Model name: model_name=EAM_Dynamo_WuTrinkle_2009_CuAg__MO_270337113239_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.090069212019444
cohesive_energy=2.828476574706077
mass=107.8682
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[8.656544331735659e-20, 1.3844087859067199e-19, 1.82419025017338e-19, 2.1990354954640197e-19, 2.51578581600582e-19, 2.78697023307666e-19, 3.02149684876158e-19, 3.2256622172321998e-19, 3.4048336302124197e-19, 3.5644584882578393e-19, 3.70918310360706e-19, 3.8415389153417996e-19, 3.96192646762056e-19, 4.06986510745314e-19, 4.16508246481176e-19, 4.2478028444251796e-19, 4.3185549645826197e-19, 4.3780277612367e-19, 4.4268781268073595e-19, 4.465730910181859e-19, 4.495114829649419e-19, 4.51554258173292e-19, 4.52746277588988e-19, 4.5313560651105e-19, 4.52723847116112e-19, 4.513860296267219e-19, 4.48966742909382e-19, 4.45235273528796e-19, 4.39755829440516e-19, 4.3188593781430793e-19, 4.20878984338728e-19, 4.0590984804726595e-19, 3.86034846902496e-19, 3.6021737262222e-19, 3.273375037392719e-19, 2.86142338125864e-19, 2.35121023216134e-19, 1.72416636291276e-19, 9.564866330849279e-20, 1.7062540281446398e-21, -1.132189333652538e-19, -2.5343229996612e-19, -4.2380455887241195e-19, -6.3039241841364e-19, -8.81626532037912e-19, -1.189741120522452e-18, -1.5719099152071059e-18, -2.0537981835919197e-18, -2.6769006983208597e-18, -3.5066199117704396e-18, -4.63842952956072e-18, -6.171536328868979e-18, -8.053052459006879e-18, -9.85232886252156e-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: -0.0217427559800002 eV

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

Energy: 0.00852136048477716
Energy: 0.06707392589734718
Energy: 0.44097408688485473
Energy: 0.008897072886759746
Energy: 0.06707392589734718
Energy: 0.526183867449408
Energy: 0.008897072886269772
Energy: 0.5261838674498843
Energy: 0.4409740868805539
Energy: 0.008897072886269772
Energy: 0.00852136048477716
Energy: 0.06707392589734718
Energy: 0.008897072886759746
Energy: 0.526183867449408
Energy: 0.06707392589734718
Energy: 0.5261838674508507

minimum gb energy = 0.00852136048477716 eV
minimum distance =  2.80448968942368 Angstroms
sigma value = 1


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

Energy: 0.8737809647201276
Energy: 0.6106956340190921
Energy: 0.6113353091135157
Energy: 0.5682405717858083
Energy: 0.5785324787477689
Energy: 0.6211843346937865
Energy: 0.5787314268017262
Energy: 0.6211843346937865
Energy: 0.6111462043021826
Energy: 0.6106151990672758
Energy: 0.9476886902120872
Energy: 0.6106151990672758
Energy: 0.5801360738226345
Energy: 0.5778412702888609
Energy: 0.5787575220446852
Energy: 0.5778412702894551
Energy: 0.8130622009581071
Energy: 0.5781043932804302
Energy: 0.5799470100681812
Energy: 0.5781043932792418
Energy: 0.6126170709653576
Energy: 0.6562552877052427
Energy: 0.5785614553158592
Energy: 0.6562552877058369
Energy: 0.6142966365469925
Energy: 0.6289576120377484
Energy: 0.6127827108807907
Energy: 0.6289576120371542
Energy: 0.6156393557694586
Energy: 0.6357285048561058
Energy: 0.6411344260156603
Energy: 0.6357285048561058
Energy: 0.6300324408186874
Energy: 0.658704302205433
Energy: 0.6305149711827328
Energy: 0.658704302205433
Energy: 0.6392561262051228
Energy: 0.6528817590593344
Energy: 0.6311786210679002
Energy: 0.65288175905874
Energy: 0.6290994525477737
Energy: 0.6585179732951743
Energy: 0.6300652794851748
Energy: 0.6585179732951743
Energy: 0.613898155243644
Energy: 0.6574633597124724
Energy: 0.6436908728678101
Energy: 0.6574633597118782
Energy: 0.6221189170042807
Energy: 0.6285913534875385
Energy: 0.5897292495658
Energy: 0.6285913534881327
Energy: 0.6130969421737513
Energy: 0.6289818040183868
Energy: 0.615410482295299
Energy: 0.6289818040183868
Energy: 0.5897896060985028
Energy: 0.5778184035585658
Energy: 0.5779488580033403
Energy: 0.5778184035585658
Energy: 0.5981883817987071
Energy: 0.5788771959647485
Energy: 0.5784466854196237
Energy: 0.5788771959641543
Energy: 0.6109252609087426
Energy: 0.6106481032446753
Energy: 0.5659366888108918
Energy: 0.6106481032452696
Energy: 0.5791289025647243
Energy: 0.5783059435763437
Energy: 0.588933616620837
Energy: 0.5783059435763437
Energy: 0.5781820285826016
Energy: 0.6107180662704148
Energy: 0.6124558195915054
Energy: 0.6107180662704148
Energy: 0.612566562730034
Energy: 0.5786722053214969
Energy: 0.5800288552725552
Energy: 0.5786722053226855
Energy: 0.5793383971097432
Energy: 0.5799692257919349
Energy: 0.6124313461352859
Energy: 0.5799692257919349
Energy: 0.578592856345841
Energy: 0.5780836216714207
Energy: 0.6132159494029467
Energy: 0.5780836216714207
Energy: 0.6124631698803064
Energy: 0.6290488036011028
Energy: 0.6126249592876251
Energy: 0.6290488036028855
Energy: 0.6416455045847155
Energy: 0.6307910183498644
Energy: 0.6136848107037653
Energy: 0.6307910183498644
Energy: 0.6312327498383746
Energy: 0.6587165673190153
Energy: 0.629977976537451
Energy: 0.6587165673196094
Energy: 0.6319733894972365
Energy: 0.6568661446838874
Energy: 0.6402410261818917
Energy: 0.6568661446844816
Energy: 0.7033723686692852
Energy: 0.6580706492167147
Energy: 0.6294841040567574
Energy: 0.6580706492161205
Energy: 0.641901995083725
Energy: 0.6570083568239982
Energy: 0.6349949826987973
Energy: 0.6570083568245924
Energy: 0.5895419088007176
Energy: 0.6285125652981758
Energy: 0.6224459107349554
Energy: 0.6285125652975815
Energy: 0.6153292287725115
Energy: 0.6287499484109267
Energy: 0.6138326184036629
Energy: 0.628749948411521
Energy: 0.5775349806324099
Energy: 0.577666685045602
Energy: 0.5893987303664835
Energy: 0.5776666850551097
Energy: 0.5783008872804081
Energy: 0.5785267541720966
Energy: 0.5660490172948704
Energy: 0.5785267541732851
Energy: 0.5657381703231733
Energy: 0.5799970992080965
Energy: 0.6115027729943866
Energy: 0.5799970992086908

minimum gb energy = 0.5657381703231733 eV
minimum distance =  2.62464265460153 Angstroms
sigma value = 1


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

Energy: 0.993710372381962
Energy: 0.6435036235811846
Energy: 0.642567454418162
Energy: 0.5958065473921507
Energy: 0.6085309585296081
Energy: 0.6523896883780738
Energy: 0.6081158187079715
Energy: 0.6523896883787512
Energy: 0.6431952825033989
Energy: 0.643525848330011
Energy: 0.9149200509633779
Energy: 0.6435258483306886
Energy: 0.6110393280373878
Energy: 0.6085323363610903
Energy: 0.6081071131041483
Energy: 0.6085323363597352
Energy: 0.6090521379668452
Energy: 0.6086001434497906
Energy: 0.6088905716984111
Energy: 0.6086001434511457
Energy: 0.6125653114741137
Energy: 0.6785513392716579
Energy: 0.6084396125796402
Energy: 0.6785513392689477
Energy: 0.6515269522823597
Energy: 0.6684162739398375
Energy: 0.6492387242153083
Energy: 0.6684162739378049
Energy: 0.6513209955391143
Energy: 0.6709725532959872
Energy: 0.6781470033605509
Energy: 0.6709725532959872
Energy: 0.6496297995541125
Energy: 0.6991849181941678
Energy: 0.6642754092748228
Energy: 0.6991849181948453
Energy: 0.6786191094595451
Energy: 0.7005316403803766
Energy: 0.6508706640449068
Energy: 0.7005316403790215
Energy: 0.6242932101952147
Energy: 0.6681792789465959
Energy: 0.6662929957191309
Energy: 0.6681792789486284
Energy: 0.6516606590127109
Energy: 0.6684982173193803
Energy: 0.6583553649015023
Energy: 0.6684982173193803
Energy: 0.6089648374637584
Energy: 0.6085608710706853
Energy: 0.6237497341919146
Energy: 0.6085608710720405
Energy: 0.6086139733694054
Energy: 0.6084920824874422
Energy: 0.5925954356717561
Energy: 0.6084920824860871
Energy: 0.5919393690494625
Energy: 0.6433753742861718
Energy: 0.6433896886636182
Energy: 0.6433753742875268
Energy: 0.6244166211962978
Energy: 0.6089175840201497
Energy: 0.608066889522234
Energy: 0.6089175840221823
Energy: 0.6434894793850577
Energy: 0.6436708706961533
Energy: 0.6091535785436957
Energy: 0.6436708706975084
Energy: 0.6109092907747831
Energy: 0.6085151368197682
Energy: 0.6108960403184184
Energy: 0.6085151368184131
Energy: 0.6088811728808803
Energy: 0.6112624069777767
Energy: 0.6108271871867772
Energy: 0.6112624069737114
Energy: 0.6123806414469705
Energy: 0.6089714333292375
Energy: 0.6090611476138452
Energy: 0.6089714333285601
Energy: 0.6498017645565708
Energy: 0.6691061763295346
Energy: 0.6492075053356954
Energy: 0.6691061763288569
Energy: 0.6496812510449081
Energy: 0.6695268349760518
Energy: 0.6378306754047003
Energy: 0.6695268349767294
Energy: 0.6498422132294911
Energy: 0.6989994337453292
Energy: 0.6645403490699928
Energy: 0.6989994337419416
Energy: 0.6785198367397794
Energy: 0.6983328818309935
Energy: 0.6718880811487872
Energy: 0.6983328818309935
Energy: 0.6241204622052936
Energy: 0.6677095174351242
Energy: 0.6671029776676062
Energy: 0.6677095174371568
Energy: 0.6518805100433768
Energy: 0.6684088793609869
Energy: 0.6576615003730207
Energy: 0.6684088793589543
Energy: 0.6084178179458354
Energy: 0.6087382424889818
Energy: 0.624051712223061
Energy: 0.6087382424903368
Energy: 0.6089822635487704
Energy: 0.6088161694099347
Energy: 0.5925399457822281
Energy: 0.6088161694119674
Energy: 0.5923440683090557
Energy: 0.6105780784120192
Energy: 0.6427250130335729
Energy: 0.6105780784120192

minimum gb energy = 0.5919393690494625 eV
minimum distance =  2.62556923705426 Angstroms
sigma value = 25


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

Energy: 0.9534512404256804
Energy: 0.6786874677144048
Energy: 0.6787976796771198
Energy: 0.6241883141253959
Energy: 0.6445828282409474
Energy: 0.6859098508583488
Energy: 0.6441128730483093
Energy: 0.6859098508583488
Energy: 0.6785806813242292
Energy: 0.6787070832903422
Energy: 0.6422798655954786
Energy: 0.6787070832895548
Energy: 0.6472309825786419
Energy: 0.6861977092726598
Energy: 0.643985261378984
Energy: 0.686197709274235
Energy: 0.6425020117090209
Energy: 0.643919220509491
Energy: 0.6447860476558269
Energy: 0.643919220509491
Energy: 0.6492940049792142
Energy: 0.6446642150157559
Energy: 0.6434283006923848
Energy: 0.6446642150157559
Energy: 0.6854667951902171
Energy: 0.7176535729479447
Energy: 0.6817712414118172
Energy: 0.7176535729479447
Energy: 0.6829322558736723
Energy: 0.7193989682989332
Energy: 0.6306369749226126
Energy: 0.7193989682997208
Energy: 0.6832085530725315
Energy: 0.7168586728238657
Energy: 0.667779899417163
Energy: 0.7168586728246534
Energy: 0.6486427983824946
Energy: 0.7173668850524628
Energy: 0.6438347315684324
Energy: 0.7173668850516753
Energy: 0.6200079732116264
Energy: 0.6440509281433017
Energy: 0.6443728801088081
Energy: 0.644050928142514
Energy: 0.6199158623805023
Energy: 0.6436702215068081
Energy: 0.6435465857390413
Energy: 0.6436702215075958
Energy: 0.6780606774100844
Energy: 0.678461770613899
Energy: 0.6196742995360143
Energy: 0.678461770613899
Energy: 0.6439830198134232
Energy: 0.6469101075966132
Energy: 0.6679990139272051
Energy: 0.6469101075966132
Energy: 0.6425891598718237
Energy: 0.6792222067746277
Energy: 0.6799895189886458
Energy: 0.6792222067746277
Energy: 0.6458056919083893
Energy: 0.6435651886980402
Energy: 0.6470685824949459
Energy: 0.6435651886980402
Energy: 0.6436526416212023
Energy: 0.6477192867407285
Energy: 0.6428971823901464
Energy: 0.647719286739941
Energy: 0.6433547060356686
Energy: 0.6437377978523603
Energy: 0.648232597791081
Energy: 0.6437377978515726
Energy: 0.6816986445077718
Energy: 0.7185297068866128
Energy: 0.6856833882899065
Energy: 0.7185297068866128
Energy: 0.6304259344168184
Energy: 0.7184283179903516
Energy: 0.6841051445367945
Energy: 0.7184283179911392
Energy: 0.6668106938424814
Energy: 0.7166330316835258
Energy: 0.6828375430606952
Energy: 0.7166330316835258
Energy: 0.6667493473114684
Energy: 0.7169271752757649
Energy: 0.702101185529018
Energy: 0.7169271752749774
Energy: 0.6425411664787543
Energy: 0.6440277542719219
Energy: 0.6195016534932879
Energy: 0.6440277542719219
Energy: 0.643346228982547
Energy: 0.6436738066998241
Energy: 0.6199237144832399
Energy: 0.6436738066998241
Energy: 0.6195012107361978
Energy: 0.6464597132400612
Energy: 0.6790071015153472
Energy: 0.6464597132392736

minimum gb energy = 0.6195012107361978 eV
minimum distance =  2.62751307352093 Angstroms
sigma value = 9


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

Energy: 0.8902633355542762
Energy: 0.7166192317307187
Energy: 0.7172175470376174
Energy: 0.6531340422484381
Energy: 0.686722354463535
Energy: 0.7194273338522297
Energy: 0.6888464489127525
Energy: 0.7194273338522297
Energy: 0.716859414911209
Energy: 0.7168062782613492
Energy: 0.6852271124452906
Energy: 0.7168062782594701
Energy: 0.6866807684970406
Energy: 0.7203169772129278
Energy: 0.6871963078807986
Energy: 0.7203169772119882
Energy: 0.6843646169939208
Energy: 0.6863246472278188
Energy: 0.6873926167019677
Energy: 0.6863246472268794
Energy: 0.6878791154065741
Energy: 0.6894313548405264
Energy: 0.6865597361389155
Energy: 0.6894313548405264
Energy: 0.7220192700539187
Energy: 0.7682729507186313
Energy: 0.6878448110660731
Energy: 0.7682729507195709
Energy: 0.6870458637473134
Energy: 0.7703423394409356
Energy: 0.6943025725654539
Energy: 0.7703423394409356
Energy: 0.6851001803451486
Energy: 0.6859442932613135
Energy: 0.6459787381713448
Energy: 0.685944293262253
Energy: 0.6861027471776663
Energy: 0.6858529202112537
Energy: 0.6460791978690279
Energy: 0.6858529202121932
Energy: 0.6457908715240958
Energy: 0.716460266269757
Energy: 0.7162093217538192
Energy: 0.7164602662688173
Energy: 0.7234463525722791
Energy: 0.6884548250084982
Energy: 0.6859321376220546
Energy: 0.6884548250075586
Energy: 0.7168291495127698
Energy: 0.7172185992234756
Energy: 0.6853669442633249
Energy: 0.7172185992244152
Energy: 0.6862476961229681
Energy: 0.6858351959707324
Energy: 0.7155838291625849
Energy: 0.6858351959697929
Energy: 0.6857646496066745
Energy: 0.6884521057615954
Energy: 0.6907310113208315
Energy: 0.6884521057606557
Energy: 0.6883315097403053
Energy: 0.6863634305352605
Energy: 0.6896711341251128
Energy: 0.6863634305362001
Energy: 0.7227320318642627
Energy: 0.7692382392456202
Energy: 0.6877815442604132
Energy: 0.7692382392428014
Energy: 0.7225090192768152
Energy: 0.7688620895062573
Energy: 0.6867459595865545
Energy: 0.7688620895053178
Energy: 0.6843308138922546
Energy: 0.6858670699194914
Energy: 0.6459590173054629
Energy: 0.685867069920431
Energy: 0.6863175462241077
Energy: 0.6865272992526148
Energy: 0.6458269835810662
Energy: 0.6865272992535543
Energy: 0.6454009217996177
Energy: 0.6869455045533172
Energy: 0.7175768287215357
Energy: 0.6869455045533172

minimum gb energy = 0.6454009217996177 eV
minimum distance =  2.64278802423209 Angstroms
sigma value = 25


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

Energy: 0.7947608759062033
Energy: 0.7577383810411927
Energy: 0.7584551165616338
Energy: 0.6809572003095868
Energy: 0.7580591738122398
Energy: 0.7271266953119537
Energy: 0.693246623279237
Energy: 0.7271266953119537
Energy: 0.7575305993302957
Energy: 0.7579761887472213
Energy: 0.6745272391784101
Energy: 0.7579761887472213
Energy: 0.6761058028066659
Energy: 0.7271298875427201
Energy: 0.6935268342600934
Energy: 0.7271298875427201
Energy: 0.7321623880053844
Energy: 0.7736367193924862
Energy: 0.6936387633293317
Energy: 0.7736367193936483
Energy: 0.6756023357900451
Energy: 0.6937369775735843
Energy: 0.6917095073252296
Energy: 0.6937369775735843
Energy: 0.6726709325103303
Energy: 0.6926554141643794
Energy: 0.694155919387026
Energy: 0.6926554142201267
Energy: 0.6727696275522217
Energy: 0.7279849898062595
Energy: 0.6952161926585293
Energy: 0.7279849898062595
Energy: 0.7568776082407891
Energy: 0.7573829065898584
Energy: 0.8330936313740805
Energy: 0.7573829065898584
Energy: 0.6942545381469172
Energy: 0.7737617185394942
Energy: 0.6723370364629975
Energy: 0.7737617185406561
Energy: 0.6736084898367047
Energy: 0.7583549422675258
Energy: 0.7596382752954974
Energy: 0.7583549422652018
Energy: 0.756083648441154
Energy: 0.7286485025724124
Energy: 0.7583161234406539
Energy: 0.7286485025724124
Energy: 0.6924051961961828
Energy: 0.7760149819750817
Energy: 0.7320872180247637
Energy: 0.7760149819750817
Energy: 0.6937453951625452
Energy: 0.694155809772938
Energy: 0.6771810528935096
Energy: 0.6941558097741
Energy: 0.734556367076382
Energy: 0.738968910617268
Energy: 0.6727522381564709
Energy: 0.738968910617268
Energy: 0.6925359141540339
Energy: 0.7716798881082325
Energy: 0.6728212625087527
Energy: 0.7716798881082325
Energy: 0.8326372191013773
Energy: 0.6769191969059214
Energy: 0.7586122109948884
Energy: 0.6769191969059214

minimum gb energy = 0.6723370364629975 eV
minimum distance =  2.69758213475966 Angstroms
sigma value = 17


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

Energy: 1.106562221363629
Energy: 0.8306455917418384
Energy: 0.8292793640020082
Energy: 0.7823840557443204
Energy: 0.7239506111338645
Energy: 0.745805518851624
Energy: 0.7401884701857547
Energy: 0.745805518851624
Energy: 0.7365301310517112
Energy: 0.7357329113505006
Energy: 0.7848643977640739
Energy: 0.7357329113498424
Energy: 0.7358025086318695
Energy: 0.7846340571057511
Energy: 0.7406569908009114
Energy: 0.784634057105093
Energy: 0.7354667283627888
Energy: 0.7914792114847912
Energy: 0.6893065782853741
Energy: 0.7914792114847912
Energy: 0.7423127528744488
Energy: 0.7689807239434919
Energy: 0.7361264277665861
Energy: 0.7689807239441501
Energy: 0.7772676633261456
Energy: 0.7347519609867343
Energy: 0.7347048353789674
Energy: 0.7347519609860763
Energy: 0.7929515317863156
Energy: 0.7414237477407782
Energy: 0.7048259772732048
Energy: 0.7414237477407782
Energy: 0.8330107236721356
Energy: 0.8303215917781906
Energy: 0.7839223232393783
Energy: 0.8303215917775325
Energy: 0.83365737511058
Energy: 0.785310023135667
Energy: 0.7407405725225461
Energy: 0.785310023135009
Energy: 0.7338452575047092
Energy: 0.7056194279473708
Energy: 0.7018144142286009
Energy: 0.7056194279473708
Energy: 0.7863927014848424
Energy: 0.703860402598637
Energy: 0.7052526625090432
Energy: 0.7038604026111405
Energy: 0.780493019314809
Energy: 0.7251558078338657
Energy: 0.7240845935323952
Energy: 0.7251558078338657
Energy: 0.7779988771379638
Energy: 0.7437057282965205
Energy: 0.702269501545012
Energy: 0.7437057282971786
Energy: 0.8320498060620576
Energy: 0.7938479688121263
Energy: 0.7924094679368117
Energy: 0.7938479688127843
Energy: 0.8315518629324734
Energy: 0.7881156062159093
Energy: 0.7918270553399734
Energy: 0.7881156062159093
Energy: 0.7859370354711572
Energy: 0.7350491855998259
Energy: 0.7356077276290414
Energy: 0.7350491855991678
Energy: 0.7872856416319634
Energy: 0.7411971842742878
Energy: 0.7342234687573278
Energy: 0.741197184274946
Energy: 0.7418445800379111
Energy: 0.7678932012848996
Energy: 0.7348945069868654
Energy: 0.7678932012829254
Energy: 0.7577656365510032
Energy: 0.7680197722767238
Energy: 0.7358825722705843
Energy: 0.7680197722767238
Energy: 0.7350136868757283
Energy: 0.7422786373253405
Energy: 0.7917580470586897
Energy: 0.7422786373266566
Energy: 0.7353676703209113
Energy: 0.7354223807280876
Energy: 0.7762654969652544
Energy: 0.7354223807287458
Energy: 0.7399409832118994
Energy: 0.7851230565317634
Energy: 0.7909579236929128
Energy: 0.7851230565323917
Energy: 0.7841201104978912
Energy: 0.830089654337077
Energy: 0.8303174658115944
Energy: 0.8300896543377351
Energy: 0.7065692732367174
Energy: 0.7424274577867198
Energy: 0.7864574985025437
Energy: 0.7424274577867198
Energy: 0.7049272295973167
Energy: 0.7232063854429149
Energy: 0.7335623267048683
Energy: 0.7232063854429149
Energy: 0.7015933091624296
Energy: 0.7035618213540124
Energy: 0.7931435731313463
Energy: 0.7035618213540124
Energy: 0.7082460540280163
Energy: 0.7036027515922658
Energy: 0.7776906598714514
Energy: 0.7036027515909496
Energy: 0.703963098929437
Energy: 0.7436452003603896
Energy: 0.7784526132482156
Energy: 0.7436452003610475
Energy: 0.7904160870774464
Energy: 0.8303354074686772
Energy: 0.828495587927361
Energy: 0.8303354074686772

minimum gb energy = 0.6893065782853741 eV
minimum distance =  2.64484448542698 Angstroms
sigma value = 53


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

Energy: 1.0083699932618504
Energy: 0.7760882070344414
Energy: 0.777198412067845
Energy: 0.6660381569363304
Energy: 0.7788736531184539
Energy: 0.7027481179453076
Energy: 0.7735410715956402
Energy: 0.7027481179459101
Energy: 0.7757200551215239
Energy: 0.775792576582013
Energy: 0.7887224794876506
Energy: 0.7757925765841305
Energy: 0.7772932906393936
Energy: 0.7034143404361999
Energy: 0.7787640129314957
Energy: 0.7034143404371123
Energy: 0.7949444908942486
Energy: 0.7027838141850586
Energy: 0.6578052988304997
Energy: 0.7027838141861088
Energy: 0.7979248396333684
Energy: 0.7054045002164552
Energy: 0.6666246273965853
Energy: 0.7054045002160076
Energy: 0.8837978294485559
Energy: 0.7746883816687034
Energy: 0.772983092330806
Energy: 0.7746883816682558
Energy: 0.8801549888095436
Energy: 0.7055131173761747
Energy: 0.7754412370288568
Energy: 0.7055131173749524
Energy: 0.7758538524229839
Energy: 0.7754863692364697
Energy: 0.7886994144296932
Energy: 0.7754863692347997
Energy: 0.7778051684439501
Energy: 0.7048667966889037
Energy: 0.776922742724828
Energy: 0.7048667966890586
Energy: 0.7948920687253066
Energy: 0.7069939287360146
Energy: 0.6685770915026982
Energy: 0.7069939287349473
Energy: 0.7771227299911354
Energy: 0.7027507937728497
Energy: 0.6571081646868969
Energy: 0.7027507937746573
Energy: 0.8806866281206615
Energy: 0.7058412021472412
Energy: 0.775114133723393
Energy: 0.7058412021481536

minimum gb energy = 0.6571081646868969 eV
minimum distance =  2.68669189884352 Angstroms
sigma value = 9


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

Energy: 0.9806565838988452
Energy: 0.8674947955296016
Energy: 0.8671733849470749
Energy: 0.8089936402652395
Energy: 0.7193302490330453
Energy: 0.7181345914343186
Energy: 0.8719935454422718
Energy: 0.7181345914337577
Energy: 0.7224128923183668
Energy: 0.7209710490263054
Energy: 0.8645858376449037
Energy: 0.7209710490279875
Energy: 0.7210087754878436
Energy: 0.720615787048086
Energy: 0.9292182547352269
Energy: 0.7206157870475254
Energy: 0.7185955112266839
Energy: 0.7183583904511288
Energy: 0.9232496274137296
Energy: 0.7183583904516897
Energy: 0.7181104230419683
Energy: 0.7182347522798337
Energy: 0.9232900382414516
Energy: 0.7182347522798337
Energy: 0.8679605238891883
Energy: 0.862744841931642
Energy: 0.8703070127381177
Energy: 0.8627448419310813
Energy: 0.8676501167715152
Energy: 0.7973454868015212
Energy: 0.863340341891969
Energy: 0.7973454868003996
Energy: 0.7605231610236846
Energy: 0.8085158552523851
Energy: 0.77709427527691
Energy: 0.8085158552529459
Energy: 0.719638455146223
Energy: 0.7736566421974149
Energy: 0.8664089670705648
Energy: 0.7736566421979757
Energy: 0.7594529390643006
Energy: 0.7595004066860721
Energy: 0.8188887028495333
Energy: 0.7595004066866329
Energy: 0.7694217328011744
Energy: 0.7649824967365711
Energy: 0.9250944683238305
Energy: 0.7649824967360105
Energy: 0.8686413678861199
Energy: 0.7594276711553842
Energy: 0.7702224096637984
Energy: 0.7594276711553842
Energy: 0.8698734514121153
Energy: 0.7601667045883972
Energy: 0.7623987180931582
Energy: 0.7601667045878363
Energy: 0.8627980063733341
Energy: 0.7518761195556419
Energy: 0.764763501703345
Energy: 0.7518761195550813
Energy: 0.8039000817228132
Energy: 0.8134033179417993
Energy: 0.765451617539379
Energy: 0.81340331794236
Energy: 0.8664918365433183
Energy: 0.719901581845275
Energy: 0.7614650545811307
Energy: 0.719901581845275
Energy: 0.8658525521401378
Energy: 0.8657916257317201
Energy: 0.9779093571712193
Energy: 0.8657916257317201
Energy: 0.8716698386284712
Energy: 0.7183309510256846
Energy: 0.7642782950710267
Energy: 0.7183309510262451
Energy: 0.9109283959720262
Energy: 0.721812469624876
Energy: 0.7222324872717278
Energy: 0.721812469624876
Energy: 0.8732414341276649
Energy: 0.7197585917756437
Energy: 0.7200210540525698
Energy: 0.7197585917745224
Energy: 0.9233760360989256
Energy: 0.7179929622882038
Energy: 0.7177183866099711
Energy: 0.717992962287643
Energy: 0.9231807205866841
Energy: 0.7185479459394049
Energy: 0.7179248964511007
Energy: 0.7185479459388442
Energy: 0.8716788568740927
Energy: 0.8632298228475856
Energy: 0.867853890317055
Energy: 0.8632298228481465
Energy: 0.8637735726427528
Energy: 0.8852428824696245
Energy: 0.8677549838128688
Energy: 0.8852428824696245
Energy: 0.7668208743450324
Energy: 0.8057142664110712
Energy: 0.7593750895726809
Energy: 0.8057142664099497
Energy: 0.8680531224045854
Energy: 0.771557389549577
Energy: 0.719444645610906
Energy: 0.7715573895501376
Energy: 0.818715468209755
Energy: 0.7609987293641094
Energy: 0.7595272666209676
Energy: 0.7609987293652307
Energy: 0.9257817517401998
Energy: 0.7660954299781421
Energy: 0.7682539999967788
Energy: 0.7660954299787028
Energy: 0.7711266141833871
Energy: 0.7544047787075343
Energy: 0.8740722109002503
Energy: 0.7544047787075343
Energy: 0.7642814133212705
Energy: 0.7611141448557966
Energy: 0.8635601108204123
Energy: 0.7611141448557966
Energy: 0.7638970817141258
Energy: 0.750864353020327
Energy: 0.8691643406546701
Energy: 0.7508643530197662
Energy: 0.7667288826425476
Energy: 0.8124411634820371
Energy: 0.8035235944098534
Energy: 0.8124411634820371
Energy: 0.7604773965942261
Energy: 0.7197532498576215
Energy: 0.80402027843591
Energy: 0.7197532498581822
Energy: 0.9253734352230243
Energy: 0.8644914907443605
Energy: 0.8693266261091098
Energy: 0.864491490743239

minimum gb energy = 0.7177183866099711 eV
minimum distance =  2.63989787647605 Angstroms
sigma value = 73


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

Energy: 1.035636872620174
Energy: 0.8332024875024892
Energy: 0.8331735018997711
Energy: 0.7690541987669965
Energy: 0.7371501999057138
Energy: 0.7337776451987227
Energy: 0.8256425643954632
Energy: 0.7337776451996123
Energy: 0.7341504757959489
Energy: 0.7346124730973943
Energy: 0.8515795884170213
Energy: 0.7346124730973943
Energy: 0.7324657232159933
Energy: 0.7341320809145413
Energy: 0.9116846144901302
Energy: 0.7341320809136516
Energy: 0.734350803581433
Energy: 0.7352783490729938
Energy: 0.8698202806083348
Energy: 0.7352783490738835
Energy: 0.7345094815942278
Energy: 0.7359605632791213
Energy: 0.8699218602755203
Energy: 0.7359605632800109
Energy: 0.8214172264601408
Energy: 0.8511472733510504
Energy: 0.861128718826464
Energy: 0.8511472733492914
Energy: 0.7657272884646676
Energy: 0.8127202915907881
Energy: 0.8509414932266689
Energy: 0.8127202915907881
Energy: 0.7720663807790984
Energy: 0.8180616439905735
Energy: 0.852734239247428
Energy: 0.8180616439905735
Energy: 0.7778572836677479
Energy: 0.7554151234314833
Energy: 0.8501102542736686
Energy: 0.7554151234323729
Energy: 0.7598644922885693
Energy: 0.7173602100813
Energy: 0.7283847073052739
Energy: 0.7173602100804103
Energy: 0.7583063854385534
Energy: 0.7189887615318299
Energy: 0.8974707591872143
Energy: 0.7189887615327195
Energy: 0.853109727641629
Energy: 0.7689739582441226
Energy: 0.7656196846104479
Energy: 0.7689739582441226
Energy: 0.8506925065879085
Energy: 0.7662246626577308
Energy: 0.76277617268048
Energy: 0.7662246626568412
Energy: 0.8610064235419146
Energy: 0.8096359254500433
Energy: 0.762014618813019
Energy: 0.8096359254491535
Energy: 0.9084077798886783
Energy: 0.7633733849696243
Energy: 0.762638732599456
Energy: 0.7633733849696243
Energy: 0.9095977574443388
Energy: 0.7851246151274991
Energy: 0.7640566407224921
Energy: 0.7851246151283887
Energy: 0.8350209872491549
Energy: 0.8334215177180176
Energy: 0.7654854931455228
Energy: 0.8334215177180176
Energy: 0.8215601623488187
Energy: 0.7854803418763595
Energy: 0.8207481295490169
Energy: 0.7854803418763595
Energy: 0.8222493963021844
Energy: 0.7829546275474962
Energy: 0.8209162114426084
Energy: 0.7829546275483859
Energy: 0.8219875097902288
Energy: 0.8022997006864314
Energy: 0.7618156519555366
Energy: 0.8022997006855417
Energy: 0.8692394750958236
Energy: 0.8191471815426943
Energy: 0.8186499103932914
Energy: 0.8191471815435839

minimum gb energy = 0.7173602100804103 eV
minimum distance =  2.60183952578088 Angstroms
sigma value = 7


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

Energy: 1.185128451946053
Energy: 0.8349138525470491
Energy: 0.8347297923400229
Energy: 0.7429113273082321
Energy: 0.7345984773355516
Energy: 0.7396871135270443
Energy: 0.8144327850599766
Energy: 0.7396871135308187
Energy: 0.7320761852398638
Energy: 0.7339610908030382
Energy: 0.8121987075829086
Energy: 0.733961090802409
Energy: 0.7330914934023588
Energy: 0.7342833122196246
Energy: 0.8953556978717617
Energy: 0.7342833122183664
Energy: 0.7329237519572741
Energy: 0.7333741655206235
Energy: 0.87501711098807
Energy: 0.7333741655206235
Energy: 0.7378749245540305
Energy: 0.7352963004223356
Energy: 0.873960910094929
Energy: 0.7352963004217066
Energy: 0.8082442240477243
Energy: 0.7329822882650359
Energy: 0.735782119595195
Energy: 0.7329822882688102
Energy: 0.8104867348688914
Energy: 0.7360713377858157
Energy: 0.7349495187226586
Energy: 0.7360713377851866
Energy: 0.8961868199433806
Energy: 0.7361284139658543
Energy: 0.7363200152320352
Energy: 0.7361284139601925
Energy: 0.8759491038371079
Energy: 0.7334909835344298
Energy: 0.731951705744694
Energy: 0.7334909835344298
Energy: 0.8172334016614947
Energy: 0.8100374910083945
Energy: 0.7358939671898977
Energy: 0.8100374910065073
Energy: 0.8134544904916599
Energy: 0.8127157628359934
Energy: 0.8076173458001974
Energy: 0.8127157628347352
Energy: 0.808457121197203
Energy: 0.7775585650669122
Energy: 0.8117972027250859
Energy: 0.7775585650631379
Energy: 0.8106323506037331
Energy: 0.7767522220006745
Energy: 0.7409223468877224
Energy: 0.7767522219981582
Energy: 0.8114953202094516
Energy: 0.777352321802465
Energy: 0.7394976680747398
Energy: 0.7773523218043522
Energy: 0.745476257661893
Energy: 0.8121249428312483
Energy: 0.8133168055519553
Energy: 0.8121249428325065
Energy: 0.7446648033466026
Energy: 0.8105841444543166
Energy: 0.8169084737575126
Energy: 0.8105841444562039
Energy: 0.7327696659915944
Energy: 0.733416656697209
Energy: 0.818260787834275
Energy: 0.733416656697838
Energy: 0.7359771095909304
Energy: 0.7365354533062222
Energy: 0.8166532029193325
Energy: 0.7365354533043351
Energy: 0.734818338760065
Energy: 0.7359682788974459
Energy: 0.7462640813838151
Energy: 0.7359682788930425
Energy: 0.7356230478688284
Energy: 0.7330702000061744
Energy: 0.8769318194999923
Energy: 0.7330701999979965
Energy: 0.8105829770849129
Energy: 0.7347122122384263
Energy: 0.7378362254937111
Energy: 0.7347122122377973
Energy: 0.8099498648315614
Energy: 0.7333944299652422
Energy: 0.7324389186468702
Energy: 0.7333944299690165
Energy: 0.8948272447843706
Energy: 0.7342084214641911
Energy: 0.7329603591848942
Energy: 0.734208421463562
Energy: 0.8749738322585467
Energy: 0.7340738172516437
Energy: 0.7321401902037035
Energy: 0.7340738172491273
Energy: 0.8735904372751293
Energy: 0.7385498030959922
Energy: 0.7342841099485676
Energy: 0.7385498030947341
Energy: 0.8346634551304655
Energy: 0.8346834123630845
Energy: 1.0382997573088288
Energy: 0.8346834123637136
Energy: 0.8080041474012479
Energy: 0.7791257970228618
Energy: 0.8133491397007641
Energy: 0.779125797024749
Energy: 0.813684611063915
Energy: 0.7775584819427113
Energy: 0.8086661484688923
Energy: 0.7775584819439696
Energy: 0.8114228536591083
Energy: 0.77861077771271
Energy: 0.7409465863989845
Energy: 0.77861077771271
Energy: 0.7449602256952855
Energy: 0.8108573200773636
Energy: 0.8106116685592277
Energy: 0.8108573200773636

minimum gb energy = 0.731951705744694 eV
minimum distance =  2.61720760174767 Angstroms
sigma value = 29


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

Energy: 0.6963548901565239
Energy: 0.8146503172299964
Energy: 0.7093421488157576
Energy: 0.697892196477514
Energy: 0.707220825944223
Energy: 0.7501340814310711
Energy: 0.7060368690639619
Energy: 0.7501340814299998
Energy: 0.7027922390601589
Energy: 0.7427341314716484
Energy: 0.6930324880379923
Energy: 0.7427341314714292
Energy: 0.6960350119713502
Energy: 0.7045234926163098
Energy: 0.7032749051952852
Energy: 0.7045234926158959
Energy: 0.70246422931662
Energy: 0.7084139545642811
Energy: 0.6945356825333626
Energy: 0.7084139545647192
Energy: 0.702772237815763
Energy: 0.744944347086709
Energy: 0.6953530042826762
Energy: 0.7449443470873663
Energy: 0.6925562416846157
Energy: 0.7426882800813125
Energy: 0.7031151762136691
Energy: 0.7426882800875453
Energy: 0.7061060108880989
Energy: 0.7088774229811968
Energy: 0.6977923540173699
Energy: 0.7088774229829011
Energy: 0.6957967886864715
Energy: 0.7075581857505466
Energy: 0.7075601931620532
Energy: 0.707558185755489

minimum gb energy = 0.6925562416846157 eV
minimum distance =  2.65805250977265 Angstroms
sigma value = 5


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

Energy: 0.9423543326850907
Energy: 0.6888872352921046
Energy: 0.7913166751320535
Energy: 0.6704719942816246
Energy: 0.7845638071082978
Energy: 0.6878094671913493
Energy: 0.8044182705081816
Energy: 0.6878094671913493
Energy: 0.8042008621947111
Energy: 0.7405108091665082
Energy: 0.8063582819340851
Energy: 0.740510809165914
Energy: 0.7047912722935057
Energy: 0.7420896533163459
Energy: 0.8002766158075169
Energy: 0.7420896533145632
Energy: 0.7991136547897439
Energy: 0.6863494452655893
Energy: 0.8075660354413138
Energy: 0.6863494452661835
Energy: 0.6861940533914752
Energy: 0.6986266195336543
Energy: 0.8071153985809075
Energy: 0.6986266195354371
Energy: 0.6862122700271608
Energy: 0.6866635870769594
Energy: 0.8006171351607899
Energy: 0.6866635870769594
Energy: 0.6909451031079525
Energy: 0.6881896073994833
Energy: 0.8942981145307682
Energy: 0.6881896074000777
Energy: 0.7086750936361238
Energy: 0.7053946882824758
Energy: 0.8956656608042409
Energy: 0.7053946882818816
Energy: 0.8218923549185441
Energy: 0.6687984603978181
Energy: 0.6755042160919351
Energy: 0.6687984603972239
Energy: 0.7084907235688295
Energy: 0.6676631238112162
Energy: 0.6669941901390682
Energy: 0.6676631238118103
Energy: 0.9056849266075394
Energy: 0.6673180300996583
Energy: 0.6667843809654168
Energy: 0.667318030099064
Energy: 0.9098791701105539
Energy: 0.6670612265133734
Energy: 0.6665764508855823
Energy: 0.6670612265139678
Energy: 0.6871081799653201
Energy: 0.7005068592882494
Energy: 0.8072278268402799
Energy: 0.7005068592882494
Energy: 0.6873772067458873
Energy: 0.6863715915069071
Energy: 0.8088925024676453
Energy: 0.6863715915057186
Energy: 0.687656515173576
Energy: 0.6876489422324819
Energy: 0.7841107466739989
Energy: 0.6876489422324819
Energy: 0.6883607824030424
Energy: 0.6869216411294121
Energy: 0.7043342431856441
Energy: 0.6869216411282236
Energy: 0.8134781856087727
Energy: 0.6879549130930309
Energy: 0.7059841267931212
Energy: 0.6879549130948137
Energy: 0.8112643707324267
Energy: 0.7415222713511261
Energy: 0.8049991637593648
Energy: 0.7415222713517204
Energy: 0.8116864551680455
Energy: 0.7437937669181051
Energy: 0.7041930693725911
Energy: 0.7437937669186994
Energy: 0.8021023724301829
Energy: 0.6905234065883249
Energy: 0.7834410317315099
Energy: 0.6905234065889191
Energy: 0.8074658566684866
Energy: 0.6866054504597856
Energy: 0.6863363756313319
Energy: 0.686605450460974
Energy: 0.8001726007361526
Energy: 0.6863373909870206
Energy: 0.68640639584198
Energy: 0.6863373909876149
Energy: 0.8944961579524834
Energy: 0.687348994881782
Energy: 0.6888131327249817
Energy: 0.6873489948823762
Energy: 0.8967773980171996
Energy: 0.7019861022014731
Energy: 0.7089039941452281
Energy: 0.7019861022014731
Energy: 0.6695795468192272
Energy: 0.6706278514736601
Energy: 0.8222132703927036
Energy: 0.6706278514742544
Energy: 0.6684777726172556
Energy: 0.6685457195902184
Energy: 0.7195799618877613
Energy: 0.6685457195908124
Energy: 0.6674204610359964
Energy: 0.6682773155908385
Energy: 0.72642501932737
Energy: 0.6682773155902442
Energy: 0.6665830632538747
Energy: 0.6675746741466189
Energy: 0.8908185234690189
Energy: 0.667574674147213
Energy: 0.8087135195342497
Energy: 0.7000402512396832
Energy: 0.7074308697857005
Energy: 0.7000402512396832
Energy: 0.8090746138163994
Energy: 0.6866088154806844
Energy: 0.6889874325646768
Energy: 0.6866088154794959
Energy: 0.7833118430873622
Energy: 0.6870343110196114
Energy: 0.6887434794389103
Energy: 0.6870343110202056
Energy: 0.7051729932157524
Energy: 0.6866959540872019
Energy: 0.6875863798280906
Energy: 0.6866959540860132

minimum gb energy = 0.6665764508855823 eV
minimum distance =  2.62376777863191 Angstroms
sigma value = 1


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

Energy: 1.002774347435719
Energy: 0.6544440777793791
Energy: 0.6563697506795403
Energy: 0.6306807596159678
Energy: 0.6545326329196169
Energy: 0.6544357870957125
Energy: 0.7939557886675015
Energy: 0.6544357870940692
Energy: 0.7939458386745014
Energy: 0.7225659764994554
Energy: 0.7964949579850321
Energy: 0.7225659764986339
Energy: 0.6729154192362806
Energy: 0.7235054215863052
Energy: 0.7879308482697231
Energy: 0.7235054215879484
Energy: 0.6547037749420735
Energy: 0.6533839186524251
Energy: 0.7916554010492964
Energy: 0.6533839186516034
Energy: 0.6528756964580457
Energy: 0.6659663826053893
Energy: 0.7988883543202618
Energy: 0.6659663826053893
Energy: 0.6514329536317935
Energy: 0.6523533747572308
Energy: 0.7889621123357909
Energy: 0.6523533747572308
Energy: 0.6550643372026136
Energy: 0.6556397227394315
Energy: 0.8973223444482371
Energy: 0.6556397227386099
Energy: 0.7898292311018358
Energy: 0.6830916517778153
Energy: 0.9025843054846101
Energy: 0.6830916517769936
Energy: 0.7957037747575872
Energy: 0.6573564119783867
Energy: 0.6693579141098425
Energy: 0.6573564119808516
Energy: 0.7895889333295764
Energy: 0.652720371887676
Energy: 0.6520658468928607
Energy: 0.6527203718884977
Energy: 0.6296473183825584
Energy: 0.6577763208779135
Energy: 0.6529866686715112
Energy: 0.6577763208779135
Energy: 0.8969018358012526
Energy: 0.6532452475921487
Energy: 0.654067671621385
Energy: 0.6532452475888624
Energy: 0.7877165979756995
Energy: 0.7234691096579813
Energy: 0.7958730494139241
Energy: 0.7234691096571596
Energy: 0.6757167455553262
Energy: 0.7217304377987777
Energy: 0.7950846945963532
Energy: 0.7217304377971344
Energy: 0.6770380119455047
Energy: 0.6537436255265962
Energy: 0.6552508729103946
Energy: 0.6537436255274177
Energy: 0.6535848435274191
Energy: 0.6566066961540898
Energy: 0.8099130461610671
Energy: 0.6566066961524466
Energy: 0.6642187338457836
Energy: 0.6558741906383971
Energy: 0.7855176124754624
Energy: 0.6558741906392187
Energy: 0.6518387571955705
Energy: 0.6540400536095244
Energy: 0.9014631084910906
Energy: 0.6540400536111677
Energy: 0.6550097190430217
Energy: 0.6652004374771249
Energy: 0.8971187594644708
Energy: 0.6652004374779464
Energy: 0.7921176111930855
Energy: 0.6784050859535239
Energy: 0.6544747897814015
Energy: 0.6784050859535239
Energy: 0.7924335378713554
Energy: 0.653751551771327
Energy: 0.6556243444625921
Energy: 0.6537515517705054
Energy: 0.7885133790069841
Energy: 0.6524546099361076
Energy: 0.652483730848356
Energy: 0.6524546099385725
Energy: 0.8973201192051794
Energy: 0.6533018959797516
Energy: 0.6533545154690718
Energy: 0.6533018959797516

minimum gb energy = 0.6296473183825584 eV
minimum distance =  2.63100402553664 Angstroms
sigma value = 17


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

Energy: 1.0658694037824121
Energy: 0.6477005823277809
Energy: 0.7678796251641378
Energy: 0.6315611723731522
Energy: 0.6480418779057002
Energy: 0.6462084505408496
Energy: 0.7337792457020421
Energy: 0.6462084505413574
Energy: 0.8305359483367444
Energy: 0.645408586027802
Energy: 0.7522997238764074
Energy: 0.6454085860283099
Energy: 0.8466612356753085
Energy: 0.676532779366428
Energy: 0.7301094627188534
Energy: 0.67653277936592
Energy: 0.7173332135669754
Energy: 0.6299305600654752
Energy: 0.7441999900335394
Energy: 0.629930560065983
Energy: 0.6303092188346369
Energy: 0.629658688702128
Energy: 0.7245153277095853
Energy: 0.6296586887026359
Energy: 0.6302207755914192
Energy: 0.629503179541855
Energy: 0.6708763308995283
Energy: 0.6295031795423628
Energy: 0.6367392885609329
Energy: 0.6319056928965995
Energy: 0.6319664242952321
Energy: 0.6319056928960917
Energy: 0.7209472990595724
Energy: 0.6321248854372761
Energy: 0.8036214480859727
Energy: 0.6321248854377608
Energy: 0.7548569005433448
Energy: 0.6787276299184418
Energy: 0.7428148110408516
Energy: 0.6787276299219965
Energy: 0.7189204390753511
Energy: 0.6442464415956417
Energy: 0.6557233881103399
Energy: 0.6442464415961495
Energy: 0.723101437340948
Energy: 0.6471498544753261
Energy: 0.7415500243378637
Energy: 0.6471498544753261
Energy: 0.7187646950904637
Energy: 0.6440459423389497
Energy: 0.6448840236193757
Energy: 0.6440459423394345
Energy: 0.6450743721732
Energy: 0.6436396879988181
Energy: 0.6445751756990941
Energy: 0.6436396879978024
Energy: 0.8422521678301278
Energy: 0.6453631925192224
Energy: 0.6495796072706835
Energy: 0.6453631925187145
Energy: 0.8427198054328999
Energy: 0.6446065205440135
Energy: 0.6475541486652265
Energy: 0.6446065205445214
Energy: 0.6551772279980993
Energy: 0.6522037320176852
Energy: 0.7419511915354664
Energy: 0.6522037320187007
Energy: 0.6437291012508297
Energy: 0.6445830849036406
Energy: 0.8285979827374721
Energy: 0.6445830849041483
Energy: 0.6540043936617803
Energy: 0.6479934904865989
Energy: 0.7309016896677545
Energy: 0.6479934904871067
Energy: 0.6449046670831918
Energy: 0.7300522561029612
Energy: 0.6349148568248376
Energy: 0.7300522560988987
Energy: 0.7532213600237553
Energy: 0.6453112718141925
Energy: 0.6553536803511641
Energy: 0.6453112718152082
Energy: 0.7523948270463642
Energy: 0.7657102976229523
Energy: 0.841357881359955
Energy: 0.7657102976234601
Energy: 0.7308713669182377
Energy: 0.6749500309822477
Energy: 0.8435058373373185
Energy: 0.6749500309822477
Energy: 0.7435166975213541
Energy: 0.6306305913874465
Energy: 0.7167671475967291
Energy: 0.6306305913869386
Energy: 0.8320908279157783
Energy: 0.6303658002601226
Energy: 0.6294939298024863
Energy: 0.6303658002596377
Energy: 0.7443168877322961
Energy: 0.6303031960026105
Energy: 0.6324362939001925
Energy: 0.6303031960031182
Energy: 0.6352666104493869
Energy: 0.6315146800173559
Energy: 0.6339221800662022
Energy: 0.6315146800168482
Energy: 0.7320867954856007
Energy: 0.6312434757181818
Energy: 0.8305040529644839
Energy: 0.6312434757186898
Energy: 0.7354426203874567
Energy: 0.67793656606348
Energy: 0.7523797000611674
Energy: 0.67793656606348
Energy: 0.6563752412973055
Energy: 0.6438483978407705
Energy: 0.7178820610848865
Energy: 0.6438483978412783
Energy: 0.730110865951403
Energy: 0.6437413102481491
Energy: 0.7166195601565738
Energy: 0.6437413102481491
Energy: 0.6442036455548507
Energy: 0.6442181748971246
Energy: 0.7168155396518743
Energy: 0.6442181748971246
Energy: 0.6434521285175356
Energy: 0.6431755760260076
Energy: 0.6462075078365659
Energy: 0.6431755760260076
Energy: 0.648914575690278
Energy: 0.6464937639704704
Energy: 0.8452527588885947
Energy: 0.6464937639709784
Energy: 0.6484505656889904
Energy: 0.660226661972938
Energy: 0.8560370885591234
Energy: 0.6602266619734458
Energy: 0.7441104916788976
Energy: 0.6468965918712432
Energy: 0.6655819795168328
Energy: 0.6468965918707354
Energy: 0.825892697801526
Energy: 0.6436946949632639
Energy: 0.6448722588841538
Energy: 0.6436946949627559
Energy: 0.8039385598419991
Energy: 0.646243250773251
Energy: 0.6443272897939307
Energy: 0.6462432507722354

minimum gb energy = 0.6294939298024863 eV
minimum distance =  2.62975841823482 Angstroms
sigma value = 89


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

Energy: 1.124995766730404
Energy: 0.5915063671139922
Energy: 0.5927579309072325
Energy: 0.6064360585087261
Energy: 0.5913846908839157
Energy: 0.6419359707681752
Energy: 0.5927124634927274
Energy: 0.6419359707681752
Energy: 0.5847036488117059
Energy: 0.6426405772793103
Energy: 0.6020756046754498
Energy: 0.6426405772798389
Energy: 0.5853344643254588
Energy: 0.6434382761616165
Energy: 0.5902551654158039
Energy: 0.6434382761616165
Energy: 0.5888956169224576
Energy: 0.5892666109419936
Energy: 0.597461376337842
Energy: 0.5892666109418577
Energy: 0.5893501771741471
Energy: 0.588699986416164
Energy: 0.5962887665816405
Energy: 0.5886999864162998
Energy: 0.5888247036613391
Energy: 0.5879249066637481
Energy: 0.5905999668827004
Energy: 0.5879249066640199
Energy: 0.5919660485776678
Energy: 0.5915504858045265
Energy: 0.5849755868917581
Energy: 0.5915504858042548
Energy: 0.5917984826596605
Energy: 0.591115973506345
Energy: 0.5920811513784567
Energy: 0.5911159735066168
Energy: 0.6049817136545663
Energy: 0.6436800438357516
Energy: 0.6009752713541071
Energy: 0.6436800438356158
Energy: 0.5907661791516887
Energy: 0.644491540673096
Energy: 0.5834686229962017
Energy: 0.6444915406728393
Energy: 0.5960053563302059
Energy: 0.5920812521112322
Energy: 0.5901758191157529
Energy: 0.592081252111353
Energy: 0.5979320716001235
Energy: 0.5899437943043596
Energy: 0.5891861471241714
Energy: 0.5899437943046315
Energy: 0.5904826174227311
Energy: 0.5876888180234789
Energy: 0.5877665937709525
Energy: 0.5876888180232072
Energy: 0.5852397233389467
Energy: 0.5895585768441977
Energy: 0.5899882794728669
Energy: 0.5895585768443337

minimum gb energy = 0.5834686229962017 eV
minimum distance =  2.65380344042979 Angstroms
sigma value = 13


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

Energy: 0.9922134561177091
Energy: 0.5575737968667622
Energy: 0.7108029660039134
Energy: 0.5536419716415067
Energy: 0.6531657355314562
Energy: 0.5566580121897841
Energy: 0.6710289684437111
Energy: 0.5566580121947964
Energy: 0.568864603144531
Energy: 0.5549454755943988
Energy: 0.6629636715489801
Energy: 0.5549454755943988
Energy: 0.76443295733773
Energy: 0.557397522289783
Energy: 0.651405327352201
Energy: 0.5573975222786697
Energy: 0.6545642310524548
Energy: 0.5564886941846746
Energy: 0.8381527699100408
Energy: 0.5564886941841177
Energy: 0.6530025237044799
Energy: 0.5556213555366091
Energy: 0.8359819157915377
Energy: 0.5556213555343814
Energy: 0.6619787767149075
Energy: 0.5551241354535101
Energy: 0.6497297189955842
Energy: 0.5551241354535101
Energy: 0.5582900139178537
Energy: 0.5571243919771441
Energy: 0.6474705957597767
Energy: 0.557124391978258
Energy: 0.5640401282839612
Energy: 0.5560046130357529
Energy: 0.773373149302121
Energy: 0.5560046130379805
Energy: 0.5540971319136685
Energy: 0.5549343539503269
Energy: 0.6569974077396948
Energy: 0.5549343539519975
Energy: 0.5559432239426543
Energy: 0.5585954069456766
Energy: 0.9926981082922024
Energy: 0.5585954069456766
Energy: 0.6567884154829267
Energy: 0.5545343589125994
Energy: 0.6523468898241264
Energy: 0.5545343589114857
Energy: 0.6716720915298763
Energy: 0.5840235503535333
Energy: 0.7674161145301382
Energy: 0.5840235503618872
Energy: 0.6513792513637205
Energy: 0.5855300265703993
Energy: 0.7646879581429177
Energy: 0.5855300265759685
Energy: 0.6597836273268439
Energy: 0.5566738477127634
Energy: 0.6520637631754841
Energy: 0.5566738477127634
Energy: 0.7747286235320878
Energy: 0.5555759693272946
Energy: 0.557117205429326
Energy: 0.5555759693278516
Energy: 0.6523506881629276
Energy: 0.555058674232293
Energy: 0.5566223557166572
Energy: 0.555058674232293
Energy: 0.9009232896749118
Energy: 0.5574415210323892
Energy: 0.5569791760334285
Energy: 0.5574415210318322
Energy: 0.7489595736671555
Energy: 0.5558865864149947
Energy: 0.6488784641990104
Energy: 0.5558865864122101
Energy: 0.6560977334393989
Energy: 0.5546095784972083
Energy: 0.6622290162576235
Energy: 0.5546095784999929
Energy: 0.7672074599889849
Energy: 0.5539747434282967
Energy: 0.6491248447528422
Energy: 0.5539747434271828
Energy: 0.6566844016128188
Energy: 0.5931038765163684
Energy: 0.7664940829543672
Energy: 0.5931038765202669
Energy: 0.6545807431714482
Energy: 0.5575651742402968
Energy: 0.8385908364730672
Energy: 0.5575651742425245
Energy: 0.5586433645589964
Energy: 0.5538657259506339
Energy: 0.6516129107764018
Energy: 0.5538657259528617
Energy: 0.6502173828501363
Energy: 0.5553472593674299
Energy: 0.8194490316367247
Energy: 0.5553472593707715
Energy: 0.5551761000326055
Energy: 0.5541940329968994
Energy: 0.6480161146593533
Energy: 0.5541940329952287
Energy: 0.5542896744483987
Energy: 0.5540526721274904
Energy: 0.6539999795941156
Energy: 0.5540526721241489
Energy: 0.5641158217769657
Energy: 0.5563476976633298
Energy: 0.5660161239773376
Energy: 0.5563476976611021
Energy: 0.655352017505296
Energy: 0.556297813924156
Energy: 0.7504025195516864
Energy: 0.5562978139269406
Energy: 0.6617288844155081
Energy: 0.5859983175416855
Energy: 0.6536580889342136
Energy: 0.5859983175405716
Energy: 0.6523613198234088
Energy: 0.5843118446143512
Energy: 0.7678348851014444
Energy: 0.5843118446110096
Energy: 0.6588516521238273
Energy: 0.554759359246987
Energy: 0.765104169438711
Energy: 0.554759359248101
Energy: 0.657660865796775
Energy: 0.5555868237369344
Energy: 0.5660827149888596
Energy: 0.5555868237419466
Energy: 0.7652676690326412
Energy: 0.5541142708639014
Energy: 0.5543756465076365
Energy: 0.554114270867243
Energy: 0.7363696760707026
Energy: 0.5552878532724915
Energy: 0.5578069878893933
Energy: 0.5552878532730485

minimum gb energy = 0.5536419716415067 eV
minimum distance =  2.64313009630192 Angstroms
sigma value = 37


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

Energy: 0.9667729020887661
Energy: 0.5202210073283201
Energy: 0.521464203054738
Energy: 0.5128518962818132
Energy: 0.8268322032884394
Energy: 0.5195623754271749
Energy: 0.6859716720407685
Energy: 0.5195623754271749
Energy: 0.7518156337517874
Energy: 0.5759719863472141
Energy: 0.6829899161929286
Energy: 0.5759719863462559
Energy: 0.7557056770767342
Energy: 0.5776166198291576
Energy: 0.6804708829193042
Energy: 0.5776166198291576
Energy: 0.6628370497409202
Energy: 0.5108952911584085
Energy: 0.7576540183686866
Energy: 0.5108952911584085
Energy: 0.5990919879646815
Energy: 0.510946768041627
Energy: 0.8368646949139223
Energy: 0.510946768041627
Energy: 0.59659464914877
Energy: 0.510316867423353
Energy: 0.8223618419807814
Energy: 0.5103168674223949
Energy: 0.5975541485082827
Energy: 0.5056391811898322
Energy: 0.7582562428721074
Energy: 0.5056391811907904
Energy: 0.5906835568213931
Energy: 0.5072379421601797
Energy: 0.7571610688133367
Energy: 0.5072379421592215
Energy: 0.5896802277485975
Energy: 0.5034884060243534
Energy: 0.8219534300443124
Energy: 0.5034884060253115
Energy: 0.6193750613726181
Energy: 0.6193980504011546
Energy: 0.8660377127750344
Energy: 0.6193980504001964
Energy: 0.750412343672359
Energy: 0.5033306309331945
Energy: 0.8220405899772525
Energy: 0.5033306309341528
Energy: 0.7491247239243474
Energy: 0.5594221717838593
Energy: 0.751585517740347
Energy: 0.5594221717848175
Energy: 0.7523164066418374
Energy: 0.5614046250079185
Energy: 0.7553404553915776
Energy: 0.5614046250060023
Energy: 0.7576540183696447
Energy: 0.5695341844909225
Energy: 0.66886224415341
Energy: 0.5695341844918808
Energy: 0.82331589254616
Energy: 0.5685333530337928
Energy: 0.5992885774813208
Energy: 0.5685333530328346
Energy: 0.8237316381886794
Energy: 0.5615388553475213
Energy: 0.5964921752854853
Energy: 0.5615388553465632
Energy: 0.7582562433615148
Energy: 0.5190554799722839
Energy: 0.5253204723182902
Energy: 0.5190554799713256
Energy: 0.7571610688095038
Energy: 0.520850683879222
Energy: 0.5187374021576241
Energy: 0.520850683879222
Energy: 0.755314760139019
Energy: 0.5196521877138464
Energy: 0.5250026071680753
Energy: 0.5196521877138464

minimum gb energy = 0.5033306309331945 eV
minimum distance =  2.64169624811471 Angstroms
sigma value = 25


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

Energy: 1.0219416481591455
Energy: 0.45167975124521026
Energy: 0.6305393809583574
Energy: 0.45337334968961773
Energy: 0.9158901888103953
Energy: 0.44933365236142125
Energy: 0.5809318467177347
Energy: 0.44933365236142125
Energy: 0.9137627321562743
Energy: 0.44867103726696067
Energy: 0.5843130110463831
Energy: 0.4486710372684571
Energy: 0.7187763629621495
Energy: 0.452630300395842
Energy: 0.5805563023628605
Energy: 0.452630300395842
Energy: 0.8139792762978075
Energy: 0.4949657759186739
Energy: 0.8136257150934805
Energy: 0.4949657759186739
Energy: 0.7149286348563354
Energy: 0.4934693392917939
Energy: 0.8157638601187903
Energy: 0.4934693392917939
Energy: 0.7166545766088329
Energy: 0.49563832124877466
Energy: 0.8137319897020959
Energy: 0.4956383212495229
Energy: 0.5810795652405492
Energy: 0.45278852781832396
Energy: 0.8111330991945136
Energy: 0.45278852781832396
Energy: 0.583402235323333
Energy: 0.4485016910667879
Energy: 0.9134775324987953
Energy: 0.4485016910667879
Energy: 0.583773492325872
Energy: 0.44941037945282564
Energy: 0.9158494681510823
Energy: 0.44941037945207746
Energy: 0.44958092512446174
Energy: 0.45250389071104113
Energy: 0.8708191505596035
Energy: 0.4525038907125375
Energy: 0.45151444120764517
Energy: 0.44936907509254853
Energy: 0.9159203453754958
Energy: 0.44936907509254853
Energy: 0.4500998565723971
Energy: 0.45069920602608177
Energy: 0.9109327928476735
Energy: 0.45069920602608177
Energy: 0.458322189692344
Energy: 0.4533614356945798
Energy: 0.9096204371054974
Energy: 0.4533614356945798
Energy: 0.5840175109946705
Energy: 0.44842751742746667
Energy: 0.9140348093400309
Energy: 0.44842751742746667
Energy: 0.584043634046848
Energy: 0.4496804316600879
Energy: 0.9161490200780933
Energy: 0.4496804316600879
Energy: 0.7194118786038567
Energy: 0.45069864423408973
Energy: 0.9109319277997581
Energy: 0.45069864423408973
Energy: 0.5843428265943741
Energy: 0.49728767035582466
Energy: 0.8163590311157275
Energy: 0.49728767035582466
Energy: 0.8133971300301083
Energy: 0.49412242414994056
Energy: 0.7163986367443342
Energy: 0.49412242414994056
Energy: 0.9153848325018168
Energy: 0.4946947531647281
Energy: 0.7152281369130656
Energy: 0.49469475316622447
Energy: 0.8718957228196398
Energy: 0.451483588852584
Energy: 0.5844506522635025
Energy: 0.45148358885333223
Energy: 0.9159288376922258
Energy: 0.44815939258258847
Energy: 0.4489408191515192
Energy: 0.44815939258258847
Energy: 0.9168710644299364
Energy: 0.45045253046760203
Energy: 0.5806069722343641
Energy: 0.45045253046760203
Energy: 0.8156032572105272
Energy: 0.44985976946116957
Energy: 0.4544569922926697
Energy: 0.44985976946191775
Energy: 0.91398284322897
Energy: 0.44827981261017935
Energy: 0.44883743402136134
Energy: 0.44827981260943117
Energy: 0.914547067027324
Energy: 0.44983350847047965
Energy: 0.45287932773560774
Energy: 0.44983350847047965

minimum gb energy = 0.44815939258258847 eV
minimum distance =  2.65719876414837 Angstroms
sigma value = 41


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

Energy: 1.1184107044112055
Energy: 0.409614061384146
Energy: 0.5993358456851169
Energy: 0.4129079934967773
Energy: 0.9707164757549562
Energy: 0.4072891287752296
Energy: 0.5241917734513042
Energy: 0.4072891287752296
Energy: 0.9707959224771074
Energy: 0.4068810307990387
Energy: 0.5199171426175919
Energy: 0.4068810307990387
Energy: 0.8125939516433083
Energy: 0.41009512368960743
Energy: 0.6349617089164054
Energy: 0.41009512369022083
Energy: 0.8922418499416594
Energy: 0.40552985355871785
Energy: 0.7196206029341591
Energy: 0.40552985354215587
Energy: 0.8070321669603849
Energy: 0.5557488524252597
Energy: 0.7179021810351647
Energy: 0.5557488524246462
Energy: 0.8108626813367601
Energy: 0.445181218434579
Energy: 0.8105162294519248
Energy: 0.4451812184358058
Energy: 0.7230056960669751
Energy: 0.4488061976193372
Energy: 0.7210757072331564
Energy: 0.4488061976193372
Energy: 0.6274841533728923
Energy: 0.5579148991918126
Energy: 0.8887043172263248
Energy: 0.5579148991906137
Energy: 0.6284766734809637
Energy: 0.4053753160472197
Energy: 0.8921928737793857
Energy: 0.4053753160472197
Energy: 0.5242108559938031
Energy: 0.41057912982210965
Energy: 0.8853302822001523
Energy: 0.41057912982272304
Energy: 0.5163437204783633
Energy: 0.4060826303660525
Energy: 0.9705677620918125
Energy: 0.40608263036725145
Energy: 0.5179574581892062
Energy: 0.4073774006284979
Energy: 0.9728641507752899
Energy: 0.40737740063156497
Energy: 0.41292570712066035
Energy: 0.4085003705854098
Energy: 0.884676099074623
Energy: 0.4085003705847963
Energy: 0.40708127876412725
Energy: 0.4073020285691884
Energy: 0.968670932476959
Energy: 0.4073020285691884
Energy: 0.4102898937926604
Energy: 0.4074926269097297
Energy: 0.9722845061700499
Energy: 0.4074926269103431
Energy: 0.5214228244061219
Energy: 0.4088246441148432
Energy: 0.9650192377032143
Energy: 0.4088246441148432
Energy: 0.5158395319545961
Energy: 0.4053330890321807
Energy: 0.9679275835172203
Energy: 0.4053330890327941
Energy: 0.5174179819162359
Energy: 0.4088301167094511
Energy: 0.8091152720941229
Energy: 0.40883011671064995
Energy: 0.717793803630369
Energy: 0.4076454802390336
Energy: 0.8075928793654785
Energy: 0.407645480239647
Energy: 0.7223329633821051
Energy: 0.4058325887544816
Energy: 0.8864156325594756
Energy: 0.4058325887532548
Energy: 0.7184307217255246
Energy: 0.44406330578770903
Energy: 0.8114940487161371
Energy: 0.44406330581896486
Energy: 0.889280128131116
Energy: 0.4425430485572028
Energy: 0.8055213979390377
Energy: 0.4425430485578162
Energy: 0.7203198909630336
Energy: 0.4436361512811927
Energy: 0.7177728983129459
Energy: 0.4436361512854865
Energy: 0.8870498693817866
Energy: 0.4056470221090725
Energy: 0.6257624007485405
Energy: 0.4056470221102993
Energy: 0.8895922651973484
Energy: 0.4072684421613171
Energy: 0.7163766749486477
Energy: 0.4072684421643841
Energy: 0.8922220423733699
Energy: 0.40940441704264235
Energy: 0.5233077756161797
Energy: 0.40940441704264235
Energy: 0.9676664232321731
Energy: 0.40586923164347544
Energy: 0.515287609564192
Energy: 0.405869231642862
Energy: 0.891808554541015
Energy: 0.4085902013552492
Energy: 0.5208841255496879
Energy: 0.4085902013540224
Energy: 0.8897921212974846
Energy: 0.4076755994202248
Energy: 0.4111213649428291
Energy: 0.40767559942083825
Energy: 0.9683906495805139
Energy: 0.406829637308708
Energy: 0.4068090063329954
Energy: 0.4068296373093215
Energy: 0.9652631338557742
Energy: 0.41020794428681534
Energy: 0.4120926237597674
Energy: 0.41020794428804214

minimum gb energy = 0.4053330890321807 eV
minimum distance =  2.65264275810515 Angstroms
sigma value = 15


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

Energy: 0.9642278550978728
Energy: 0.3795020184467276
Energy: 0.574403200550059
Energy: 0.38130392155350784
Energy: 1.0088664900120106
Energy: 0.37507123034852463
Energy: 0.4731417791856872
Energy: 0.37507123034748535
Energy: 1.0089704805973778
Energy: 0.37418724534662445
Energy: 0.46982476002641504
Energy: 0.3741872453461048
Energy: 0.8745152521752884
Energy: 0.37780965971078906
Energy: 0.6481805223496858
Energy: 0.3778096597133872
Energy: 0.9405082214484447
Energy: 0.3725312155695343
Energy: 0.6428657412969028
Energy: 0.37253121556797536
Energy: 0.8691787124670438
Energy: 0.37267137286461754
Energy: 0.6419455185648676
Energy: 0.3726713728635783
Energy: 0.7229757299134558
Energy: 0.37613531386802146
Energy: 0.7943986673183762
Energy: 0.3761353137895793
Energy: 0.7978497523945254
Energy: 0.407839400125838
Energy: 0.6417706860714439
Energy: 0.40783940007597613
Energy: 0.722558639291568
Energy: 0.4040442152535143
Energy: 0.7933713862245898
Energy: 0.4040442152529946
Energy: 0.7214618755384653
Energy: 0.40576480467523046
Energy: 0.8713961769749589
Energy: 0.40576480465392517
Energy: 0.6466093562093564
Energy: 0.3755757102351326
Energy: 0.8032515261050037
Energy: 0.3755757104018665
Energy: 0.5581825309767986
Energy: 0.37209854803650055
Energy: 0.9359836109599226
Energy: 0.37209854812011545
Energy: 0.6421515393433143
Energy: 0.37301774665664683
Energy: 0.9378440351544389
Energy: 0.37301774666859855
Energy: 0.4734940944874018
Energy: 0.3774774220853277
Energy: 0.8011594622037227
Energy: 0.3774774220853277
Energy: 0.46576445854944415
Energy: 0.3725956420721503
Energy: 1.005718814864867
Energy: 0.372595642071111
Energy: 0.4711369595677578
Energy: 0.37606266323143955
Energy: 0.9398427441861057
Energy: 0.3760626632319592
Energy: 0.37903602233764444
Energy: 0.37562652208196906
Energy: 0.9427825067675715
Energy: 0.3756265220850869
Energy: 0.3733146138356951
Energy: 0.37305952749840526
Energy: 1.005084391664334
Energy: 0.3730595274978856
Energy: 0.38063050890993194
Energy: 0.37557724631103667
Energy: 0.8706441186041549
Energy: 0.37557724631207595
Energy: 0.47250098756180087
Energy: 0.37535821138568787
Energy: 1.0113048228482906
Energy: 0.37535821138464853
Energy: 0.46452766673986695
Energy: 0.3729593471451059
Energy: 1.005133205630187
Energy: 0.37295934714562556
Energy: 0.4730616845190013
Energy: 0.3782490762240261
Energy: 0.8752802573882917
Energy: 0.37824907622246706
Energy: 0.6418038010376608
Energy: 0.37387394136202684
Energy: 0.867644617412503
Energy: 0.3738739413641054
Energy: 0.6434669019747701
Energy: 0.3723285994963044
Energy: 0.9367802043142415
Energy: 0.37232859949682406
Energy: 0.6470938570432698
Energy: 0.3750590537242065
Energy: 0.7279605062824206
Energy: 0.37505905359330416
Energy: 0.7959429271683557
Energy: 0.5131484524803048
Energy: 0.8724014348384811
Energy: 0.5131484524803048
Energy: 0.6410879091467026
Energy: 0.4043153791098729
Energy: 0.7939352704972351
Energy: 0.4043153791098729
Energy: 0.7986500667151901
Energy: 0.4073898844023729
Energy: 0.7283452553224526
Energy: 0.40738988440185325
Energy: 0.7975793045735321
Energy: 0.37561656941297694
Energy: 0.7949415902488212
Energy: 0.3756165692836336
Energy: 0.7956210488517613
Energy: 0.3727854068829424
Energy: 0.6424840813660521
Energy: 0.37278540696242385
Energy: 0.9392489283064964
Energy: 0.3727156255611548
Energy: 0.5582526922560307
Energy: 0.37271562555959586
Energy: 0.8005625186806955
Energy: 0.37845804571068475
Energy: 0.6471149050137313
Energy: 0.37845804570964553
Energy: 0.9386037915567783
Energy: 0.3742328886820904
Energy: 0.47122457055085926
Energy: 0.3742328886831297
Energy: 0.935934915102228
Energy: 0.3740987957091374
Energy: 0.4704429497933832
Energy: 0.3740987957091374
Energy: 0.934489332230745
Energy: 0.37700648659754016
Energy: 0.3843062231548281
Energy: 0.37700648659598124
Energy: 1.0086623621326611
Energy: 0.37605878075548144
Energy: 0.3770237083561468
Energy: 0.37605878075548144
Energy: 1.007058348816503
Energy: 0.37646198795916586
Energy: 0.3747119197617431
Energy: 0.37646198795916586

minimum gb energy = 0.37209854803650055 eV
minimum distance =  2.65614505053222 Angstroms
sigma value = 85


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

Energy: 1.0770647517000898
Energy: 0.337033261615766
Energy: 0.3370649778713196
Energy: 0.35141728596736843
Energy: 0.9634551874245733
Energy: 0.33781311487668686
Energy: 0.42150734916506233
Energy: 0.33781311487713755
Energy: 0.933821370996396
Energy: 0.3375954108830953
Energy: 0.4216320585260506
Energy: 0.3375954108826446
Energy: 0.8048309433243878
Energy: 0.33799720550335854
Energy: 0.5751451759479514
Energy: 0.3379972055047106
Energy: 0.9344211623815748
Energy: 0.3364391881168256
Energy: 0.5744475711318562
Energy: 0.336439188117727
Energy: 0.8087636439308613
Energy: 0.33697017040415456
Energy: 0.5755609628095231
Energy: 0.33697017038930244
Energy: 0.8058281771819047
Energy: 0.33731222647467207
Energy: 0.713650881232091
Energy: 0.33731222647557346
Energy: 0.8439178130001542
Energy: 0.3374613698938308
Energy: 0.6116297709707398
Energy: 0.33746136992265413
Energy: 0.8109464623033567
Energy: 0.33748569645892934
Energy: 0.7106362040058763
Energy: 0.33748569646839377
Energy: 0.8098315550755051
Energy: 0.39299906301502036
Energy: 0.8387481022399706
Energy: 0.39299906301411897
Energy: 0.7113099381481475
Energy: 0.3366624462456129
Energy: 0.7416672703239245
Energy: 0.3366624462960488
Energy: 0.6768130244606196
Energy: 0.3361680032917379
Energy: 0.8389384669762433
Energy: 0.33616800329489266
Energy: 0.7109982527344708
Energy: 0.33641066574459083
Energy: 0.8716021531247717
Energy: 0.33641066574459083
Energy: 0.5739157653895446
Energy: 0.3378199008323858
Energy: 0.7405037113026911
Energy: 0.3378199009562628
Energy: 0.5372702602186331
Energy: 0.3362977492652962
Energy: 0.9614461795760365
Energy: 0.3362977492634935
Energy: 0.5757762652538966
Energy: 0.33766727886816805
Energy: 0.8729437277483981
Energy: 0.3376672788699708
Energy: 0.41507088011324766
Energy: 0.3370252223167479
Energy: 0.8694319306833039
Energy: 0.3370252223162973
Energy: 0.4184217064581628
Energy: 0.3363329237341521
Energy: 0.9930813654190876
Energy: 0.3363329237346028
Energy: 0.41394859731629197
Energy: 0.33728836072151475
Energy: 0.9912364465532131
Energy: 0.3372883607219654
Energy: 0.3826308335511536
Energy: 0.33619528275703525
Energy: 0.9912984683447823
Energy: 0.33619528275658456
Energy: 0.3753952173152884
Energy: 0.3347899742820209
Energy: 1.0225521167368472
Energy: 0.33478997428066887
Energy: 0.38090296289971187
Energy: 0.33468526883176497
Energy: 0.9003649105754287
Energy: 0.3346852688313143
Energy: 0.4647508367858734
Energy: 0.3376522603569884
Energy: 1.020531106369865
Energy: 0.33765226035834045
Energy: 0.45842637023692867
Energy: 0.33627573663045
Energy: 1.022854384420945
Energy: 0.33627573663180205
Energy: 0.4613649149656229
Energy: 0.3348250726260519
Energy: 0.8048379442188672
Energy: 0.3348250726242491
Energy: 0.5726363884371544
Energy: 0.33648766754209813
Energy: 0.9319208265619459
Energy: 0.33648766754164744
Energy: 0.5726010060151849
Energy: 0.3360447278295572
Energy: 0.933235957567881
Energy: 0.33604472783181055
Energy: 0.6417236272306763
Energy: 0.3364456675734715
Energy: 0.8059049874771406
Energy: 0.3364456675725701
Energy: 0.7127574271224687
Energy: 0.3361512244280008
Energy: 0.9327281364418576
Energy: 0.3361512243933185
Energy: 0.7116257195260502
Energy: 0.33612088478033325
Energy: 0.8079594176581724
Energy: 0.33612088482493063
Energy: 0.8570430954274436
Energy: 0.39291219579370795
Energy: 0.675305660797846
Energy: 0.39291219579055314
Energy: 0.7415961497068466
Energy: 0.3930081712709806
Energy: 0.8128552361367678
Energy: 0.3930081679500017
Energy: 0.8411501797100448
Energy: 0.4422752431859364
Energy: 0.6779525946508971
Energy: 0.4422752431859364
Energy: 0.9069329039046765
Energy: 0.3372910083970763
Energy: 0.6790663002110756
Energy: 0.3372910116383044
Energy: 0.7406017629385995
Energy: 0.3387386932915757
Energy: 0.5752622376998106
Energy: 0.33873869328977296
Energy: 0.9649525459425611
Energy: 0.3365028024433945
Energy: 0.5739582519360716
Energy: 0.3365028024438451
Energy: 0.9938213187733138
Energy: 0.3370855900167189
Energy: 0.575275052683456
Energy: 0.3370855900171696
Energy: 0.8694883097233242
Energy: 0.3402970196480655
Energy: 0.4205681612448612
Energy: 0.34029701964761483
Energy: 1.0254012956104197
Energy: 0.3366305569207448
Energy: 0.41808171557063323
Energy: 0.33663055692254756
Energy: 0.9912961339962623
Energy: 0.33959297869087635
Energy: 0.4225784249707173
Energy: 0.33959297869087635
Energy: 0.8684344825767193
Energy: 0.33814453286561524
Energy: 0.33767764749054197
Energy: 0.3381445328665166
Energy: 1.0238196650087916
Energy: 0.33662857927248535
Energy: 0.33687119359140466
Energy: 0.3366285792738374
Energy: 0.931195040025845
Energy: 0.33766382953255164
Energy: 0.3369005047483455
Energy: 0.337663829532101

minimum gb energy = 0.3346852688313143 eV
minimum distance =  2.64904842018646 Angstroms
sigma value = 113


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

Energy: 0.009640818863500624
Energy: 0.2930175661535923
Energy: 0.7727550734686109
Energy: 0.010155111250434057
Energy: 0.5492211285450646
Energy: 0.07121496446219364
Energy: 0.5485697614932081
Energy: 0.0712149644628673
Energy: 0.010011071329665859
Energy: 0.07074413969948518
Energy: 0.5478603835917605
Energy: 0.07074413970083253
Energy: 0.010777026209301993
Energy: 0.07230481547186779
Energy: 0.5512924821989716
Energy: 0.07230481547186779
Energy: 0.5500808772157812
Energy: 0.07241927284281595
Energy: 0.5503066147659043
Energy: 0.07241927284281595
Energy: 0.009916946121087471
Energy: 0.07044317414541428
Energy: 0.5476238648957802
Energy: 0.0704431741450678

minimum gb energy = 0.009640818863500624 eV
minimum distance =  2.85628057794804 Angstroms
sigma value = 1