
Energy: 0.5997660430455168
Energy: 0.7001362683742972
Energy: 0.5258245644459325
Energy: 0.700136268373534
Energy: 0.47730849472045317
Energy: 0.6145709748420384
Energy: 0.6053193982632235
Energy: 0.6145709748420384
Energy: 0.6210719344518832
Energy: 0.6866323179785275
Energy: 0.48291098792464854
Energy: 0.6866323179777645
Energy: 0.4829826184514663
Energy: 0.6012253149753108
Energy: 0.5148987232807898
Energy: 0.6012253149753108
Energy: 0.6411086659293773
Energy: 0.700227457456444
Energy: 0.474655498549009
Energy: 0.700227457456444
Energy: 0.5288763135891521
Energy: 0.6177282574006635
Energy: 0.4706173533572048
Energy: 0.6177282574006635
Energy: 0.6235557277959994
Energy: 0.6669439816346653
Energy: 0.4756740963263425
Energy: 0.6669439816346653
Energy: 0.5535118033811927
Energy: 0.6751819287863985
Energy: 0.46868942123044516
Energy: 0.6751819287863985
Energy: 0.7348691574965758
Energy: 0.6843035332306368
Energy: 0.47498293497579813
Energy: 0.6843035332298737
Energy: 0.5288935391085429
Energy: 0.6996905196013294
Energy: 0.4739878454005755
Energy: 0.6996905196005664
Energy: 0.5257146438158914
Energy: 0.6333102889869092
Energy: 0.4802480090466004
Energy: 0.6333102889869092
Energy: 0.48292743690060813
Energy: 0.6964993009597822
Energy: 0.6225669597968206
Energy: 0.6964993009605454
Energy: 0.5148475243484003
Energy: 0.694693227775998
Energy: 0.48047939166369147
Energy: 0.694693227775235
Energy: 0.4749174076544116
Energy: 0.7002813673437248
Energy: 0.6701298892540385
Energy: 0.7002813673437248
Energy: 0.4692107986002168
Energy: 0.6369935676559517
Energy: 0.5249561580464416
Energy: 0.6369935676559517

minimum gb energy = 0.4630235221130779 eV
minimum distance =  2.50924019560007 Angstroms
sigma value = 41


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

Energy: 0.5966998130914927
Energy: 0.5719755049833015
Energy: 0.4475638260095016
Energy: 0.571975504982676
Energy: 0.6810809843455699
Energy: 0.567170246271893
Energy: 0.4283202217963457
Energy: 0.567170246271893
Energy: 0.4378687508253467
Energy: 0.5647972644852672
Energy: 0.8354912672481644
Energy: 0.5647972644852672
Energy: 0.5241116577507097
Energy: 0.5675227130443157
Energy: 0.4284887941906192
Energy: 0.5675227130449413
Energy: 0.42512251818786684
Energy: 0.5785226210294965
Energy: 0.46160161961013185
Energy: 0.5785226210276196
Energy: 0.5963742545547716
Energy: 0.567882341585752
Energy: 0.428310921834607
Energy: 0.5678823415851263
Energy: 0.42775967243458346
Energy: 0.5675816113939399
Energy: 0.6351513444160154
Energy: 0.5675816113939399
Energy: 0.4240376521180606
Energy: 0.5065710983640482
Energy: 0.42568450980058786
Energy: 0.5065710983640482
Energy: 0.4301262435667371
Energy: 0.6136123167916703
Energy: 0.6550429113361893
Energy: 0.6136123167910447
Energy: 0.42774063770581916
Energy: 0.5651151981947614
Energy: 0.43858537381003426
Energy: 0.5651151982341461
Energy: 0.4277149731962866
Energy: 0.5677251257514686
Energy: 0.6771982662493992
Energy: 0.5677251257508429
Energy: 0.4217562119505313
Energy: 0.5711979464183262
Energy: 0.5973714267924024
Energy: 0.5711979464177006
Energy: 0.43007457714211555
Energy: 0.6142741347973084
Energy: 0.6773517436319906
Energy: 0.6142741347966828
Energy: 0.48811606374663563
Energy: 0.7012407014725245
Energy: 0.4385550388191472
Energy: 0.7012407014725245
Energy: 0.42785935778831524
Energy: 0.5913336336615264
Energy: 0.5787536459104338
Energy: 0.591333633662152
Energy: 0.5404199260701701
Energy: 0.6217269998539352
Energy: 0.4257164081468646
Energy: 0.6217269998545608
Energy: 0.4301572868832763
Energy: 0.6132897782467464
Energy: 0.5394856236772505
Energy: 0.6132897782454951
Energy: 0.5291605830992739
Energy: 0.7041075657191873
Energy: 0.4283559720378276
Energy: 0.7041075657191873
Energy: 0.4277774098363185
Energy: 0.5301208840519699
Energy: 0.4246070268621419
Energy: 0.5301208840519699
Energy: 0.5248888089610442
Energy: 0.6210251931368289
Energy: 0.43298571263509816
Energy: 0.6210251931362033
Energy: 0.4404029446364314
Energy: 0.6432346284422562
Energy: 0.4277935381709247
Energy: 0.6432346284422562
Energy: 0.6748290503916426
Energy: 0.6869452189619263
Energy: 0.4282240047515479
Energy: 0.6869452189619263
Energy: 0.59914823965986
Energy: 0.5960012307911009
Energy: 0.4251712598419835
Energy: 0.5960012307904752
Energy: 0.6020207363172827
Energy: 0.6150871022932466
Energy: 0.4325704450745966
Energy: 0.6150871022919954
Energy: 0.4405875226329735
Energy: 0.6717018991589285
Energy: 0.43443202093320565
Energy: 0.671701899159554
Energy: 0.5828886545329981
Energy: 0.6788171232097701
Energy: 0.4283557244743369
Energy: 0.6788171232091443
Energy: 0.4277755644801048
Energy: 0.6222133644051528
Energy: 0.5312575906829864
Energy: 0.6222133644051528
Energy: 0.425516930433608
Energy: 0.6129749650841836
Energy: 0.432774637395553
Energy: 0.6129749650841836
Energy: 0.43015091913337333
Energy: 0.6505193238014874
Energy: 0.5292524979827463
Energy: 0.650519323802113
Energy: 0.42445642432768915
Energy: 0.633404201304849
Energy: 0.43070363059282346
Energy: 0.633404201304849
Energy: 0.4333289537463967
Energy: 0.6221435454047605
Energy: 0.5099790308333562
Energy: 0.6221435454047605
Energy: 0.4248649462824631
Energy: 0.6337322770558189
Energy: 0.4434983038405544
Energy: 0.6337322770558189

minimum gb energy = 0.4217562119505313 eV
minimum distance =  2.49814539848362 Angstroms
sigma value = 15


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

Energy: 0.5431952581191827
Energy: 0.6633823681422345
Energy: 0.7537939531074691
Energy: 0.6633823681427644
Energy: 0.6185266181774958
Energy: 0.6023274174251606
Energy: 0.40024421914700126
Energy: 0.6023274174251606
Energy: 0.41138829160118606
Energy: 0.5133776544900731
Energy: 0.40104072666283624
Energy: 0.5133776544900731
Energy: 0.6181863747056661
Energy: 0.6002973079276424
Energy: 0.4003310588123
Energy: 0.6002973079271123
Energy: 0.3984180453840704
Energy: 0.7111364616973683
Energy: 0.623396116333685
Energy: 0.7111364616973683
Energy: 0.5259123413746597
Energy: 0.6011920180286324
Energy: 0.40042619919982136
Energy: 0.6011920180286324
Energy: 0.39988623300787346
Energy: 0.5176582693442495
Energy: 0.42426410358106653
Energy: 0.5176582693447795
Energy: 0.4514063284304314
Energy: 0.5170881763442552
Energy: 0.40040990976123647
Energy: 0.5170881763442552
Energy: 0.40164195550669396
Energy: 0.6667419169271858
Energy: 0.6052542076398039
Energy: 0.6667419169261258
Energy: 0.3906352170284893
Energy: 0.6332910310976595
Energy: 0.3987636563354521
Energy: 0.6332910310981895
Energy: 0.3999420464306668
Energy: 0.5641388385973534
Energy: 0.6181631371156286
Energy: 0.5641388385968233
Energy: 0.39777538945976565
Energy: 0.5129701086335142
Energy: 0.4116994390389389
Energy: 0.5129701086308643
Energy: 0.40150028696887813
Energy: 0.6355137315473676
Energy: 0.6819574664362978
Energy: 0.6355137315463076
Energy: 0.38931970931322857
Energy: 0.663176380627425
Energy: 0.543574945281255
Energy: 0.663176380627425
Energy: 0.39979505180521585
Energy: 0.5627671169108072
Energy: 0.701636814835937
Energy: 0.5627671169108072
Energy: 0.464529150736126
Energy: 0.5129235277349629
Energy: 0.41180836695009415
Energy: 0.5129235277291333
Energy: 0.40150618622263334
Energy: 0.6302759798091497
Energy: 0.61429680468778
Energy: 0.6302759798086196
Energy: 0.5017528319168454
Energy: 0.6460369540998785
Energy: 0.39882825768464225
Energy: 0.6460369540993486
Energy: 0.4000806697912178
Energy: 0.5647569640297542
Energy: 0.5268473622024376
Energy: 0.5647569640297542
Energy: 0.48297872117017665
Energy: 0.5664697899211112
Energy: 0.4002770110592856
Energy: 0.5664697899205813
Energy: 0.40162473781475
Energy: 0.5684383657293268
Energy: 0.45443257760423644
Energy: 0.5684383657293268
Energy: 0.4798219156546494
Energy: 0.6427072866403206
Energy: 0.40344727551932325
Energy: 0.6427072866403206
Energy: 0.39992788487571396
Energy: 0.5737910480061801
Energy: 0.3909805134964767
Energy: 0.5737910480061801
Energy: 0.5933047775714629
Energy: 0.5651288443152731
Energy: 0.40020101755916304
Energy: 0.5651288443158031
Energy: 0.4129950610592989
Energy: 0.5896227578887253
Energy: 0.39719085164905804
Energy: 0.5896227578887253
Energy: 0.6397940475372185
Energy: 0.6216806820476167
Energy: 0.4033564187845367
Energy: 0.6216806820470866
Energy: 0.5446054341570876
Energy: 0.5915983652621257
Energy: 0.40424962239795065
Energy: 0.5915983652615958
Energy: 0.6996734482417382
Energy: 0.5548805001720413
Energy: 0.4003074253450612
Energy: 0.5548805001720413
Energy: 0.4129973463564601
Energy: 0.6574538680119006
Energy: 0.3964981258165196
Energy: 0.6574538680124304
Energy: 0.5279350848631245
Energy: 0.6365022904412665
Energy: 0.403375551271519
Energy: 0.6365022904412665
Energy: 0.3998813358775269
Energy: 0.6133808697514415
Energy: 0.483047117890923
Energy: 0.6133808697519715
Energy: 0.5219569207000145
Energy: 0.5572690993420961
Energy: 0.40046368850694913
Energy: 0.5572690993410362
Energy: 0.40151304672980875
Energy: 0.6574231207898409
Energy: 0.48172644661142505
Energy: 0.6574231207898409
Energy: 0.39123370779506567
Energy: 0.5732238638593377
Energy: 0.4034116625068573
Energy: 0.5732238638593377
Energy: 0.39400680014881945
Energy: 0.6120492743281153
Energy: 0.4796585206171519
Energy: 0.6120492743275854
Energy: 0.39120194035742717
Energy: 0.5782822975065139
Energy: 0.40192070172958677
Energy: 0.5782822975065139
Energy: 0.40135949290907436
Energy: 0.6573361595265871
Energy: 0.6054060436990971
Energy: 0.6573361595271171

minimum gb energy = 0.38931970931322857 eV
minimum distance =  2.51291356350374 Angstroms
sigma value = 85


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

Energy: 0.5493026925381697
Energy: 0.6236525818815555
Energy: 0.49775924696092416
Energy: 0.6236525818806361
Energy: 0.6710354593382981
Energy: 0.5380289382611375
Energy: 0.3642299309649737
Energy: 0.5380289382602181
Energy: 0.5306875802639608
Energy: 0.5093870677924528
Energy: 0.4157293821599985
Energy: 0.5093870677924528
Energy: 0.5937902925699409
Energy: 0.5379540822852762
Energy: 0.3642272053934488
Energy: 0.5379540822848167
Energy: 0.4099504429698643
Energy: 0.49717687657435555
Energy: 0.4061878472911834
Energy: 0.49717687657527476
Energy: 0.6587431507784633
Energy: 0.5102359684924147
Energy: 0.3640464829721064
Energy: 0.5102359684924147
Energy: 0.39362711723774624
Energy: 0.47818805900577016
Energy: 0.43984670259856457
Energy: 0.47818805900577016
Energy: 0.4990582136946183
Energy: 0.5470224149160896
Energy: 0.36821989141597367
Energy: 0.5470224149151703
Energy: 0.3674814469427682
Energy: 0.46373079906581294
Energy: 0.4768406647142675
Energy: 0.46373079906581294
Energy: 0.4315493158623246
Energy: 0.4748036328094665
Energy: 0.39413719185662244
Energy: 0.47480363280900684
Energy: 0.3655609831989706
Energy: 0.5381276496973616
Energy: 0.6405664945069616
Energy: 0.5381276496982808
Energy: 0.37741139612937374
Energy: 0.5782643128024678
Energy: 0.4104139102209067
Energy: 0.5782643128029276
Energy: 0.3637711599776856
Energy: 0.46385246853292267
Energy: 0.6510738047289235
Energy: 0.4638524685324629
Energy: 0.3560436680952301
Energy: 0.5093659850907816
Energy: 0.5310196513710939
Energy: 0.5093659850907816
Energy: 0.3654186435945101
Energy: 0.5381330181451631
Energy: 0.7207881080635832
Energy: 0.5381330181447034
Energy: 0.35080077177867264
Energy: 0.5996311966868068
Energy: 0.5070475429253541
Energy: 0.5996311966858875
Energy: 0.36383078386557366
Energy: 0.4828570327874961
Energy: 0.6892151076826684
Energy: 0.4828570327865768
Energy: 0.3963509003756352
Energy: 0.5098102504628893
Energy: 0.5310214001616849
Energy: 0.5098102504628893
Energy: 0.36548488924477
Energy: 0.5124748474556906
Energy: 0.6594778841755553
Energy: 0.5124748474556906
Energy: 0.4334223828677357
Energy: 0.619402637779401
Energy: 0.4103444228077172
Energy: 0.6194026377803202
Energy: 0.3644127857824995
Energy: 0.46455417296264706
Energy: 0.582885663199476
Energy: 0.46455417296264706
Energy: 0.4590751240727606
Energy: 0.5199066565579465
Energy: 0.394115753538167
Energy: 0.5199066565574868
Energy: 0.36979191761620966
Energy: 0.520595646878147
Energy: 0.49931823987004287
Energy: 0.5205956468776874
Energy: 0.46380543364247256
Energy: 0.5819732273140585
Energy: 0.3683190939419043
Energy: 0.5819732273145183
Energy: 0.3954030717770734
Energy: 0.46701785193481776
Energy: 0.4316226451876653
Energy: 0.4670178519352774
Energy: 0.6409422715482332
Energy: 0.5106377734846375
Energy: 0.36569865515289585
Energy: 0.5106377734841779
Energy: 0.4116766327506592
Energy: 0.5518029277281492
Energy: 0.3792134720345751
Energy: 0.5518029277281492
Energy: 0.5666173624173696
Energy: 0.5698936946963363
Energy: 0.3641889485385625
Energy: 0.5698936946963363
Energy: 0.5323078171586283
Energy: 0.5275345168391025
Energy: 0.3836015065509812
Energy: 0.527534516839562
Energy: 0.7195772796447382
Energy: 0.5104129468971754
Energy: 0.36554954268284007
Energy: 0.5104129468971754
Energy: 0.5509616365604382
Energy: 0.5728791526488871
Energy: 0.35264423871973355
Energy: 0.5728791526488871
Energy: 0.6664629735529916
Energy: 0.572098399449678
Energy: 0.36419163320536524
Energy: 0.5720983994492184
Energy: 0.5323028999814575
Energy: 0.527668617738991
Energy: 0.3552849702075316
Energy: 0.5276686177385315
Energy: 0.6576468945362959
Energy: 0.5215460881858232
Energy: 0.3656382273492991
Energy: 0.5215460881849037
Energy: 0.4115898818495826
Energy: 0.5977794409076026
Energy: 0.434774717023724
Energy: 0.5977794409076026
Energy: 0.5126825441769776
Energy: 0.560677361229948
Energy: 0.36552936617546006
Energy: 0.560677361229948
Energy: 0.39534144388774584
Energy: 0.5103269338902401
Energy: 0.46209938796307637
Energy: 0.5103269338893206
Energy: 0.49924561271339024
Energy: 0.5290885290425283
Energy: 0.3685333823385464
Energy: 0.5290885290420687
Energy: 0.36974568844222194
Energy: 0.5840871834896196
Energy: 0.46318839831468384
Energy: 0.5840871834896196
Energy: 0.3864199679553933
Energy: 0.5389266165502408
Energy: 0.3974371561288368
Energy: 0.5389266165502408
Energy: 0.36399472598400606
Energy: 0.5101985664224957
Energy: 0.5763555076418697
Energy: 0.5101985664229554
Energy: 0.3834826194795379
Energy: 0.5368979318121099
Energy: 0.4136160485688988
Energy: 0.5368979318116501
Energy: 0.36535591769543413
Energy: 0.5610584554637632
Energy: 0.5673053478772563
Energy: 0.5610584554623842

minimum gb energy = 0.35080077177867264 eV
minimum distance =  2.56241952220442 Angstroms
sigma value = 113


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

Energy: 0.011723073415984159
Energy: 0.012541768561646864
Energy: 0.6395201092160062
Energy: 0.012541768561646864
Energy: 0.6389680410944121
Energy: 0.19350596803240616
Energy: 0.1938224238092711
Energy: 0.19350596803240616
Energy: 0.011723073415984159
Energy: 0.012541768561646864
Energy: 0.6395172859740842
Energy: 0.012541768561646864
Energy: 0.6389680410944121
Energy: 0.19350596803205283
Energy: 0.1939662520747839
Energy: 0.1935059680327399
Energy: 0.011723073415984159
Energy: 0.012541768561646864
Energy: 0.6395176883862967
Energy: 0.012541768562000217
Energy: 0.6389680410944121
Energy: 0.19350596803205283
Energy: 0.19396104671593598
Energy: 0.19350596803205283

minimum gb energy = 0.011723073415984159 eV
minimum distance =  2.85657743979323 Angstroms
sigma value = 1