Model name: model_name=EMT_Asap_MetalGlass_BaileySchiotzJacobsen_2004_CuMg__MO_228059236215_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.587871603667736
cohesive_energy=3.5216851723143447
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.53308276665875e-19, 2.2019514569379e-19, 2.7196627926823197e-19, 3.14241311932956e-19, 3.4983046150399795e-19, 3.8035993726486796e-19, 4.0684231484825395e-19, 4.3000658462262595e-19, 4.50373453994034e-19, 4.6826015393601e-19, 4.839839154220859e-19, 4.97794678007166e-19, 5.0989591812376795e-19, 5.20449455611926e-19, 5.295994863686999e-19, 5.37470980171542e-19, 5.44180895914734e-19, 5.498221598430479e-19, 5.54442837255504e-19, 5.580893912744879e-19, 5.60830715495262e-19, 5.627276926299179e-19, 5.63833194507378e-19, 5.641920820733939e-19, 5.63807559681234e-19, 5.62565872789884e-19, 5.60322825502284e-19, 5.56903780565328e-19, 5.52106863723132e-19, 5.45682135420792e-19, 5.373219777445799e-19, 5.26664298775212e-19, 5.1328131735141e-19, 4.96647519537222e-19, 4.761300455622179e-19, 4.5097266805515e-19, 4.20257339804736e-19, 3.8265265202812197e-19, 3.3651316932219e-19, 2.7988423619346e-19, 2.10239220090114e-19, 1.2423902468923259e-19, 1.7422869806433e-20, -1.16100928694493e-19, -2.8432867417617596e-19, -4.98834490642632e-19, -7.754983518017519e-19, -1.1378994911761139e-18, -1.6210983400475399e-18, -2.2795288495561798e-18, -3.2005240658447397e-18, -4.5316765004372996e-18, -6.5291421535777796e-18, -9.644158052465939e-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: -5.69299980837746e-26 eV

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

Energy: 0.015599094670134404
Energy: 0.0204118942275176
Energy: 0.11045464449452788
Energy: 0.10981032274647351
Energy: 0.019575052188059466
Energy: 0.01700293472710124
Energy: 0.10917213471975075
Energy: 0.11141096700235145
Energy: 0.10948260433560351
Energy: 0.01881780063562274
Energy: 0.016320924603378043
Energy: 0.10831223315206483
Energy: 0.10924340030885207
Energy: 0.1107203599036929
Energy: 0.11125161536445259
Energy: 0.10893127099271671
Energy: 0.10836795799506468
Energy: 0.10910295427080204
Energy: 0.11080098691760336
Energy: 0.11055859820568552
Energy: 0.11107736378632473
Energy: 0.019399600003747137
Energy: 0.01598788884433159
Energy: 0.10881534217679789
Energy: 0.109971131095516
Energy: 0.11065824817824589
Energy: 0.01856652196698924
Energy: 0.016026914997032404
Energy: 0.10864104825798859
Energy: 0.11080414834220934
Energy: 0.10999616142231157
Energy: 0.017106815915242473
Energy: 0.016985361020899432
Energy: 0.10822572232602962
Energy: 0.10923890357583653
Energy: 0.11025438079059917
Energy: 0.017759009680513877
Energy: 0.016307816824422817
Energy: 0.10921322515466414
Energy: 0.10881708972380567
Energy: 0.1096881919926802
Energy: 0.10934682046812537
Energy: 0.11164536796348842
Energy: 0.017551390024051473
Energy: 0.016577587845166324
Energy: 0.10925165330568891
Energy: 0.10996211000378611
Energy: 0.11121337300138566
Energy: 0.018439931735470972
Energy: 0.10967554000311955
Energy: 0.11167075361259278
Energy: 0.10895072421992327
Energy: 0.10976532962867049
Energy: 0.01682134913979448
Energy: 0.016153998326064085
Energy: 0.11190897334236749
Energy: 0.10819582519667642
Energy: 0.11035873606940538
Energy: 0.01732608742133527
Energy: 0.016312450665185437
Energy: 0.01624642079676698
Energy: 0.11191040123230526
Energy: 0.10979339682665018
Energy: 0.110373882556907
Energy: 0.11276708584083599
Energy: 0.01632031453433764
Energy: 0.11270648251071923
Energy: 0.10946923662037004
Energy: 0.11109702846610402
Energy: 0.1118359146444848

minimum gb energy = 0.015599094670134404 eV
minimum distance =  2.50098149152185 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 1.233377670646893
Energy: 0.8581113362646811
Energy: 0.8624558251596597
Energy: 0.8444213028057942
Energy: 0.8323395770375953
Energy: 0.8679766917597924
Energy: 0.8200307558923328
Energy: 0.8641583473928497
Energy: 0.8639000933645439
Energy: 0.8581503140136901
Energy: 0.7457630029601189
Energy: 0.9203169644630385
Energy: 0.8446525497377809
Energy: 0.7755736112726335
Energy: 0.7079042065810394
Energy: 0.6547255078329803
Energy: 0.9006947736420915
Energy: 0.8624540385627242
Energy: 0.7535333004609903
Energy: 0.7086881508056327
Energy: 0.7564477711352937
Energy: 0.8995151232455815
Energy: 0.7562938420400649
Energy: 0.7047999443046219
Energy: 0.7073435734074381
Energy: 0.7051562201265705
Energy: 0.8042054979816552
Energy: 0.7589930309275967
Energy: 0.7967992154691733
Energy: 0.7934278384635485
Energy: 0.7104606009261605
Energy: 0.8720713362890391
Energy: 0.8589528846450903
Energy: 0.704736492157989
Energy: 0.7335428494289505
Energy: 0.7049274821020638
Energy: 0.8653504066406547
Energy: 0.85903025705619
Energy: 0.792965222953432
Energy: 0.793199777898526
Energy: 0.8877883757646969
Energy: 0.8657973957905227
Energy: 0.8490244365804648
Energy: 0.7263041018672723
Energy: 0.7351644363742647
Energy: 0.7674053783622742
Energy: 0.8637217996281737
Energy: 0.8749868105204787
Energy: 0.8326244049508353
Energy: 0.7404579574529302
Energy: 0.859922230945706
Energy: 0.8628285176003481
Energy: 0.882582212706235
Energy: 0.7279645812722921
Energy: 0.9454690827494535
Energy: 0.8600129282832167
Energy: 0.8635586889278059
Energy: 0.944558232258012
Energy: 0.7867967566097911
Energy: 0.9792464828103474
Energy: 0.9046321872735974
Energy: 0.9082042576775744
Energy: 0.9156600365344081
Energy: 0.7316510739527634
Energy: 0.8904642977164269
Energy: 0.9109431126558168
Energy: 0.9890778822159021
Energy: 0.9006849143995073
Energy: 0.7302957682831941
Energy: 0.902056373725127
Energy: 0.9135951486786731
Energy: 0.890730385897486
Energy: 0.8769337908397967
Energy: 0.7385885968845476
Energy: 0.8876212371435748
Energy: 0.9004088534022723
Energy: 0.8892009226893482
Energy: 0.8923488945762296
Energy: 0.9529801077662904
Energy: 0.9056442966903294
Energy: 0.9782460113029262
Energy: 0.7939139989007391
Energy: 0.7345447454746037
Energy: 0.8913602818718339
Energy: 0.8869310673788321
Energy: 0.9798378961224523
Energy: 0.7778997210191623
Energy: 0.7194521321769379
Energy: 0.9703916860834724
Energy: 0.884726499292485
Energy: 0.9428213680337815
Energy: 0.7654640678880685
Energy: 0.7303696994251013
Energy: 0.8222683665248323
Energy: 0.8605544536777406
Energy: 0.761852140255024
Energy: 0.7652847942902289
Energy: 0.7275833920143062
Energy: 0.8125736867875256
Energy: 0.7723767960475604
Energy: 0.9174220505795546
Energy: 0.731522311819364
Energy: 0.7690558373845687
Energy: 0.7624153285600725
Energy: 0.767647707703345
Energy: 0.8171886702888868
Energy: 0.7944563049542547
Energy: 0.7666229101591717
Energy: 0.7607552461372357
Energy: 0.7562910363739812
Energy: 1.0070939129071077
Energy: 0.7967377432516606
Energy: 0.7329669409777376
Energy: 0.9896846447779649
Energy: 0.8549670241633632
Energy: 0.7662601096300704
Energy: 0.7966947316759858
Energy: 0.8312916664977605
Energy: 1.0391023075726904
Energy: 0.9194061831140323
Energy: 0.9930027718758365
Energy: 0.7971099349934411
Energy: 0.9141434967257952
Energy: 0.8597718607355822
Energy: 0.8974677041398458
Energy: 0.8096045829763973
Energy: 0.8002096640636012
Energy: 0.8792575917472084
Energy: 0.8612314227664709
Energy: 0.8961207765533111
Energy: 0.6552464746898745
Energy: 0.8025991944332981
Energy: 0.9859380388546684
Energy: 0.914159487531633
Energy: 0.866733749390586
Energy: 0.7914086950570743
Energy: 0.8032798333334659
Energy: 0.9838502558206085
Energy: 0.9140215777531798
Energy: 0.9220748314403875
Energy: 1.1610839046872767
Energy: 0.9144864537634364
Energy: 0.9064150078747875
Energy: 0.9071306186961172
Energy: 0.893112576815276
Energy: 0.8971146465643789
Energy: 0.906142738745561
Energy: 0.9073791305587708
Energy: 0.9136736812577706
Energy: 0.8939542414076473
Energy: 0.7399745216838426
Energy: 1.0584945640589178
Energy: 0.9105690685830456
Energy: 0.9887630026200087
Energy: 0.8063488165394335
Energy: 0.728637536482779
Energy: 0.9830142677250893
Energy: 0.9123204472649145
Energy: 0.8209199688955233
Energy: 0.8057508792021526
Energy: 0.8079265868608048
Energy: 0.8032065497622306
Energy: 0.7573681602566291
Energy: 0.763854125560402
Energy: 0.7943838506425379
Energy: 0.8074608770148258
Energy: 0.7607772756864583
Energy: 0.7586967292235983
Energy: 0.8061643051873598
Energy: 0.7951750062506158
Energy: 0.838729537850932
Energy: 0.7609768925225127
Energy: 0.7571918051351869
Energy: 0.7632930806656868
Energy: 0.7424216185594722
Energy: 0.7634618642168315
Energy: 0.7547562016535996
Energy: 0.7574930620637838
Energy: 0.8050414999843354
Energy: 0.7714918537539174
Energy: 0.8323712468050943
Energy: 0.926328623212088
Energy: 0.921326131748684
Energy: 0.8969688757901527
Energy: 0.8000098597679426
Energy: 0.8907647142037022
Energy: 0.9096716907607619
Energy: 0.8738253930828458
Energy: 0.7276492658784693
Energy: 0.7365893306001006
Energy: 0.9081630817676941
Energy: 0.8970831914574522
Energy: 0.9464553536121586
Energy: 0.7267120190643114
Energy: 0.8766790719143994
Energy: 0.858223076094127
Energy: 0.8972679980249083
Energy: 0.8809188416157503
Energy: 0.8488809923793633
Energy: 0.8815765304475227
Energy: 0.9036390473930299
Energy: 0.9764028775890303
Energy: 0.7651847628943245
Energy: 0.7296236866113011
Energy: 0.874407794498089
Energy: 0.9042866604928894
Energy: 0.9531508656050037
Energy: 0.7637884352701119
Energy: 0.7296188039366034
Energy: 0.9072352133932857
Energy: 1.0329792125268822
Energy: 0.8855517891437324
Energy: 0.7494780160204031
Energy: 0.7853344550965144
Energy: 0.9024393007486888
Energy: 0.903915347363583
Energy: 0.8903418862956776
Energy: 0.7369954812586185
Energy: 0.73762068682772
Energy: 0.8898340394760049
Energy: 0.9796503947109388
Energy: 0.8114707792725528
Energy: 0.7193274391932629
Energy: 0.8651091748211456
Energy: 0.8878469722887873
Energy: 0.9794037951261038
Energy: 0.7951301131905097
Energy: 0.6881615430332195
Energy: 0.7996392674265461
Energy: 0.8882834700329743
Energy: 0.751385571501837
Energy: 0.7274684972771172
Energy: 0.7924797127921418
Energy: 0.8287191485846678
Energy: 0.7544380108171862
Energy: 0.7526722477058284
Energy: 0.7270975326127292
Energy: 0.7318980112176781
Energy: 0.8278340831666883
Energy: 0.7568048816422496
Energy: 0.814146838435506
Energy: 0.7350933706601189
Energy: 0.7632457260329677
Energy: 0.770336961464124
Energy: 0.7672809725088162
Energy: 0.8301951875750171
Energy: 0.7310307796018444
Energy: 0.7671493335036488
Energy: 0.7636504850433513
Energy: 0.7562397052043622
Energy: 0.7080724208136787
Energy: 0.7333642338878197
Energy: 0.7947169097191614
Energy: 0.8882308240175583
Energy: 0.8576692011813245
Energy: 0.7067679625476444
Energy: 0.6632827204333287
Energy: 0.7331496283259816
Energy: 1.0183314828946275
Energy: 0.8625043178189762
Energy: 0.9326408000801255
Energy: 0.8500016979261356
Energy: 0.9066794289851426
Energy: 0.898578922536323
Energy: 0.8581292473061913
Energy: 0.7087140939554708
Energy: 0.7067912791583396
Energy: 0.8204139752081556
Energy: 0.8990636580645242
Energy: 0.8969567013715252
Energy: 0.8628992253879088
Energy: 0.8350478321421662
Energy: 0.9391360896719554
Energy: 0.8606366854807824
Energy: 0.8113125594048529
Energy: 0.707814938258168
Energy: 0.708990222643547
Energy: 0.9419606184183291
Energy: 0.8250095042898332
Energy: 0.8395057846439654
Energy: 0.9083129113224622
Energy: 0.8467113116963878
Energy: 0.8644308741743011
Energy: 0.8220573680377407
Energy: 0.832747319860813
Energy: 0.8312502878022636
Energy: 0.8212363692209061
Energy: 0.8631092623195232
Energy: 0.8421195580695301
Energy: 0.8047784265856939

minimum gb energy = 0.6547255078329803 eV
minimum distance =  2.35665983214062 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.5185012400186233
Energy: 0.9918779258040074
Energy: 0.8578550172275109
Energy: 0.8714724489071171
Energy: 0.9890331257801626
Energy: 0.8625254390751147
Energy: 1.0167546234044367
Energy: 0.8940335297105636
Energy: 0.873720652556096
Energy: 0.9887954503172384
Energy: 0.8731143325548344
Energy: 0.8724889232017016
Energy: 0.8937676554999817
Energy: 0.8715798957210121
Energy: 0.8633850163353716
Energy: 0.8594728212996193
Energy: 0.8222386511102747
Energy: 0.8746911631203177
Energy: 0.9020070693780178
Energy: 0.8720917654514666
Energy: 0.9122312687405569
Energy: 1.018044616436801
Energy: 0.8782334884404657
Energy: 0.8602323442618222
Energy: 0.8773911180938948
Energy: 0.847741024032678
Energy: 1.0071845787603186
Energy: 0.878431735189407
Energy: 0.8661740693173897
Energy: 0.8775684439511423
Energy: 0.8951039135094373
Energy: 0.8749094476717716
Energy: 0.8706950472308044
Energy: 0.8480710170668224
Energy: 0.883974570237383
Energy: 0.8935031928729893
Energy: 0.8593055724241101
Energy: 0.8209049234530087
Energy: 0.8647593519157588
Energy: 0.883233078130547
Energy: 0.8755002112000829
Energy: 0.827888503733512
Energy: 1.0191121421848315
Energy: 0.9251767189470655
Energy: 0.7951835818003653
Energy: 0.8594107900739303
Energy: 0.8233067202097779
Energy: 1.0205182090200253
Energy: 0.921992129133077
Energy: 0.8943015702553676
Energy: 0.8759986197514056
Energy: 0.8541887203772521
Energy: 1.0184885895976648
Energy: 0.9058824441217954
Energy: 0.8917763666509828
Energy: 0.8534784285397711
Energy: 0.8558926488694723
Energy: 0.8593064243998993
Energy: 0.9208107778152401
Energy: 0.9069820988936648
Energy: 0.8752861117410713
Energy: 0.930639336349896
Energy: 0.8777251968389654
Energy: 0.9304070673989088
Energy: 0.9119533848912933
Energy: 0.8479849042213535
Energy: 0.9246068222551499
Energy: 0.8849012523920466
Energy: 0.8502278699212009
Energy: 0.8795959854513274
Energy: 0.8821873555681863
Energy: 0.9229831143213721
Energy: 1.0171420943700404
Energy: 1.01723233590521
Energy: 0.845760134338932
Energy: 0.8833395625386765
Energy: 0.8710288615059841
Energy: 1.0171202713989538
Energy: 1.0185045465464893
Energy: 0.8775274943173517
Energy: 0.878147497514183
Energy: 0.8750170912711454
Energy: 0.8078618579294982
Energy: 0.8753152026712676
Energy: 0.8797154699720391
Energy: 0.8781802109065335
Energy: 0.8571835074323731
Energy: 0.8692995117393773
Energy: 0.8993890475940486
Energy: 0.9145495787392137
Energy: 0.8862833176305327
Energy: 0.8634720630796667
Energy: 0.8202302494754449
Energy: 1.0089521610256809
Energy: 0.9577196626052739
Energy: 0.905355772812815
Energy: 0.8650830080271875
Energy: 0.7967549912024088
Energy: 1.0541177912019573
Energy: 0.9281320517385694
Energy: 0.9254403432992628
Energy: 0.8600697886587891
Energy: 0.8679807703295053
Energy: 0.9045809003876631
Energy: 0.9350085781736718
Energy: 0.9161857727231703
Energy: 0.7988646492537136
Energy: 0.8688570923373683
Energy: 0.8918927787415531
Energy: 0.9497852753869104
Energy: 0.8979853788717297
Energy: 0.8869435183596114
Energy: 0.9091593615348937
Energy: 0.8834986177290115
Energy: 0.8679000407252193
Energy: 0.821221105750696
Energy: 0.8701068869704645
Energy: 0.9056541270750659
Energy: 0.8214711950617757
Energy: 0.9192260300892179
Energy: 0.8922809727841889
Energy: 0.8851193716430261
Energy: 0.9253408708692057
Energy: 0.8905432851567242
Energy: 0.9034530427291848
Energy: 0.851004543335416
Energy: 0.8869742726135312
Energy: 0.8887252593775202
Energy: 0.8900257043966948
Energy: 0.8751316494481683
Energy: 0.9289990004609272
Energy: 0.8887367203796568
Energy: 0.8649580006719567
Energy: 0.8085550553515491
Energy: 0.8733554522133462
Energy: 0.8187875664940907
Energy: 0.8279678771060839
Energy: 0.8489463704762947
Energy: 0.8298267718568704
Energy: 0.8483172511360727
Energy: 0.9524953862293496
Energy: 0.9250497736176104
Energy: 0.8602204803670392
Energy: 0.8065416919508741
Energy: 1.070585871212638
Energy: 0.9509229605959453
Energy: 0.8752387434765929
Energy: 0.8647037139174019
Energy: 0.810976097665584
Energy: 1.074669197390747
Energy: 0.9445937503996735
Energy: 0.9445338527538588
Energy: 0.8072180959244537
Energy: 0.8599741283958624
Energy: 0.9415851966901307
Energy: 0.9647066920921522
Energy: 0.9350325624982334
Energy: 0.8111162325438935
Energy: 0.8641255715940809
Energy: 0.9404460905846828
Energy: 0.9264701077917434
Energy: 0.943133537442827
Energy: 0.8485463039081124
Energy: 0.9143591181142225
Energy: 0.8859866069436122
Energy: 0.8968895148358343
Energy: 0.8380063812487072
Energy: 0.8377684042976168
Energy: 0.8274917107854157
Energy: 0.8838124595009219
Energy: 0.8833969054476034
Energy: 0.8750681564703584
Energy: 0.8763140149443616
Energy: 0.9177478578849523
Energy: 0.8895418787040414
Energy: 0.8995870573819815
Energy: 0.8768700361397068
Energy: 0.8749299100938012
Energy: 0.9036280916592132
Energy: 0.8844029445954488
Energy: 0.8471834814653908
Energy: 0.877029716588543
Energy: 0.8586162065446626
Energy: 0.8510939520709261
Energy: 0.8655244202143707
Energy: 0.8646374140067684
Energy: 0.8316070663857125
Energy: 0.8343490185114414
Energy: 0.9168182015211278
Energy: 0.8376699569032604
Energy: 0.9210798996039266
Energy: 0.9288261153089586
Energy: 1.0100473708671218
Energy: 0.8564191754040371
Energy: 0.8699401189574776
Energy: 1.0505227939676545
Energy: 0.9495004242231533
Energy: 1.0468258198085398
Energy: 0.8794639232481536
Energy: 1.0258235674848577
Energy: 0.9013896597103179
Energy: 0.9676266179108756
Energy: 0.8193927950111941
Energy: 0.8124894151635155
Energy: 0.8548246369473786
Energy: 0.9066934573796415
Energy: 0.9421321587006029
Energy: 0.8363188683810796
Energy: 0.7944202088209739
Energy: 0.8310227487093886
Energy: 0.8837887781404523
Energy: 0.9080770444090062
Energy: 0.844857486065523
Energy: 0.8004406505503812
Energy: 0.9198290092686023
Energy: 0.8843379315729204
Energy: 0.9229069038548993
Energy: 0.9020225532752273
Energy: 0.8601900760654324
Energy: 0.8358289405352483
Energy: 0.884167992982764
Energy: 0.9176643327849129
Energy: 0.8752532638337469
Energy: 0.8769151129011697
Energy: 0.9259034894318935
Energy: 0.8848707824565131
Energy: 0.8817055193138457
Energy: 0.8765314924904173
Energy: 0.8724732473278745
Energy: 0.9144116923027736
Energy: 0.8771714699183737
Energy: 0.9127805331359441
Energy: 0.7843645610739174
Energy: 0.8237065835936563
Energy: 0.8974270246496644
Energy: 0.9077148156632241
Energy: 0.9172719151328647
Energy: 0.8348018769058179
Energy: 0.879474715837461
Energy: 0.9437191666602434
Energy: 0.8576140137015176
Energy: 0.9292275463620429
Energy: 0.9239817590464593
Energy: 1.0473012673552324
Energy: 0.8669887518150103
Energy: 0.869458397324906
Energy: 0.9049299422126009
Energy: 0.9392747326105113
Energy: 0.9906411487497853
Energy: 0.8719114249986412
Energy: 0.9232700021010569
Energy: 0.9202109834173688
Energy: 0.9462476816736077
Energy: 0.8901326262127122
Energy: 0.8149847147365616
Energy: 0.8318161473951243
Energy: 0.8884974273029576
Energy: 0.9393261151269261
Energy: 0.8952670611690496
Energy: 0.8451267428840128
Energy: 0.9113816500940416
Energy: 0.8905898006109199
Energy: 0.857460956937311
Energy: 0.8539077975767959
Energy: 0.8346657121523803
Energy: 0.8016530523575998
Energy: 0.8919312720164304
Energy: 0.8639639342631799
Energy: 0.8697862229346739
Energy: 0.8612291743950091
Energy: 0.9369275863074726
Energy: 0.9038763693878058
Energy: 0.9275283585555796
Energy: 0.8865532051305833
Energy: 0.9016622539097069
Energy: 0.8495460611044162
Energy: 0.9020530178094821
Energy: 0.8978613724041242
Energy: 0.8853635274885187
Energy: 0.8913649551593203
Energy: 0.8209808960570752
Energy: 0.7777279256860654
Energy: 0.9334225516450875
Energy: 0.8927060033513369
Energy: 0.8548889427670984
Energy: 0.8418157423900683
Energy: 1.006124619857416
Energy: 0.922315245137123
Energy: 0.9035475216781799
Energy: 0.8538609324016798
Energy: 1.407198867191742
Energy: 1.0449355079767342
Energy: 0.9204832851559052
Energy: 0.9186566228803514
Energy: 0.9907221860659233
Energy: 0.8456662206071293
Energy: 0.9012424284321381
Energy: 0.918724820228623
Energy: 0.9230600127604709
Energy: 0.9887305444583049
Energy: 0.869977144425851
Energy: 0.8530405627172465
Energy: 0.9167856707381989
Energy: 0.919420020630436
Energy: 0.910138927500641
Energy: 0.933936502700651
Energy: 0.8561850354867265
Energy: 0.9174882070026488
Energy: 0.9169079853878978
Energy: 0.8514218874546962
Energy: 0.9032042452536329
Energy: 1.018531028710809
Energy: 0.8782764020479215
Energy: 0.8510423992557503
Energy: 0.8773671096948913
Energy: 0.8980979116179655
Energy: 1.0171455876731843
Energy: 0.8783813040442973
Energy: 0.8843483146840092
Energy: 0.8790660919412572
Energy: 0.8939129295296505
Energy: 0.8517497332343452
Energy: 0.876728570973763
Energy: 0.9151480625917531
Energy: 0.8839491681493628
Energy: 0.8764572090602385
Energy: 0.8309358333536185
Energy: 0.8725536957902261
Energy: 0.9078130326867045
Energy: 0.8831939052623562
Energy: 0.9236339178154801
Energy: 0.8383103377807875
Energy: 1.0271898781883646
Energy: 0.9382651067572249
Energy: 0.9024187218699837
Energy: 0.8181646327260363
Energy: 0.8125754002437835
Energy: 1.0482638013441778
Energy: 0.9188982953531697
Energy: 0.9172761878203354
Energy: 0.8582472430076362
Energy: 0.8557863216759871
Energy: 1.0407338950580716
Energy: 0.9185626891421987
Energy: 0.9152743590757013
Energy: 0.887237491516792
Energy: 0.8601437734432075
Energy: 0.9078409500883009
Energy: 0.9142334088329002
Energy: 0.9174872634171222
Energy: 0.8772304041433691
Energy: 0.8729717735713204
Energy: 0.8818668518907095
Energy: 0.8391163293514169
Energy: 0.9164479721765239
Energy: 0.8824680340922311
Energy: 0.9097484973076303
Energy: 0.8235393405527134
Energy: 0.8928143977497132
Energy: 0.9336054680528372
Energy: 0.8825023030291405
Energy: 0.8937104488451414
Energy: 1.0169304163321604
Energy: 1.0173562138712144
Energy: 0.8534199136154812
Energy: 0.8833951024423367
Energy: 0.9100719967003335
Energy: 1.0174271807959698
Energy: 1.018124119388596
Energy: 0.8362974239459082
Energy: 0.8780892776539454
Energy: 0.8333363054313482
Energy: 0.8124751115010534
Energy: 0.8764054143243862
Energy: 0.909016143339313
Energy: 0.8780557796651276
Energy: 0.8758717281779304
Energy: 0.8167207995852165
Energy: 0.8448602464046028
Energy: 0.8856072486530562
Energy: 0.9141109156498759
Energy: 0.8797504127601126
Energy: 0.794476703986213
Energy: 1.06353866759919
Energy: 0.9543338661985703
Energy: 0.9102331413539066
Energy: 0.8552395932904626
Energy: 0.8123265533711153
Energy: 0.9308202169937511
Energy: 0.9326330065357342
Energy: 0.9259533356254817
Energy: 0.7953716124069454
Energy: 0.8817410634963875
Energy: 0.9095624409151185
Energy: 0.9441985862637906
Energy: 0.9109179339801309
Energy: 0.8208626627686869
Energy: 0.8544241497375865
Energy: 0.9236988138950414
Energy: 0.9291616254501102
Energy: 0.8478169703045013
Energy: 0.8373086248757419
Energy: 0.9068997349431932
Energy: 0.8376438204223197
Energy: 0.8252210775096948
Energy: 0.8546413908488801
Energy: 0.8296951412085217
Energy: 0.923310587878211
Energy: 0.8625620922804329
Energy: 0.9325503964972847
Energy: 0.8381147102926712
Energy: 0.8852543464810112
Energy: 0.8880013664657658
Energy: 0.8903419920647153
Energy: 0.9065154799137912
Energy: 0.8634727533108908
Energy: 0.8870134728065365
Energy: 0.9127716865220553
Energy: 0.8901644888101545
Energy: 0.9106664982224811
Energy: 0.8981357805239406
Energy: 0.8322379344146935
Energy: 0.8668064636218548
Energy: 0.8449311925368278
Energy: 0.8380228559844457
Energy: 0.9395421135996677
Energy: 0.8901833856971746
Energy: 0.9043988956333717
Energy: 0.8613062408204407
Energy: 0.9186648425421652
Energy: 0.9573727629647285
Energy: 0.9242609073696669
Energy: 0.8647788774668925
Energy: 0.8107968942568237
Energy: 1.0616186579763853
Energy: 1.086821334397514
Energy: 0.9393820726217088
Energy: 0.861486663234826
Energy: 0.8110044526793863
Energy: 1.0840900529709578
Energy: 0.9514364652050821
Energy: 0.9428068866294718
Energy: 0.8116306558489148
Energy: 0.8640839509634585
Energy: 0.8550292729792928
Energy: 0.9536672465179921
Energy: 0.9460467726469906
Energy: 0.7991863453431713
Energy: 0.8599957906773001
Energy: 0.9286985536919029
Energy: 0.9361726645894862
Energy: 0.8517225535215807
Energy: 0.8374005600748894
Energy: 0.8891092059273855
Energy: 0.8851134388691615
Energy: 0.9089778850558634
Energy: 0.9294717701092449
Energy: 0.842114786862751
Energy: 0.8449460241417804
Energy: 0.8838427768719566
Energy: 0.8917987776381416
Energy: 0.875112918714389
Energy: 0.8763334515715527
Energy: 0.9083932353182274
Energy: 0.8893940464731952
Energy: 0.896357752827651
Energy: 0.8768243742531776
Energy: 0.8749850959514806
Energy: 0.9264804549955354
Energy: 0.8843308592614916
Energy: 0.9054722485729935
Energy: 0.8211492019111639
Energy: 0.8266588803156616
Energy: 0.9063276423955405
Energy: 0.8542330238997528
Energy: 0.8531697412676115
Energy: 0.8594366528125292
Energy: 0.8888277344179943
Energy: 0.9251317451120576
Energy: 0.8838954812441706
Energy: 0.9274325998994033
Energy: 0.9332866913757395
Energy: 1.028931777560784
Energy: 0.869387362565282
Energy: 0.8654468131906762
Energy: 1.0234569403431193
Energy: 0.9429958492224443
Energy: 1.0276308751178687
Energy: 0.8507270577078293
Energy: 0.8628238493173432
Energy: 0.9006373128520313
Energy: 0.9335472149141104
Energy: 0.9229019764785856
Energy: 0.7966728452559625
Energy: 0.867128553620685
Energy: 0.9151951518280839
Energy: 0.9384054177284575
Energy: 0.8882906725512633
Energy: 0.8161897298198687
Energy: 0.8283002950309116
Energy: 0.883928659707766
Energy: 0.9134553447503064
Energy: 0.8989056149026403
Energy: 0.8555908854298738
Energy: 0.8798114398001604
Energy: 0.8844272309461263
Energy: 0.9051324747924768
Energy: 0.874589136638813
Energy: 0.8755602394126853
Energy: 0.8249362189493431
Energy: 0.8840068954576953
Energy: 0.876845463080308
Energy: 0.8752494448876007
Energy: 0.8769971841944434
Energy: 0.881573447918615
Energy: 0.8847754730798572
Energy: 0.9035912708623266
Energy: 0.8768119236870217
Energy: 0.87248727742358
Energy: 0.9205741197527585
Energy: 0.873355225026257
Energy: 0.920002007371599
Energy: 0.8811334939632008
Energy: 0.8724922366917168
Energy: 0.9034575302124034
Energy: 0.8553666225458603
Energy: 0.9196823953807419
Energy: 0.897259925031454
Energy: 0.8740638526426342
Energy: 0.9190320989083333
Energy: 0.8768348309274443
Energy: 0.89331630311455
Energy: 0.9442510810673536
Energy: 0.9955911672559226
Energy: 0.8584979637310962
Energy: 0.8551441402210949
Energy: 0.8890794110076331
Energy: 0.9056123554831108
Energy: 0.9981703999367859
Energy: 0.8368922910616049
Energy: 0.8752980025696354
Energy: 0.9152652156232817
Energy: 0.9187077713811042
Energy: 0.8699097245404476
Energy: 0.8134736879279126
Energy: 0.8592771338124799
Energy: 0.795775745574565
Energy: 0.9226215885781234
Energy: 0.8882604659310168
Energy: 0.8344458458741029
Energy: 0.9420749200312909
Energy: 0.8902089856043193
Energy: 0.8198330850952471
Energy: 0.8195193462875494
Energy: 0.8590681397371798
Energy: 0.8969450527461239
Energy: 0.8917368444082272
Energy: 0.8749133455417786
Energy: 0.8898686553496583
Energy: 0.861634723773052
Energy: 0.8983638444139892
Energy: 0.885927238153422
Energy: 0.8906840328170472
Energy: 0.8865054091329586
Energy: 0.8212775003703121
Energy: 0.8472576947007251
Energy: 0.9021129394280101
Energy: 0.9137696892196527
Energy: 0.8853239195221261
Energy: 0.847934234023708
Energy: 0.8630692356048612
Energy: 0.8881406132811944
Energy: 0.8995041858803435
Energy: 0.888793397006028
Energy: 0.8211612890975002
Energy: 0.7987736767703646
Energy: 0.993117128348059
Energy: 0.8790553698323998
Energy: 0.8774488343773975
Energy: 0.8477342765805588

minimum gb energy = 0.7777279256860654 eV
minimum distance =  2.2791596417413 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

Energy: 1.5768444455239676
Energy: 0.8658980056370055
Energy: 0.8733004676195586
Energy: 0.8574635293802283
Energy: 0.9447822609989655
Energy: 0.9432351772631944
Energy: 0.856670768889826
Energy: 0.8732786961431401
Energy: 0.8567640714978932
Energy: 0.9495891435243685
Energy: 0.894803270536009
Energy: 0.9263565364003858
Energy: 0.8851550987960402
Energy: 0.8586001464909487
Energy: 0.8784853685225235
Energy: 0.8907468672272892
Energy: 0.9244816748956887
Energy: 0.8884733299815092
Energy: 0.8747789584281431
Energy: 0.9008080126079231
Energy: 0.8988819047816295
Energy: 0.9535286363281098
Energy: 0.9600711403644479
Energy: 0.8671475016463889
Energy: 0.9109015062686995
Energy: 0.902838680438378
Energy: 0.9570730055954927
Energy: 0.9623910163178265
Energy: 0.9353415813204565
Energy: 0.9123076667200007
Energy: 0.9752507752505777
Energy: 0.8853689961941922
Energy: 0.8885894439583066
Energy: 0.9031010304361864
Energy: 0.891896203986139
Energy: 0.9524628955017376
Energy: 0.890391108470302
Energy: 0.9029357509208749
Energy: 0.9023723850126784
Energy: 0.9106639449746579
Energy: 0.9083240342981963
Energy: 0.8713697265513402
Energy: 0.883899210269542
Energy: 0.8871337346986373
Energy: 0.8478018727024291
Energy: 0.8562736847571915
Energy: 0.8712050823827179
Energy: 0.890110335651287
Energy: 0.8884061318507036
Energy: 0.882673084935332
Energy: 0.9035382891463415
Energy: 0.9537787635905571
Energy: 0.8755132189298757
Energy: 0.8843368792930161
Energy: 0.8486288710673112
Energy: 0.9620948388014897
Energy: 0.9027763304245873
Energy: 0.8824703978406271
Energy: 0.8883716221278374
Energy: 0.8815342305521414
Energy: 0.9264453873300222
Energy: 0.9345636991111347
Energy: 0.9342749386277184
Energy: 0.8472043116447694
Energy: 0.8813341361772583
Energy: 0.8569043567159508
Energy: 0.9754980892403583
Energy: 0.934348493473383
Energy: 0.8875830613464928
Energy: 0.8850197959633676
Energy: 0.9159970994850795
Energy: 0.9160921669976667
Energy: 0.967485411242401
Energy: 0.9649674046807813
Energy: 0.9425230378176286
Energy: 0.8728033437759772
Energy: 0.9101980879632022
Energy: 0.9793157086358552
Energy: 0.959357821242304
Energy: 0.9053436571768562
Energy: 0.8818952008763093
Energy: 0.9473915529874467
Energy: 0.904758786331561
Energy: 0.9208210914649567
Energy: 0.9193141205363262
Energy: 0.9105100925995431
Energy: 0.9735233444173974
Energy: 0.8972083318379356
Energy: 0.920047779169393
Energy: 0.9243292139818882
Energy: 0.9016937376052656
Energy: 0.9047870540449435
Energy: 0.861995891999132
Energy: 0.9194231616926746
Energy: 0.9362456334759358
Energy: 0.8704142556618137
Energy: 0.9019990411077699
Energy: 0.8678669958014988
Energy: 0.9194333872535603
Energy: 0.9384880852501044
Energy: 0.8978895200916646
Energy: 0.9523630726307785
Energy: 0.9534998793512671
Energy: 0.8924372391252529
Energy: 0.8839806287014652
Energy: 0.8927724897924968
Energy: 0.8706129638319593
Energy: 0.9358491712682729
Energy: 0.8973401302049586
Energy: 0.9826337202649231
Energy: 0.9215441673750335
Energy: 0.8840866824243055
Energy: 0.9482696162609571
Energy: 0.9387811636590896
Energy: 0.9205440087116236
Energy: 0.9307106608246315
Energy: 0.883045775937439
Energy: 0.9509350352622329
Energy: 0.9389373614756061
Energy: 0.9158752946102042
Energy: 0.9501365065650079
Energy: 0.8682469273593317
Energy: 0.9356130793326516
Energy: 0.9469634517485591
Energy: 0.9386446400407833
Energy: 0.9186138882596202
Energy: 0.8777190900221895
Energy: 0.9194613837090402
Energy: 0.9430545873231354
Energy: 0.9358303357051828
Energy: 0.9312368359828451
Energy: 0.9347293848455203
Energy: 0.9291477725780978
Energy: 0.8856578341936864
Energy: 0.9313014672655359
Energy: 0.9546399686396114
Energy: 0.934697820427026
Energy: 0.9312722794239223
Energy: 0.885010171177567
Energy: 0.9302049185243093
Energy: 0.9324262194635298
Energy: 0.9318703330236975
Energy: 0.951879104144706
Energy: 0.8849905475760534
Energy: 0.9290713053352799
Energy: 0.9727793931329172
Energy: 0.9493668407692285
Energy: 0.9528625264420106
Energy: 0.885727593130445
Energy: 0.9306668387141145
Energy: 1.1390005170203763
Energy: 0.9719281092089395
Energy: 0.8739737026529536
Energy: 0.8900664087961995
Energy: 0.9571614825434253
Energy: 0.9769864853219747
Energy: 0.9559571728017936
Energy: 0.8783188373405613
Energy: 0.8951547233314809
Energy: 0.9726399182118606
Energy: 0.8789022082938812
Energy: 0.9464179511217209
Energy: 0.8707297818526883
Energy: 0.879877446935847
Energy: 0.900308753341621
Energy: 0.8893530543952235
Energy: 0.9323692957762013
Energy: 0.8537007441766331
Energy: 0.881562737345849
Energy: 0.9020665203978854
Energy: 0.8751939887604849
Energy: 0.9571996339673733
Energy: 0.9238401992374343
Energy: 0.8759340352747582
Energy: 0.8844919610757365
Energy: 0.8752029835996838
Energy: 0.9532917932766317
Energy: 0.8530575656592436
Energy: 0.8753179313066904
Energy: 0.8854286924556607
Energy: 0.888132932815907
Energy: 0.8954613350447317
Energy: 0.8600639109666949
Energy: 0.900140998929307
Energy: 0.89686858508595
Energy: 0.8788454872703216
Energy: 0.865545351811945
Energy: 0.867449833345778
Energy: 0.8883783830695666
Energy: 0.9010808361190231
Energy: 0.892372236034061
Energy: 0.8721712275205274
Energy: 0.9177636833904962
Energy: 0.9134917112238571
Energy: 0.9203721714804504
Energy: 0.892253676197981
Energy: 0.8617532412552555
Energy: 0.9646725528762229
Energy: 0.9138490275130142
Energy: 0.926777840910219
Energy: 0.9135499281095811
Energy: 0.9480634286070494
Energy: 0.9652269126883588
Energy: 0.8927099588720366
Energy: 0.8762458534639975
Energy: 0.8669583693245884
Energy: 0.890919979377904
Energy: 0.8932891932020195
Energy: 0.8823538724284005
Energy: 0.9005358183533217
Energy: 0.8883065368689014
Energy: 0.8869876710038052
Energy: 0.8953816108238528
Energy: 0.8974140060262777
Energy: 0.8878607794684606
Energy: 0.8703011728635857
Energy: 0.8865609680368896
Energy: 0.879514462765648
Energy: 0.8975253185082421
Energy: 0.8975346277596328
Energy: 0.8899833155579658
Energy: 0.885245200049069
Energy: 0.9645923326133531
Energy: 0.9617473142390109
Energy: 0.8867289575862416
Energy: 0.8878049508898953
Energy: 0.8667566438149558
Energy: 0.964521812587809
Energy: 0.9629365585778633
Energy: 0.888361946803047
Energy: 0.8880681411978939
Energy: 0.8891900025419176
Energy: 0.8898750257957889
Energy: 0.9223580389433287
Energy: 0.8676872909692226
Energy: 0.885919502181179
Energy: 0.867717515677444
Energy: 0.9136468510008897
Energy: 0.8952003024051155
Energy: 0.898019875011009
Energy: 0.9674796869553056
Energy: 0.8952332411076455
Energy: 0.882753362110698
Energy: 0.9557048179620655
Energy: 0.9341412321116437
Energy: 0.9574707427964928
Energy: 0.912447594086067
Energy: 0.881947193354928
Energy: 0.9598101964689544
Energy: 1.0567305174857469
Energy: 0.9183820636220759
Energy: 0.890944871398546
Energy: 0.8954751215938486
Energy: 0.8944844249524964
Energy: 0.9580434042943987
Energy: 0.9183377294148312
Energy: 0.8924227331682182
Energy: 0.889203721487049
Energy: 0.9204973390596869
Energy: 0.9210187271195349
Energy: 0.9191004456120972
Energy: 0.9380244477695835
Energy: 0.9149161424634342
Energy: 0.9139879696015113
Energy: 0.9536869267707367
Energy: 0.9193073327951612
Energy: 0.8986161258548533
Energy: 0.8855239511368104
Energy: 0.914528739007181
Energy: 0.9196082236040164
Energy: 0.9245435466751131
Energy: 0.9332204147948573
Energy: 0.9016551186484063
Energy: 0.8852700484413579
Energy: 0.9638674384671189
Energy: 0.937546149265982
Energy: 0.9024229190909525
Energy: 0.8887694097192083
Energy: 0.8855886197197144
Energy: 0.9590295184296078
Energy: 0.8815610451823048
Energy: 0.9395579414927961
Energy: 0.9317307293137943
Energy: 0.8793697156287448
Energy: 0.9453189225280393
Energy: 0.8641275564813872
Energy: 0.9193976145096132
Energy: 0.8987787477491351
Energy: 0.882361357961016
Energy: 0.9374370188937138
Energy: 1.0433098768690585
Energy: 0.9349045473642055
Energy: 0.9490016362659247
Energy: 0.8895145877997886
Energy: 0.9313706572102676
Energy: 0.9437896132044384
Energy: 0.9189824587497181
Energy: 0.9434983350715171
Energy: 0.8891584343150845
Energy: 0.935162099634542
Energy: 0.941399699486023
Energy: 0.9317307013270228
Energy: 0.8808237511173302
Energy: 0.9497534005734609
Energy: 0.9231527970227645
Energy: 0.9368485494249602
Energy: 0.9302524673315207
Energy: 0.86862381590931
Energy: 0.9258886196139148
Energy: 0.9411637771230754
Energy: 0.9364375877266244
Energy: 0.9282620349821104
Energy: 0.8865192743030766
Energy: 0.9616917768648533
Energy: 0.9576828653206135
Energy: 0.9188828531481277
Energy: 0.9310472932892276
Energy: 0.8886356679851378
Energy: 0.9489170205854399
Energy: 0.904017792691462
Energy: 0.9691217098688422
Energy: 0.9520746437870202
Energy: 0.9601046988883257
Energy: 0.9484912165356005
Energy: 0.9061600994741339
Energy: 0.9550372434317034
Energy: 0.9522245196714281
Energy: 0.957350409464465
Energy: 0.9611734548897611
Energy: 0.9489100117504143
Energy: 0.8884273542739735
Energy: 0.9009211286782447
Energy: 0.9393802728251374
Energy: 0.9806335061515459
Energy: 0.8534609812904159
Energy: 0.8808680831040632
Energy: 0.8899094506798283
Energy: 0.9448264389207013
Energy: 0.9279450536011552
Energy: 0.9092482219528945
Energy: 0.875925197766728
Energy: 0.8857400550566871
Energy: 0.8756639776232339
Energy: 0.9442892058935786
Energy: 0.9416489675729794
Energy: 0.8758512660520218
Energy: 0.8817866713875239
Energy: 0.875763149773552
Energy: 0.9371135430804889
Energy: 0.941837449950658
Energy: 0.8765676605840917
Energy: 0.8967616709855325
Energy: 0.8783446441152858
Energy: 0.840996121281435
Energy: 0.9315172861047255
Energy: 0.8764026211669911
Energy: 0.9012288362539683
Energy: 0.8894635339567345
Energy: 0.8515406319006364
Energy: 0.9518888878404723
Energy: 0.9649643300558288
Energy: 0.8771958364812116
Energy: 0.8901210892061677
Energy: 0.8600535491993435
Energy: 0.979398910161563
Energy: 0.8819274291957951
Energy: 0.9012021173293991
Energy: 0.8981436584232225
Energy: 0.8918199804897751
Energy: 0.9777643173110954
Energy: 0.944651723448917
Energy: 0.9707211377638336
Energy: 0.8673241398073469
Energy: 1.0239140768141126
Energy: 0.8916294643701436
Energy: 0.9135066615924348
Energy: 0.8911061796462332
Energy: 0.8679091896316853
Energy: 0.9679439375595911
Energy: 0.8769004488903788
Energy: 0.9443594840230892
Energy: 0.8894923197819161
Energy: 0.8581270425156514
Energy: 0.9244277562243512
Energy: 0.9254151505344992
Energy: 0.9415760627965992
Energy: 0.8906584154667887
Energy: 0.8757128488056102
Energy: 0.9208146659168996
Energy: 0.8952630146007894
Energy: 0.908599283514165
Energy: 0.8842246451932457
Energy: 0.8839276045523746
Energy: 0.8675493650174737
Energy: 0.9595603624507879
Energy: 0.9053415881703537
Energy: 0.8858904016643393
Energy: 0.8857560034019615
Energy: 0.8880857763145039
Energy: 0.9433868310310042
Energy: 0.9191021317519356
Energy: 0.8680259239551971
Energy: 0.8856607590065075
Energy: 0.8921764200425082
Energy: 0.8778455155762495
Energy: 0.9198240528054736
Energy: 0.8877550223461942
Energy: 0.8876828060780432
Energy: 0.8891299042525767
Energy: 0.9151807690527889
Energy: 0.9092783395467667
Energy: 0.8962365636586972
Energy: 0.9431101931908358
Energy: 0.9422596966398585
Energy: 0.9148994535699251
Energy: 0.8876991829869892
Energy: 0.8856566888881429
Energy: 0.9085141495244416
Energy: 0.9424943071523071
Energy: 0.912542350886152
Energy: 0.8945522776685849
Energy: 0.9205278810226473
Energy: 0.9192240267972616
Energy: 0.8619839167057411
Energy: 0.8642642211165904
Energy: 0.8761135616375997
Energy: 0.9245510579073238
Energy: 0.919422336165952
Energy: 0.8739360328460355
Energy: 0.9683880816090183
Energy: 0.9165249665126566
Energy: 0.9205338189236008
Energy: 0.9345453995369032
Energy: 0.8774808439732132
Energy: 0.9541207016572474
Energy: 0.8579037047306166
Energy: 0.9210201444916629
Energy: 0.9347170733216059
Energy: 0.9019390690593408
Energy: 0.9731622252171009
Energy: 0.938436946444464
Energy: 0.9254868180459488
Energy: 0.9267954692998166
Energy: 0.8930211006724116
Energy: 0.9704042404999067
Energy: 0.954687613901126
Energy: 0.925262044343533
Energy: 0.926969937643095
Energy: 0.9175727168732833
Energy: 0.9672013621987801
Energy: 0.9257265475336507
Energy: 0.9299069155845181
Energy: 0.8873626595977904
Energy: 0.9239540317483957
Energy: 0.9196340232702689
Energy: 0.9427748576102578
Energy: 0.9337600976218156
Energy: 0.8788362504436367
Energy: 0.9244009842020645
Energy: 0.954148834838587
Energy: 0.9160882862858026
Energy: 0.9367048829128574
Energy: 0.922011849772744
Energy: 0.9291137577689603
Energy: 0.9341412129747916
Energy: 0.9347565292157053
Energy: 0.9289495180083143
Energy: 0.9291364406097105
Energy: 0.9488064887135953
Energy: 0.8855104945508059
Energy: 0.9645045870484726
Energy: 0.8837647728656327
Energy: 0.938063895140791
Energy: 0.9381948767935233
Energy: 0.8614535978390673
Energy: 0.9290931664405934
Energy: 0.8476863672501119
Energy: 0.934850626520601
Energy: 0.9342429870817434
Energy: 0.9027559543164339
Energy: 0.9917918754284892
Energy: 0.882086786322291
Energy: 0.9240893812777216
Energy: 0.9247130962884162
Energy: 0.8710304188011324
Energy: 0.9379591673424587
Energy: 0.8796245183414737
Energy: 0.9258095858241422
Energy: 0.930339993283805
Energy: 0.9198456875132562
Energy: 0.9570654741137097
Energy: 0.9532693067434491
Energy: 0.9453452273345846
Energy: 0.9666395546159655
Energy: 0.9691236119694002
Energy: 0.8723108689078586
Energy: 0.953054771251399
Energy: 0.9537297633588278
Energy: 0.9649319014607006
Energy: 0.9692512882334211
Energy: 0.9338414931825876
Energy: 0.8769190774152692
Energy: 0.8714150653842245
Energy: 0.8706081572336658
Energy: 0.9481094788755814
Energy: 0.853796179000539
Energy: 0.8867545551459305
Energy: 0.858964627805806
Energy: 0.8557357886306719
Energy: 0.9472065368055992
Energy: 0.869361305150676
Energy: 0.8568561316457931
Energy: 0.8581915713925741
Energy: 0.8564374135988758
Energy: 0.8564329722513051
Energy: 0.851821677001592
Energy: 0.8577441222768218
Energy: 0.8701125502298797
Energy: 0.856443806645818
Energy: 0.9530383756622878

minimum gb energy = 0.840996121281435 eV
minimum distance =  2.2852646119926 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.1901277857393737
Energy: 0.8780718085878216
Energy: 0.8670003211971814
Energy: 0.905547645450309
Energy: 0.8242190386872877
Energy: 1.1176584611742955
Energy: 0.8736784908792298
Energy: 0.8723686170921473
Energy: 0.914106757692046
Energy: 0.8793706639253122
Energy: 0.8596244671670042
Energy: 0.9185143711057013
Energy: 0.9083201748072631
Energy: 0.9081518548873989
Energy: 0.8972523589618769
Energy: 0.8746233838146402
Energy: 0.8530914272496956
Energy: 0.9145522588371088
Energy: 0.91337553150746
Energy: 0.9583106459150531
Energy: 0.8735423604973238
Energy: 0.950802690234314
Energy: 0.8700319002429274
Energy: 0.8769378634625133
Energy: 0.9118606931203915
Energy: 0.8634970625463801
Energy: 0.8737447820950196
Energy: 0.9132281766716426
Energy: 0.9132685357532899
Energy: 0.9781967883210914
Energy: 0.866300758102265
Energy: 0.9042698823777798
Energy: 0.917793981523791
Energy: 0.9068474489541584
Energy: 0.8683239885536619
Energy: 0.9395165156952157
Energy: 0.9139195547823195
Energy: 0.8738605927598648
Energy: 0.8716280364427345
Energy: 0.9108720653317136
Energy: 0.9493708165885519
Energy: 0.8712542095619329
Energy: 0.9134380365135288
Energy: 0.9094786496222664
Energy: 0.8522361289794591
Energy: 0.9182285826478769
Energy: 0.8733681655698029
Energy: 0.8735145315883637
Energy: 0.9101280005198452
Energy: 0.9093046464455578
Energy: 0.9110932747002839
Energy: 0.8812678073858075
Energy: 0.9385389983582056
Energy: 0.8658593659037102
Energy: 0.8670863359380292
Energy: 0.911222145463774
Energy: 0.8812737115740339
Energy: 0.8675687756404309
Energy: 0.863758413569841
Energy: 0.9403701368129154
Energy: 0.9087786986185284
Energy: 0.9369568825625615
Energy: 0.9450664435804075
Energy: 0.9109323364838678
Energy: 0.8669096916217143
Energy: 0.8994441840465378
Energy: 0.9551712297875395
Energy: 0.9476299375825806
Energy: 0.9027871508949245
Energy: 0.8662253071418912
Energy: 0.907885848502239
Energy: 0.943089497239334
Energy: 0.9391938841327494
Energy: 0.9405204413985863
Energy: 0.9129289912939316
Energy: 0.8284500880217462
Energy: 0.9304522339747605
Energy: 0.9418319124942778
Energy: 0.9415774263228605
Energy: 0.8271591124856801
Energy: 0.829505308977544
Energy: 0.8611253636935671
Energy: 0.9052415772309973
Energy: 0.9421171583988783
Energy: 0.933004774421111
Energy: 0.8297373536462967
Energy: 0.8533832012144933
Energy: 0.9044048374979583
Energy: 0.9390294080728592
Energy: 0.9039149878201935
Energy: 0.9572559554161468
Energy: 0.8873894041052636
Energy: 0.9482395382395494
Energy: 0.9499219568530445
Energy: 0.9367141499833667
Energy: 0.9282636278887972
Energy: 0.8671259800167992
Energy: 0.8988754272717056
Energy: 0.947698978618934
Energy: 0.9394694088183577
Energy: 0.9464490104924408
Energy: 0.9608583836890098
Energy: 0.8882414452212778
Energy: 0.9459609723516568
Energy: 0.9061458656250784
Energy: 0.9480048386719968
Energy: 0.9236744081163355
Energy: 0.919457445405244
Energy: 0.9615158157703844
Energy: 0.9105936910007547
Energy: 0.9484842864309599
Energy: 0.9532981227769525
Energy: 0.9154846770922007
Energy: 0.8614069600182509
Energy: 0.8641808545006224
Energy: 0.9503310390215023
Energy: 0.9044355612565051
Energy: 0.9200371644874887
Energy: 0.9192983253004933
Energy: 0.9225831450597093
Energy: 0.9248618409268253
Energy: 0.8886530039995386
Energy: 0.8508147560371865
Energy: 0.8529786658220645
Energy: 0.8682024982573271
Energy: 0.8832239229572795
Energy: 0.905809248237899
Energy: 0.9157299647053613
Energy: 0.917416681871878
Energy: 0.8813856375324932
Energy: 0.8524603013341097
Energy: 0.8819788305946626
Energy: 0.9023731679023373
Energy: 0.8629717014995784
Energy: 0.8527293394102309
Energy: 0.9014428564365292
Energy: 0.9091071541382169
Energy: 0.8767306767797156
Energy: 0.8631712853160596
Energy: 0.861537549003469
Energy: 0.8597573569649121
Energy: 0.953596263127298
Energy: 0.9070232036302306
Energy: 0.8675303562149759
Energy: 0.8742785115329865
Energy: 0.8721248070201453
Energy: 0.901107791555559
Energy: 0.9132153397172259
Energy: 0.873051842400481
Energy: 0.9176283094391018

minimum gb energy = 0.8242190386872877 eV
minimum distance =  2.29551034717129 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.7530055024248965
Energy: 0.7414919526369113
Energy: 0.7469302705159752
Energy: 0.7546629096907556
Energy: 0.7415895125551957
Energy: 0.7910173789611233
Energy: 0.7456512631616957
Energy: 0.7472865136687706
Energy: 0.7462602280061882
Energy: 0.7974217232964524
Energy: 0.7576561044947476
Energy: 0.7551361578767474
Energy: 0.7519940692029453
Energy: 0.7550499009597331
Energy: 0.7572417079716481
Energy: 0.8079876446019321
Energy: 0.7550758092199261
Energy: 0.7502059535515054
Energy: 0.7490913860208164
Energy: 0.7573936217150632
Energy: 0.776374657476709
Energy: 0.7783560404096278
Energy: 0.7800589159137724
Energy: 0.7784832476511467
Energy: 0.7568402611864272
Energy: 0.7761639357255669
Energy: 0.7774728161177838
Energy: 0.7798955812141292
Energy: 0.7818336539982537
Energy: 0.7567845106693061
Energy: 0.7888711095508127
Energy: 0.7529294944713896
Energy: 0.7815525065105643
Energy: 0.7713256687324354
Energy: 0.9307768405877865
Energy: 0.7896121748563671
Energy: 0.7521366718469561
Energy: 0.7770987845599302
Energy: 0.771989891374973
Energy: 0.9309795778919908
Energy: 0.8001902617311135
Energy: 0.7765097578760992
Energy: 0.7802252301242281
Energy: 0.7913660022636323
Energy: 0.8046884217531072
Energy: 0.7529606801886789
Energy: 0.7794674688553763
Energy: 0.7811561173079418
Energy: 0.8033858215065303
Energy: 0.8027621663629669
Energy: 0.8054558309018892
Energy: 0.791098060548396
Energy: 0.7802585732291659
Energy: 0.7464257821352298
Energy: 0.8124946616756958
Energy: 0.8061984386110481
Energy: 0.778045255797367
Energy: 0.7826686264742178
Energy: 0.7758598727085901
Energy: 0.806947938098864
Energy: 0.8008357218323281
Energy: 0.8018958928176009
Energy: 0.7823099352324194
Energy: 0.7529403559045086
Energy: 0.7993989132410845
Energy: 0.8025682328363022
Energy: 0.8036878324906218
Energy: 0.7819268863272256
Energy: 0.7787827477544348
Energy: 0.7997069884694957
Energy: 0.7486374478425756
Energy: 0.7918730364614178
Energy: 0.7787102621019979
Energy: 0.7525077492690083
Energy: 0.7831464129846859
Energy: 0.7773294700477231
Energy: 0.7763677786911937
Energy: 0.7789806673501252
Energy: 0.7487174963915473
Energy: 0.7927250441760382
Energy: 0.7948022601968302
Energy: 0.7820167251147978
Energy: 0.7576466013279615
Energy: 0.7614215100193624
Energy: 0.7758456027940664
Energy: 0.7515831967199958
Energy: 0.7699611004967258
Energy: 0.7412469549817249
Energy: 0.7804708510698879
Energy: 0.7765169428060903
Energy: 0.7583308714158292
Energy: 0.7502337357005747
Energy: 0.753003291656874
Energy: 0.7544616138879658
Energy: 0.8062648700244692
Energy: 0.7594850153090282
Energy: 0.7504738083621537
Energy: 0.7535196788075649
Energy: 0.7560957040924579
Energy: 0.8087033485096845
Energy: 0.7470470227398809
Energy: 0.7517281865647518
Energy: 0.7466596425327404
Energy: 0.7476662526790432
Energy: 0.8589633905227747
Energy: 0.7477449639522147
Energy: 0.7505668561687656
Energy: 0.7461408626455376
Energy: 0.7477435791039471
Energy: 0.8569632932642359
Energy: 0.7491140059464424
Energy: 0.7470956261807384
Energy: 0.7475588023583741
Energy: 0.7485583608489863
Energy: 0.8082252256408692
Energy: 0.7482371718755462
Energy: 0.7673246091032183
Energy: 0.7530802834773179
Energy: 0.7492715362352316
Energy: 0.8073570075005299
Energy: 0.7476292852467281
Energy: 0.7486024583172082
Energy: 0.7514205156642414
Energy: 0.7904608607104339
Energy: 0.7769704535424959
Energy: 0.7474628087803261
Energy: 0.7487618964319216
Energy: 0.7521207594831677
Energy: 0.8108955052561166
Energy: 0.7775122199526058
Energy: 0.751014796275656
Energy: 0.7512598624556021
Energy: 0.7448403988796017
Energy: 0.8098255550930903
Energy: 0.7914716423922983
Energy: 0.7495186597594659
Energy: 0.7528286811435135
Energy: 0.7455609449959003
Energy: 0.7552498741707846
Energy: 0.7928794242372393
Energy: 0.7542421707623718
Energy: 0.7526671639107199
Energy: 0.7521782471506016
Energy: 0.8245176161937174
Energy: 0.7775210884824181
Energy: 0.7467523077641105
Energy: 0.7540253893350674
Energy: 0.7505978763264752
Energy: 0.8002336689648053
Energy: 0.7751618470458649
Energy: 0.7687615487505745
Energy: 0.7763933919637903
Energy: 0.7541511322453575
Energy: 0.789203313579832
Energy: 0.7767076542863101
Energy: 0.7686105692078901
Energy: 0.7749182878783298
Energy: 0.7544981770269785
Energy: 0.7891051727304711
Energy: 0.7768751249873275
Energy: 0.7792822537315706
Energy: 0.7762934770264839
Energy: 0.769138317540222
Energy: 0.7534460896994822
Energy: 0.7775513895661796
Energy: 0.7810870940934789
Energy: 0.7767026376532421
Energy: 0.7670539881577199
Energy: 0.7537945357913283
Energy: 0.7616418621889056
Energy: 0.7803307224089175
Energy: 0.798047900266226
Energy: 0.8568214560880858
Energy: 0.8073154590833533
Energy: 0.7761031308191202
Energy: 0.781042192840566
Energy: 0.7818873086184874
Energy: 0.8004979416967772
Energy: 0.8103282509124252
Energy: 0.793989158753202
Energy: 0.8063900009457414
Energy: 0.7576347464061564
Energy: 0.788867563582615
Energy: 0.8062629516106723
Energy: 0.8391528896107062
Energy: 0.779826670519778
Energy: 0.7589786478758377
Energy: 0.7900353609200897
Energy: 0.8054434996446638
Energy: 0.7933005734444254
Energy: 0.7912750077179139
Energy: 0.7786490703807422
Energy: 0.7475139957142625
Energy: 0.7827967102877564
Energy: 0.8016445425403533
Energy: 0.7902277054840557
Energy: 0.7796632940087558
Energy: 0.7708557125191287
Energy: 0.7995423189400542
Energy: 0.8039945642192333
Energy: 0.7766330621362708
Energy: 0.7784414977333103
Energy: 0.7784837565879295
Energy: 0.7571238560811643
Energy: 0.8071905418775118
Energy: 0.7767342558475565
Energy: 0.7770869194138728
Energy: 0.7771642732502619
Energy: 0.7514493673623859
Energy: 0.7739226946369991
Energy: 0.7769275556934513
Energy: 0.9087759186071962
Energy: 0.7772723224057944
Energy: 0.7974588746869605
Energy: 0.7964550968744022
Energy: 0.7814858973163231
Energy: 0.909611977378744
Energy: 0.7773894865072708
Energy: 0.802165572024439
Energy: 0.7823719276481701
Energy: 0.748453055320659
Energy: 0.7516369500313713
Energy: 0.7765291464688304
Energy: 0.7800010657535374
Energy: 0.749198518428905
Energy: 0.7484456397363758
Energy: 0.7527347211444374
Energy: 0.8012957245533368
Energy: 0.7594117939833461
Energy: 0.7497048201750393
Energy: 0.7538500387459652
Energy: 0.749293506939496
Energy: 0.7996268002135781
Energy: 0.7790397676571132
Energy: 0.7544792987563613
Energy: 0.7543406542750171
Energy: 0.7493095983379899
Energy: 0.7935810589607115
Energy: 0.7494653453084025
Energy: 0.7523425151736486
Energy: 0.7486233426784956
Energy: 0.7487414455593071
Energy: 0.7793839322611971
Energy: 0.7741477315068097
Energy: 0.7457228634611275
Energy: 0.7566123157828434
Energy: 0.7489942317951104
Energy: 0.8686406847185427
Energy: 0.7731953602602566
Energy: 0.7456743262259689
Energy: 0.7470946117135477
Energy: 0.7922900458532435
Energy: 0.7890365140617202
Energy: 0.7472063497932759
Energy: 0.8256544128421109
Energy: 0.7479747861889534
Energy: 0.7894363562119175
Energy: 0.7886279348876519
Energy: 0.7472827462905608
Energy: 0.825293599732955
Energy: 0.7499382614788829
Energy: 0.759187683678004
Energy: 0.7543717752068727
Energy: 0.7480651646310148
Energy: 0.7481487591805305
Energy: 0.7512738741854581
Energy: 0.7587514279647583
Energy: 0.7544444611274564
Energy: 0.750148901356506
Energy: 0.7492038133181554
Energy: 0.7505929085203352
Energy: 0.8057222594513972
Energy: 0.8061371069476531
Energy: 0.7530820185858855
Energy: 0.7536581919298437
Energy: 0.7514662046528185
Energy: 0.8020571932613004
Energy: 0.804306253258311
Energy: 0.752621632480882
Energy: 0.7525327655034219
Energy: 0.8081955472149357
Energy: 0.7580206670895882
Energy: 0.7713158743163245
Energy: 0.7766525428479545
Energy: 0.7767910267040843
Energy: 0.7917451945805289
Energy: 0.7642174193510751
Energy: 0.7766629860085708
Energy: 0.7681256233058507
Energy: 0.7772375699529398
Energy: 0.7760190939679356
Energy: 0.7816715268880552
Energy: 0.7697803428750118
Energy: 0.7811862234001216
Energy: 0.7779220237678804
Energy: 0.7891280999860764
Energy: 0.7543467644039511
Energy: 0.7730717594133842
Energy: 0.780860158676239
Energy: 0.7791781762402343
Energy: 0.8005266629413604
Energy: 0.79768734191399
Energy: 0.7505437076744639
Energy: 0.7816167426397207
Energy: 0.7975071024285331
Energy: 0.8005163098737649
Energy: 0.7971795504296051
Energy: 0.7547592268356099
Energy: 0.7819909046240604
Energy: 0.7990797418580649
Energy: 0.7960979002002263
Energy: 0.7927128852726453
Energy: 0.7800963460930026
Energy: 0.7955014982889627
Energy: 0.7940220110641228
Energy: 0.7909660230372239
Energy: 0.7915896890291072
Energy: 0.7558521221165293
Energy: 0.7989441368898379
Energy: 0.7925977640658698
Energy: 0.7704594535612781
Energy: 0.8031416734518357
Energy: 0.8002021134520263
Energy: 0.7790258199272272
Energy: 0.7773249459038087
Energy: 0.7696621224290751
Energy: 0.7795679991271212
Energy: 0.8034831615270273
Energy: 0.7789958511875674
Energy: 0.7781317210092938
Energy: 0.7542347373770909
Energy: 0.7980860455999931
Energy: 0.809954989311042
Energy: 0.7773013486778764
Energy: 0.7518213586306359
Energy: 0.7519981802112818
Energy: 0.7908786808471997
Energy: 0.8081375298674078
Energy: 0.7782394686832944
Energy: 0.7779513513001979
Energy: 0.7798448259936538
Energy: 0.7785040154537335
Energy: 0.7831216161790626
Energy: 0.7726647883646232
Energy: 0.7414118172978338
Energy: 0.777016181982036
Energy: 0.7797683828296453
Energy: 0.7956959632084449
Energy: 0.7786112645258999
Energy: 0.904994326904354
Energy: 0.7771901284973427
Energy: 0.8034686079225768
Energy: 0.7491956983235886
Energy: 0.7488034326376818
Energy: 0.7500627879223271
Energy: 0.7771141617635893
Energy: 0.7896249588656984
Energy: 0.7485123929508798
Energy: 0.7478231856451456
Energy: 0.7469497518677798
Energy: 0.7476973033997241
Energy: 0.7977221685255117
Energy: 0.7482105437616922
Energy: 0.7561741931988579
Energy: 0.7535762056558178
Energy: 0.7480786930975476
Energy: 0.7964341768124514
Energy: 0.748352855193277
Energy: 0.7553303728498965
Energy: 0.7446481926978219
Energy: 0.7590432265098536
Energy: 0.8115691939931033
Energy: 0.7542779525670734
Energy: 0.7477053260849988
Energy: 0.7491841492143626
Energy: 0.7594180762549757
Energy: 0.80528189697657
Energy: 0.754061799385645
Energy: 0.7483830326737969
Energy: 0.7497254375239992
Energy: 0.7560113510876596
Energy: 0.7475010470594811
Energy: 0.7490408494388278
Energy: 0.7470764094123191
Energy: 0.7490072348693724
Energy: 0.7571108658080271
Energy: 0.7471013410307759
Energy: 0.748313533366295
Energy: 0.7471110553595055
Energy: 0.77988788260309

minimum gb energy = 0.7412469549817249 eV
minimum distance =  2.3249568638766 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.5366111762504905
Energy: 0.5224446669505463
Energy: 0.5628372424288085
Energy: 0.5673597702830756
Energy: 0.32531762270926445
Energy: 0.3240940782486204
Energy: 0.5061165063319628
Energy: 0.5577556951022085
Energy: 0.5605348187029492
Energy: 0.5317442383076554
Energy: 0.5211597470696172
Energy: 0.5596893141731952
Energy: 0.6188868204910483
Energy: 0.5635317457171439
Energy: 0.5007087454067686
Energy: 0.5027971660832318
Energy: 0.509943113382662
Energy: 0.686221890075165
Energy: 0.5192035292636215
Energy: 0.565292123314046
Energy: 0.5897349890728883
Energy: 0.6191201207543227
Energy: 0.5888197271593117
Energy: 0.5738848409968886
Energy: 0.388289046472085
Energy: 0.5456945991793857
Energy: 0.6080473894286934
Energy: 0.5708425874426031
Energy: 0.5588488592511669
Energy: 0.44398059946996504
Energy: 0.4282349588241664
Energy: 0.5557248509145104
Energy: 0.5918446819486812
Energy: 0.564288138105602
Energy: 0.36583767446260107
Energy: 0.3622704283383842
Energy: 0.5211392161906356
Energy: 0.6065460821387888
Energy: 0.5726053608044397
Energy: 0.4304222718876476
Energy: 0.5611112489816762
Energy: 0.5788763605218381
Energy: 0.5853360021850126
Energy: 0.5637744975532246
Energy: 0.5581667917134383
Energy: 0.5478138487545308
Energy: 0.5447867056675957
Energy: 0.5706642972564601
Energy: 0.5817162778566437
Energy: 0.5139633981307178
Energy: 0.5782432035983524
Energy: 0.6234114257140535
Energy: 0.5664879508061917
Energy: 0.3636870389676826
Energy: 0.37659747350119727
Energy: 0.5797798213250227
Energy: 0.5363429573536236
Energy: 0.5801363459760214
Energy: 0.43829287146969165
Energy: 0.41663832979180865
Energy: 0.6229327782426827
Energy: 0.6375596354943076
Energy: 0.5500206598238936
Energy: 0.3652485697767727
Energy: 0.3672198667949225
Energy: 0.5726592781242419
Energy: 0.5716783573191866
Energy: 0.5533766957622386
Energy: 0.44171893089198094
Energy: 0.5512613839085112
Energy: 0.5877495097382452
Energy: 0.5634934297939177
Energy: 0.6093344094536602
Energy: 0.6552942369785516
Energy: 0.5687128614417117
Energy: 0.5583344456626554
Energy: 0.6251482696190616
Energy: 0.5955501419428796
Energy: 0.6328438278943631
Energy: 0.5436594390147881
Energy: 0.7150009393280157
Energy: 0.5950046104917818
Energy: 0.36214016423865525
Energy: 0.3633589794031963
Energy: 0.5444095215506304
Energy: 0.7154989708433578
Energy: 0.614599761749694
Energy: 0.4004910370202104
Energy: 0.4029270247804064
Energy: 0.6298436112210574
Energy: 0.7276423834816047
Energy: 0.6238758015211242
Energy: 0.37990905804247294
Energy: 0.5543971789643353
Energy: 0.6405529724575773
Energy: 0.7294725206051212
Energy: 0.5943728236365585
Energy: 0.3986747749105364
Energy: 0.603087720277651
Energy: 0.557031613354077
Energy: 0.6588559574664095
Energy: 0.627583977485222
Energy: 0.38184550303836073
Energy: 0.6620369580894612
Energy: 0.6286976598202942
Energy: 0.555310257577065
Energy: 0.35781169970029086
Energy: 0.3769411580907055
Energy: 0.6677351749327738
Energy: 0.7350324769945834
Energy: 0.5658394441256286
Energy: 0.3646874096402247
Energy: 0.36218901555719074
Energy: 0.5492540303010088
Energy: 0.718739187795591
Energy: 0.6524540592629975
Energy: 0.3639033868716043
Energy: 0.36216546248895776
Energy: 0.6106911050159641
Energy: 0.7180887582727754
Energy: 0.6692965219232487
Energy: 0.6574140988708109
Energy: 0.6714689227851931
Energy: 0.6468377103120999
Energy: 0.7350671866987747
Energy: 0.7096825413358169
Energy: 0.7066126911926816
Energy: 0.676842109031909
Energy: 0.6758778829471244
Energy: 0.6587882905634843
Energy: 0.3261954227982881
Energy: 0.3258777087173949
Energy: 0.6988409955602662
Energy: 0.7157276585560012
Energy: 0.7395871559869627
Energy: 0.3647005546233154
Energy: 0.36515777491638723
Energy: 0.7277867503176277
Energy: 0.7155361744021377
Energy: 0.703512821740569
Energy: 0.3265342205449234
Energy: 0.3256270306528448
Energy: 0.6324593240334423
Energy: 0.7453952362358222
Energy: 0.7174544872480326
Energy: 0.35781863232714833
Energy: 0.36413558982586286
Energy: 0.6487696931333868
Energy: 0.7330825185596431
Energy: 0.7170239601509452
Energy: 0.7242416704936622
Energy: 0.7166788799981368
Energy: 0.6941187720257649
Energy: 0.7231635663898524
Energy: 0.7122230012776759
Energy: 0.6142013778181991
Energy: 0.7322673097957434
Energy: 0.7110130377992601
Energy: 0.7176882312071621
Energy: 0.704941903006889
Energy: 0.4022405380080709
Energy: 0.7141756753507114
Energy: 0.7316962427928541
Energy: 0.7165643951925156
Energy: 0.32414031150456907
Energy: 0.32724393737284657
Energy: 0.7367059109942755
Energy: 0.7276574409167447
Energy: 0.7224385712679889
Energy: 0.40031310373521134
Energy: 0.4075792621203287
Energy: 0.6933320263845143
Energy: 0.7462475855773091
Energy: 0.7268485936516924
Energy: 0.6665383027613683
Energy: 0.34493999895284383
Energy: 0.7076906321623193
Energy: 0.7370726233544477
Energy: 0.7123717901850256
Energy: 0.684755580632833
Energy: 0.7191518061664136
Energy: 0.7519596336857789
Energy: 0.7093834001193392
Energy: 0.7098221054061589
Energy: 0.35776729496493637
Energy: 0.722863668695916
Energy: 0.7304694148312181
Energy: 0.7156474011696081
Energy: 0.6682927960798326
Energy: 0.32792757781070114
Energy: 0.3247445181735566
Energy: 0.6830032629679017
Energy: 0.7178583951443785
Energy: 0.6996276454935672
Energy: 0.36190148538173517
Energy: 0.3636055929321048
Energy: 0.7312540783612833
Energy: 0.720339473975751
Energy: 0.3471327986063996
Energy: 0.3233854834351154
Energy: 0.6590330467906297
Energy: 0.6480437360562709
Energy: 0.6817217111998946
Energy: 0.6370638630710823
Energy: 0.6656575994391627
Energy: 0.638532605407358
Energy: 0.7373594293032814
Energy: 0.6736661397185089
Energy: 0.702730030992365
Energy: 0.6383095702466078
Energy: 0.6428546738053172
Energy: 0.7216295519764879
Energy: 0.6043330093874013
Energy: 0.3717363984687531
Energy: 0.35742963095048114
Energy: 0.654493941026298
Energy: 0.7696343366398316
Energy: 0.6280671540095376
Energy: 0.3678319211632259
Energy: 0.6704450530573652
Energy: 0.5630652747136062
Energy: 0.6965835061700361
Energy: 0.680509606724549
Energy: 0.3677550092764321
Energy: 0.36238239294595453
Energy: 0.6698983839412702
Energy: 0.7146166221733976
Energy: 0.6155029623016264
Energy: 0.36809159564746546
Energy: 0.3623536457284719
Energy: 0.7204770335599753
Energy: 0.6655677690905389
Energy: 0.6361124481572024
Energy: 0.6810920050880241
Energy: 0.6281736865803219
Energy: 0.651343168914554
Energy: 0.5455481020387185
Energy: 0.6550219732151354
Energy: 0.6590379562477354
Energy: 0.6815078147891063
Energy: 0.7014874749781521
Energy: 0.5491570199537225
Energy: 0.4015922293688002
Energy: 0.40620186396724817
Energy: 0.5999897304457092
Energy: 0.7070929622106171
Energy: 0.5624044174244396
Energy: 0.36314785321914494
Energy: 0.3767309299741254
Energy: 0.5598233252539396
Energy: 0.7224243966729293
Energy: 0.6245000088639426
Energy: 0.3912133762959266
Energy: 0.410304882507603
Energy: 0.5363360933281832
Energy: 0.5432217749456948
Energy: 0.5904566866872134
Energy: 0.3654469001290017
Energy: 0.37882179676022043
Energy: 0.5656857352321162
Energy: 0.5435043618029924
Energy: 0.5972931029939913
Energy: 0.5558646756266985
Energy: 0.6588625292174106
Energy: 0.5955757891411754
Energy: 0.54806500367111
Energy: 0.5475391202754384
Energy: 0.5541684770959671
Energy: 0.5728463985859427
Energy: 0.701999703291231
Energy: 0.5512965611086795
Energy: 0.4337985463053901
Energy: 0.4378723504362734
Energy: 0.5418243636229905
Energy: 0.5937941848408493
Energy: 0.5496410778301755
Energy: 0.36228577163932707
Energy: 0.36270810537205134
Energy: 0.5448771323212567
Energy: 0.5394765963796134
Energy: 0.574338270369186
Energy: 0.5503078108976611
Energy: 0.4157011954404505
Energy: 0.524763295506522
Energy: 0.5400624185329284
Energy: 0.5197558398837139
Energy: 0.543965672070485
Energy: 0.5476646032436646
Energy: 0.5414205692582559
Energy: 0.5441371675253098
Energy: 0.5637036559234546
Energy: 0.44671032321242565
Energy: 0.5693767802647991
Energy: 0.5910719881083154
Energy: 0.5278461414660434
Energy: 0.5767889463107907
Energy: 0.3799067407991834
Energy: 0.5476784675820876
Energy: 0.6012190897455579
Energy: 0.5754768617994515
Energy: 0.4119630313593169
Energy: 0.4311865517259867
Energy: 0.5578778309155967
Energy: 0.6041813121857869
Energy: 0.5270926011414223
Energy: 0.36573080309573963
Energy: 0.3665512042639156
Energy: 0.5262672931699212
Energy: 0.5988958162698808
Energy: 0.5651055113431964
Energy: 0.5548982130590525
Energy: 0.5366801131987075
Energy: 0.5684848020497556
Energy: 0.556559560253941
Energy: 0.509295039186232
Energy: 0.5203242820104228
Energy: 0.5221847445888027
Energy: 0.5335699988703987
Energy: 0.564338875585854
Energy: 0.5539447616020786
Energy: 0.5292530088763798
Energy: 0.5406062546715876
Energy: 0.6355441813258381
Energy: 0.5072272377676523
Energy: 0.5639763159220185
Energy: 0.32569002572379485
Energy: 0.5629438426206426
Energy: 0.5579440826856198
Energy: 0.5888668553533438
Energy: 0.5261803448409866

minimum gb energy = 0.3233854834351154 eV
minimum distance =  2.39195574591804 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.7174278643348235
Energy: 0.692334283060161
Energy: 0.7127006902577305
Energy: 0.7156784845911376
Energy: 0.6851374108503426
Energy: 0.6829474674295425
Energy: 0.6968498560428852
Energy: 0.7050710952680168
Energy: 0.7080663823523496
Energy: 0.6875953959147655
Energy: 0.6922960815000837
Energy: 0.7287573469573053
Energy: 0.7045137952074718
Energy: 0.6998004202530085
Energy: 0.7049581279383662
Energy: 0.6883761642935586
Energy: 0.7259746836600877
Energy: 0.7111840033251383
Energy: 0.6995342895916968
Energy: 0.7161232175642581
Energy: 0.6938565551050965
Energy: 0.702433825286751
Energy: 0.7017484016127358
Energy: 0.7200858604179549
Energy: 0.687390412313537
Energy: 0.6872199697621906
Energy: 0.7026228350158585
Energy: 0.7018763377593539
Energy: 0.7243094115785816
Energy: 0.6867031439969635
Energy: 0.7562623573210063
Energy: 0.7095946860659388
Energy: 0.7090038306478356
Energy: 0.7009220987771743
Energy: 0.6920411040680323
Energy: 0.7281624275220184
Energy: 0.7086104805567376
Energy: 0.7023848591390173
Energy: 0.7210646531890987
Energy: 0.7072544240782119
Energy: 0.7035869600229652
Energy: 0.7081967145513999
Energy: 0.7296478814275966
Energy: 0.6949302170392182
Energy: 0.6863793355412968
Energy: 0.708158293050222
Energy: 0.7331090462810907
Energy: 0.7306514481795015
Energy: 0.6953065399580861
Energy: 0.7305730263286955
Energy: 0.7059538676609305
Energy: 0.7035842161461576
Energy: 0.7749379541351892
Energy: 0.7041738010575671
Energy: 0.6893071166837371
Energy: 0.7066110349800049
Energy: 0.706225444646972
Energy: 0.7675883054616424
Energy: 0.7035218435124514
Energy: 0.6892877908560879
Energy: 0.7580557494358207
Energy: 0.7055568996818578
Energy: 0.6961323258975342
Energy: 0.7061192006199053
Energy: 0.727350198857305
Energy: 0.7718530849624506
Energy: 0.7055695443408984
Energy: 0.7127268864977278
Energy: 0.6995278507313734
Energy: 0.7105162579667593
Energy: 0.6962646491118707
Energy: 0.7060640560557764
Energy: 0.6924926312310549
Energy: 0.7058165958674961
Energy: 0.6950863754029354
Energy: 0.6966254639414174
Energy: 0.7067505515105791
Energy: 0.6918147775529228
Energy: 0.7094765896397817
Energy: 0.6952418054548509
Energy: 0.6947935817366531
Energy: 0.6928240244798822
Energy: 0.7233933342944753
Energy: 0.6906030581148646
Energy: 0.7116623891678105
Energy: 0.6944894290043446
Energy: 0.6928843582327632
Energy: 0.7235160949817561
Energy: 0.6897076218484747
Energy: 0.7121892727915119
Energy: 0.7314061468421367
Energy: 0.6956347470701648
Energy: 0.687973835396425
Energy: 0.6957577015076548
Energy: 0.6968159680526035
Energy: 0.7893178173593967
Energy: 0.6967987174971371
Energy: 0.7065149700071814
Energy: 0.6963277842685428
Energy: 0.6960793300464263
Energy: 0.6949174829180295
Energy: 0.7138628590247327
Energy: 0.7165127497247905
Energy: 0.69231482292979
Energy: 0.6927227103831989
Energy: 0.6949440257411947
Energy: 0.7135674429287323
Energy: 0.7098140974196546
Energy: 0.6934384542661785
Energy: 0.693712088036667
Energy: 0.7065214603629519
Energy: 0.6925879441293888
Energy: 0.7050463529004627
Energy: 0.7125145025077843
Energy: 0.6882562724174348
Energy: 0.7071389249140885
Energy: 0.6918279223686862
Energy: 0.7978572151684702
Energy: 0.7181502104409726
Energy: 0.6868440276728798
Energy: 0.7038190236341081
Energy: 0.7080708117382558
Energy: 0.6920595162938791
Energy: 0.710682504390728
Energy: 0.6919932243563396
Energy: 0.7203310260950444
Energy: 0.7264495488826096
Energy: 0.6923640154479396
Energy: 0.713131279626584
Energy: 0.6936299609856718
Energy: 0.7006581241256422
Energy: 0.6986622495962385
Energy: 0.7015529143108548
Energy: 0.6915108194326456
Energy: 0.6918031540095985
Energy: 0.7070758589892292
Energy: 0.6947036966090171
Energy: 0.6937663129564333
Energy: 0.6915425987442559
Energy: 0.715832609461745
Energy: 0.7168873323441536
Energy: 0.7158666242235641
Energy: 0.7008822001507826
Energy: 0.7035738324400522
Energy: 0.6880369191228537
Energy: 0.6950114772350303
Energy: 0.7128609220833247
Energy: 0.6955456906162266
Energy: 0.7024048544392029
Energy: 0.6881570019513412
Energy: 0.7001031932588025
Energy: 0.694640357647097
Energy: 0.6972247950618128
Energy: 0.7116750919453498
Energy: 0.7245012141104346
Energy: 0.6999633278755559
Energy: 0.6947537326405178
Energy: 0.7112983997518925
Energy: 0.7023498401012069
Energy: 0.6993314885634357
Energy: 0.7177922237245818
Energy: 0.7053541612531143
Energy: 0.6941216947008898
Energy: 0.7080221904568846
Energy: 0.7638657649662456
Energy: 0.7004342341801886
Energy: 0.7036236782671866
Energy: 0.6935287087549361
Energy: 0.7077170801255976
Energy: 0.7641444933520815
Energy: 0.7000177843108455
Energy: 0.711455616412963
Energy: 0.699526383184195
Energy: 0.6874424749249904
Energy: 0.7070005659903273
Energy: 0.7005012322946171
Energy: 0.6997744228791922
Energy: 0.701106341486411
Energy: 0.6877026867552608
Energy: 0.696564549765349
Energy: 0.703056261831828
Energy: 0.7013063362664964
Energy: 0.7032146177509704
Energy: 0.7068542211029365
Energy: 0.7256137134430938
Energy: 0.7015688093358414
Energy: 0.7013097615823893
Energy: 0.7461318089386169
Energy: 0.7276055359365395
Energy: 0.7252186812901544
Energy: 0.7032739780385776
Energy: 0.703446861852791
Energy: 0.6890587760996926
Energy: 0.7029285418546288
Energy: 0.717172650024391
Energy: 0.7038410628746623
Energy: 0.6879347069102787
Energy: 0.6891834131792659
Energy: 0.7019756769164589
Energy: 0.7092179523003859
Energy: 0.7211912844994747
Energy: 0.6817440342475877
Energy: 0.6841726092922229
Energy: 0.7031800855753138
Energy: 0.7067279974494607
Energy: 0.7038140636111195
Energy: 0.6815152427571999
Energy: 0.7176724975239649
Energy: 0.7098316584839239
Energy: 0.7067898809397046
Energy: 0.7042927753242192
Energy: 0.7046039546580318
Energy: 0.7072944189084689
Energy: 0.7018434866154617
Energy: 0.7076540123518086
Energy: 0.7047638171946093
Energy: 0.7043872256919068
Energy: 0.7008394782044682
Energy: 0.7024974525804354
Energy: 0.7063849694949365
Energy: 0.696024553025623
Energy: 0.6924013054610908
Energy: 0.7144349422534071
Energy: 0.7010984527363628
Energy: 0.7120946264898931
Energy: 0.7001622286677741
Energy: 0.6893863389598501
Energy: 0.7145263126196509
Energy: 0.7015933411519961
Energy: 0.7121044477877905
Energy: 0.6980164192442517
Energy: 0.6965126457428378
Energy: 0.7015540107254266
Energy: 0.7223848636100914
Energy: 0.7009424025525839
Energy: 0.6919270140135039
Energy: 0.696949599707858
Energy: 0.7062767797961733
Energy: 0.7222298748687633
Energy: 0.702590197485117
Energy: 0.695354790523803
Energy: 0.7043562225468325
Energy: 0.7054306986977567
Energy: 0.7173552352406485
Energy: 0.7048520832981401
Energy: 0.6958221601823227
Energy: 0.7059355875433104
Energy: 0.706957535693138
Energy: 0.7184054802558016
Energy: 0.6970341660013505
Energy: 0.7043630117335573
Energy: 0.6969874034193749
Energy: 0.7058604226628281
Energy: 0.7275276358918094
Energy: 0.6881102459190636
Energy: 0.6998750866903254
Energy: 0.6973010199958627
Energy: 0.7060092710667568
Energy: 0.7280555915469314
Energy: 0.6875341485752589
Energy: 0.6862111191399565
Energy: 0.7298782962941073
Energy: 0.7078513102842225
Energy: 0.7059970795506983
Energy: 0.6990823242203089
Energy: 0.6862212953318374
Energy: 0.7310958696600839
Energy: 0.7065820807193
Energy: 0.7051581762330504
Energy: 0.6993979131732676
Energy: 0.7100121454456914
Energy: 0.6954964707071676
Energy: 0.6982763955559512
Energy: 0.7106145805798836
Energy: 0.6866205990333913
Energy: 0.7098940741769448
Energy: 0.6955782579434429
Energy: 0.6975894226922444
Energy: 0.7263026999781899
Energy: 0.6862168255814423
Energy: 0.6884828449412806
Energy: 0.7237279592485426
Energy: 0.6930590308241771
Energy: 0.6927092906117133
Energy: 0.7033497169742631
Energy: 0.6944462724909086
Energy: 0.7183151568768935
Energy: 0.6975119101307888
Energy: 0.6929868592928591
Energy: 0.6898868689470102
Energy: 0.6933891342579421
Energy: 0.6922038623912542
Energy: 0.710847449261423
Energy: 0.7719744285493427
Energy: 0.6918545508935287
Energy: 0.6938987589792934
Energy: 0.696609403745626
Energy: 0.7118406350685007
Energy: 0.7667103336595646
Energy: 0.6914853880732122
Energy: 0.6926167698593751
Energy: 0.6927657193667955
Energy: 0.696274495908841
Energy: 0.7104923993293696
Energy: 0.7112313590446286
Energy: 0.6922494211627535
Energy: 0.693963632885234
Energy: 0.6958992598696347
Energy: 0.7119323880460917
Energy: 0.7106382954237972
Energy: 0.7012553458411971
Energy: 0.6918137723542779
Energy: 0.7126148378446621
Energy: 0.6895059942349574
Energy: 0.7131573782892906
Energy: 0.7036497389762453
Energy: 0.6988604993024471
Energy: 0.7131126455660514
Energy: 0.6898539228812126
Energy: 0.7059076621180903
Energy: 0.7114976659932445
Energy: 0.6921883411927003
Energy: 0.6950481518700797
Energy: 0.6943893506974893
Energy: 0.6927192452023977
Energy: 0.7111898365082454
Energy: 0.7037555557215817
Energy: 0.694586132941896
Energy: 0.6941883285959002
Energy: 0.693225059859379
Energy: 0.6914184652250062
Energy: 0.7175819839313532
Energy: 0.7616510730755927
Energy: 0.6978677700017619
Energy: 0.6950052771818042
Energy: 0.6917529423465753
Energy: 0.7200824383587366
Energy: 0.7616626577600091
Energy: 0.6952112528256346
Energy: 0.6939517630571205
Energy: 0.7352162881622517
Energy: 0.6944715962935526
Energy: 0.7115104266572605
Energy: 0.696049140529325
Energy: 0.6878432695638641
Energy: 0.7074900427732704
Energy: 0.6941367263101123
Energy: 0.709493754252462
Energy: 0.7071717236624265
Energy: 0.6871671026274502
Energy: 0.68525313451631
Energy: 0.7265585551879374
Energy: 0.7040472572097981
Energy: 0.6943449312367742
Energy: 0.6951739868471329
Energy: 0.6916116242641727
Energy: 0.7000161920407607
Energy: 0.7025420276002875
Energy: 0.6946674918463158
Energy: 0.7109797086461201
Energy: 0.7254269100574797
Energy: 0.6989744177287194
Energy: 0.6995443526507387
Energy: 0.73921045252184
Energy: 0.6856020410301328
Energy: 0.7241637436443855
Energy: 0.7010259075782507
Energy: 0.700770181329883
Energy: 0.7263065187705776
Energy: 0.6851231575327948
Energy: 0.6880944736788049
Energy: 0.7068428970434131
Energy: 0.7005835845822128
Energy: 0.6978038094315638
Energy: 0.6867143857569119
Energy: 0.6891954770315493
Energy: 0.719527334258693
Energy: 0.6999284956598396
Energy: 0.6950889442284938
Energy: 0.7024782159039065
Energy: 0.69513019774501
Energy: 0.7082904741957259
Energy: 0.7014311188347105
Energy: 0.7071780492778035
Energy: 0.6936106554903473
Energy: 0.7009430726748127
Energy: 0.7153138324831224
Energy: 0.7009395623328853
Energy: 0.7075382010238452
Energy: 0.6941809446333931
Energy: 0.7216277322105634
Energy: 0.7372999408978653
Energy: 0.7032382905548414
Energy: 0.6831836854782706
Energy: 0.6842438000971084
Energy: 0.7218195149859304
Energy: 0.7369972745784509
Energy: 0.7023095902811896
Energy: 0.6830593394308768
Energy: 0.689940144279421
Energy: 0.7078355122076943
Energy: 0.7171457121711214
Energy: 0.7188683602289114
Energy: 0.6838616106131582
Energy: 0.6897024861188922
Energy: 0.70776644339794
Energy: 0.7183274656859456
Energy: 0.7158226133615142
Energy: 0.6829032081627798
Energy: 0.6904124327380845
Energy: 0.7019449715882194
Energy: 0.7071362586314349
Energy: 0.7001390851658452
Energy: 0.719019275834567
Energy: 0.7012179242125299
Energy: 0.7034617838083151
Energy: 0.707195987990027
Energy: 0.6955309047098338
Energy: 0.7062625244101337
Energy: 0.703754132969135
Energy: 0.7017115007532286
Energy: 0.7084309744766981
Energy: 0.7940500958624255
Energy: 0.6866677036255505
Energy: 0.7166907241810325
Energy: 0.7007845903471237
Energy: 0.7090666498329182
Energy: 0.7994042056875528
Energy: 0.6874119247642302
Energy: 0.7184654646461245
Energy: 0.7031769282737247
Energy: 0.7000157653775887
Energy: 0.7158663136683568
Energy: 0.7240808451503875
Energy: 0.7197133269176686
Energy: 0.7027503300377563
Energy: 0.7006961748321909
Energy: 0.7224928927169363
Energy: 0.7175800157558513
Energy: 0.7024253017932106
Energy: 0.7253657134399097
Energy: 0.7201765303645733
Energy: 0.6981057993444243
Energy: 0.7048549044257532
Energy: 0.7072448771444901
Energy: 0.7245720915210775
Energy: 0.7210283567788099
Energy: 0.6995878811125111
Energy: 0.7046653913698115
Energy: 0.7085538868741457
Energy: 0.6957953388164343
Energy: 0.690051143234899
Energy: 0.6898341447647528
Energy: 0.713493945960539
Energy: 0.7058321570373821
Energy: 0.6958053872418007
Energy: 0.6902576449389551
Energy: 0.6862358490072805
Energy: 0.714296630276185
Energy: 0.7053772681044023
Energy: 0.738507761116186
Energy: 0.6931694072759852
Energy: 0.6951635280265718
Energy: 0.6985342983551178
Energy: 0.7068845768596108
Energy: 0.739008322242423
Energy: 0.6933732556898289
Energy: 0.6954934453210364
Energy: 0.6984530308098663
Energy: 0.7059817039832771
Energy: 0.705465278098066
Energy: 0.7009966651285545
Energy: 0.7118129841031068
Energy: 0.6952279912592659
Energy: 0.758577739978169
Energy: 0.7197365918757743
Energy: 0.6923730425231635
Energy: 0.7103129598743795
Energy: 0.695281343005205
Energy: 0.7685782463088511
Energy: 0.6941141478967272
Energy: 0.7084324573113662
Energy: 0.7478190789262245
Energy: 0.719676663258344
Energy: 0.6953164828559014
Energy: 0.6880791350918829
Energy: 0.7049122229192093
Energy: 0.734049709635641
Energy: 0.7038921522373749
Energy: 0.7113303685389832
Energy: 0.6916681922914908
Energy: 0.6914843757095587
Energy: 0.692189622905392
Energy: 0.6926264286800756
Energy: 0.7089541216044016
Energy: 0.6917580972837544
Energy: 0.6915092224895539
Energy: 0.6925174117526453
Energy: 0.6930750395862901
Energy: 0.6998627617647818
Energy: 0.7156310887533888
Energy: 0.7099618360337187
Energy: 0.692312092941596
Energy: 0.7084146236877259
Energy: 0.8117158210691273
Energy: 0.6893887778462578
Energy: 0.7100114867897122
Energy: 0.6918721792668591
Energy: 0.7107149978354524
Energy: 0.8107439904763658
Energy: 0.6896336779335936
Energy: 0.719508038143046
Energy: 0.6923374594153007
Energy: 0.6928410550969023
Energy: 0.7108325642854613
Energy: 0.6904172750994366
Energy: 0.7208317107748667
Energy: 0.6919801248346077
Energy: 0.689206005430707
Energy: 0.7118979285710836
Energy: 0.6950935313727165
Energy: 0.6920313128031889
Energy: 0.7115018446015695
Energy: 0.7163462363204048
Energy: 0.6950807513522411
Energy: 0.6932227195621954
Energy: 0.6920758468113266
Energy: 0.7187622647588257
Energy: 0.7216441508922733
Energy: 0.6936880788677999
Energy: 0.6956740222874083
Energy: 0.7162601042624316
Energy: 0.6936548667170083
Energy: 0.6961794982789425
Energy: 0.6991941436865325
Energy: 0.7138734025605505
Energy: 0.7133888509998841
Energy: 0.7076144981481894
Energy: 0.6957798675773302
Energy: 0.7054235229155921
Energy: 0.6971292520564499
Energy: 0.6910277924580209
Energy: 0.7128017730647608
Energy: 0.7215589965193732
Energy: 0.6947728226023753
Energy: 0.7133564012827784
Energy: 0.6907140484308869
Energy: 0.7032076286410379
Energy: 0.7169909997939785
Energy: 0.693283610184302
Energy: 0.6935491878150845
Energy: 0.6950202282903857
Energy: 0.6915470676277075
Energy: 0.7096449834760129
Energy: 0.6964340078793758
Energy: 0.6950631994348462
Energy: 0.7106707554998183
Energy: 0.6915222295035938
Energy: 0.7028070224576857
Energy: 0.695233468025602
Energy: 0.7045530585366107
Energy: 0.6890794885193596
Energy: 0.7003744936403308
Energy: 0.7134529788083481
Energy: 0.7296160225115179
Energy: 0.6942735914445276
Energy: 0.715169440089619
Energy: 0.6873961706583659
Energy: 0.7179745026637957
Energy: 0.7306065367191138
Energy: 0.6909968640310294
Energy: 0.7034016479650793
Energy: 0.7136218563488631
Energy: 0.7030685674889432
Energy: 0.6930624336019452
Energy: 0.6885842042914929
Energy: 0.6936842895583278
Energy: 0.7143763155927125
Energy: 0.7006992264916233
Energy: 0.7016211799734645
Energy: 0.6952906870281027
Energy: 0.6944576422111081
Energy: 0.7302891405061215
Energy: 0.7225786984350675
Energy: 0.6981965234798788
Energy: 0.6888426215519491
Energy: 0.695254110272472
Energy: 0.7381936641916428
Energy: 0.6975362001514488
Energy: 0.7027758056771329
Energy: 0.6882573579795999
Energy: 0.6938645805765771
Energy: 0.7195684003787131
Energy: 0.7164245829341549
Energy: 0.6866949167271457
Energy: 0.6813943564914
Energy: 0.6985585950728705
Energy: 0.7049405983886553
Energy: 0.699834919942394
Energy: 0.6976242594051244

minimum gb energy = 0.6813943564914 eV
minimum distance =  2.31709585802211 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.3104041925811185
Energy: 0.9294962149398946
Energy: 0.9217186098244278
Energy: 0.9135106643585783
Energy: 0.9073637257946483
Energy: 0.9081041011145689
Energy: 0.9273150362099344
Energy: 0.9391681358121564
Energy: 0.913982820188593
Energy: 0.9077972813543989
Energy: 0.908437548678279
Energy: 0.9027691840145008
Energy: 0.907461132589707
Energy: 0.9011989556462907
Energy: 0.9165639259208661
Energy: 0.9136371337891231
Energy: 0.9019123442234834
Energy: 0.9013001452961745
Energy: 0.9017082000929104
Energy: 0.9270167979923298
Energy: 0.9264316052872834
Energy: 0.9035094753216144
Energy: 0.9010915028553982
Energy: 0.9069109497713438
Energy: 0.9113606369870026
Energy: 0.9222077705044511
Energy: 0.9025273812518281
Energy: 0.9010448544347243
Energy: 0.9249880523855328
Energy: 0.9120356378207766
Energy: 0.9298950732396645
Energy: 0.9351165641384878
Energy: 0.9038715175582026
Energy: 0.9213541814043937
Energy: 0.9111810434519388
Energy: 0.9184001245946106
Energy: 0.9348082237615949
Energy: 0.9047029276246942
Energy: 0.915272149541816
Energy: 0.9061292821217517
Energy: 0.9124240428450398
Energy: 0.9059910658074356
Energy: 0.8814117318628858
Energy: 0.9126382088876956
Energy: 0.9116830704108705
Energy: 0.9127601767005965
Energy: 0.8874452644197703
Energy: 0.881242033032149
Energy: 0.912864435462936
Energy: 0.9215323978991539
Energy: 0.9139454734059361
Energy: 0.9169364663309205
Energy: 0.9114462203369894
Energy: 0.929331894289315
Energy: 0.913323700298476
Energy: 0.9135023860307389
Energy: 0.9243762460127488
Energy: 0.9116110325318758
Energy: 0.9284188261813472
Energy: 0.9133895490619499
Energy: 0.8824069003315276
Energy: 0.9085154059134601
Energy: 0.9130301858954157
Energy: 0.9138059275598258
Energy: 0.9156402866841838
Energy: 0.882796097300342
Energy: 0.9082863881216023
Energy: 0.913342356839704
Energy: 0.929081072927985
Energy: 0.9135848654890196
Energy: 0.9131245064923145
Energy: 0.9085081043601867
Energy: 0.9040897767347457
Energy: 0.9140352148932044
Energy: 0.9128386635654929
Energy: 0.9271156018598107
Energy: 0.9092224859297139
Energy: 0.9034430013402317
Energy: 0.9232755679971177
Energy: 0.91430214480563
Energy: 0.9083836919164774
Energy: 0.9269534877341867
Energy: 0.9016766578892633
Energy: 0.9026325178490694
Energy: 0.9165106052709693
Energy: 0.9101707052185033
Energy: 0.9271635748667991
Energy: 0.9015237157442689
Energy: 0.9034102336376256
Energy: 0.9138809103634832

minimum gb energy = 0.881242033032149 eV
minimum distance =  2.32618225652481 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.0137172348949424
Energy: 1.0145418565122684
Energy: 1.036982795336621
Energy: 1.0224356356638702
Energy: 1.0620769618069579
Energy: 1.01126269686843
Energy: 1.030853675918829
Energy: 1.0398921354946784
Energy: 1.0227955087987992
Energy: 1.0486230492456785
Energy: 1.072615804842051
Energy: 1.0244474713280896
Energy: 1.0221200752464947
Energy: 1.0206243215961486
Energy: 1.0297213259814073
Energy: 1.0317042084913313
Energy: 1.0261799601335169
Energy: 1.019266473079295
Energy: 1.021433668738464
Energy: 1.0406861191993553
Energy: 1.062422956082225
Energy: 1.0380752793426964
Energy: 1.025051872282599
Energy: 1.0234762454096444
Energy: 1.0316820665486197
Energy: 1.0563426042982629
Energy: 1.0369739284937254
Energy: 1.0243084918507785
Energy: 1.0256451661004746
Energy: 1.0442222063485735
Energy: 1.0194349966955996
Energy: 1.066722669667142
Energy: 1.0122431885630176
Energy: 1.0614926619316065
Energy: 1.006622625777437
Energy: 1.0188344410444041
Energy: 1.0671399355625697
Energy: 1.005142626033175
Energy: 1.029197117012645
Energy: 1.042228822281351
Energy: 1.055022008553983
Energy: 1.0050106229056632
Energy: 1.0059413914749171
Energy: 1.0293910612313926
Energy: 1.0301486125684631
Energy: 1.0569643652897949
Energy: 1.0048245967881337
Energy: 1.0128073677192038
Energy: 1.0356511738484895
Energy: 1.031529631501408
Energy: 1.0271284050109308
Energy: 1.0394748824317248
Energy: 1.0529827502272588
Energy: 1.0215958865636467
Energy: 1.024736078308567
Energy: 1.0270976521753092
Energy: 1.0322761971005912
Energy: 1.037538034114977
Energy: 1.019642681160403
Energy: 1.0259118839618275
Energy: 1.047246263645396
Energy: 1.0247253021169882
Energy: 1.0315892552205865
Energy: 1.0296434082143142
Energy: 1.016428502263004
Energy: 1.0203156022634263
Energy: 1.0280438409688883
Energy: 1.0339443672619928
Energy: 1.0293073619163708
Energy: 1.0164409854834568
Energy: 1.047418757569502
Energy: 1.0303354458636074
Energy: 1.0590864399088011
Energy: 1.0369213314737553
Energy: 1.0253114522490245
Energy: 1.0684618521736613
Energy: 1.0284869824935972
Energy: 1.0398907091751104
Energy: 1.034201459915193
Energy: 1.020794533326814
Energy: 1.0340998075266847
Energy: 1.0551081397877557
Energy: 1.0467192014836775
Energy: 1.0203974362441237
Energy: 1.0660776559465486
Energy: 1.0371110414832563
Energy: 1.0544753664651954
Energy: 1.046921351133181
Energy: 1.0390668074269909
Energy: 1.036560735456958
Energy: 1.015041473751558
Energy: 1.0289787687456113
Energy: 1.0465726639042434
Energy: 1.0394209158779584
Energy: 1.0272010662211934
Energy: 1.0142354422108206
Energy: 1.0423539705850402
Energy: 1.0492042688558807
Energy: 1.0384713944019563
Energy: 1.013975269199317
Energy: 1.0045875471170653
Energy: 1.0488671216121344
Energy: 1.0186348332638269
Energy: 1.014745645775866
Energy: 1.0329780554063555
Energy: 1.0041499497428663
Energy: 1.0515514252917877
Energy: 1.0124744098912615
Energy: 1.020477949441407
Energy: 1.033853532053192
Energy: 1.0078364912471764
Energy: 1.007345394178979
Energy: 1.071943539102441
Energy: 1.0239566188594929
Energy: 1.0037911127018562
Energy: 1.0090818271374729
Energy: 1.007475568785716
Energy: 1.0719246158387585
Energy: 1.02467946302604
Energy: 1.0139955974301769
Energy: 1.0033030578339213
Energy: 1.0549459345734429
Energy: 1.0072644890935947
Energy: 1.0051403866465136
Energy: 1.0110416311830395
Energy: 1.0032158938065117
Energy: 1.0479729704004788
Energy: 1.0490762439094161
Energy: 1.0058863849979807
Energy: 1.0122689725148453
Energy: 1.00512153296784
Energy: 1.0391217709158704
Energy: 1.063515601407631
Energy: 1.004247068202257
Energy: 1.0601228702519077
Energy: 1.0050662504125736
Energy: 1.0473984680585078
Energy: 1.0250586898664347
Energy: 1.0033912632001167
Energy: 1.0261602918943022
Energy: 1.003976132457508
Energy: 1.0710728717659168
Energy: 1.0448528070864287
Energy: 1.0439379635454793
Energy: 1.003127961772718
Energy: 1.0042881177857297
Energy: 1.0697420689267638
Energy: 1.0485233031492063
Energy: 1.050698654694877
Energy: 1.0055540240090726
Energy: 1.021521843530262
Energy: 1.0161746120018604
Energy: 1.0471925967648472
Energy: 1.054306584857354
Energy: 1.0296055518362628
Energy: 1.0237045631853072
Energy: 1.0171162948835404
Energy: 1.044215970280211
Energy: 1.0320539215151088
Energy: 1.0415857475753134
Energy: 1.0525450556438811
Energy: 1.043119800648969
Energy: 1.0436017836407259
Energy: 1.0117249476933172
Energy: 1.0405069940661478
Energy: 1.0484060343860406
Energy: 1.0438443129813626
Energy: 1.0343696090799366
Energy: 1.0165418638798223
Energy: 1.055755240077758
Energy: 1.0199219600518143
Energy: 1.0163268432993164
Energy: 1.0240787530925022
Energy: 1.028193177561017
Energy: 1.022091986241438
Energy: 1.018807649963507
Energy: 1.0184520796440233
Energy: 1.0315442220270252
Energy: 1.0623001668709224
Energy: 1.0242188253095434
Energy: 1.039295213217116
Energy: 1.0183235673735718
Energy: 1.0686439336037425
Energy: 1.0074143781519587
Energy: 1.0925668417762517
Energy: 1.036703919094733
Energy: 1.0176081863189859
Energy: 1.0359606375630541
Energy: 1.0059875482813572
Energy: 1.0281896521725444
Energy: 0.9986690497334323
Energy: 1.0698648156499346
Energy: 1.008663921585331
Energy: 1.0110379225819839
Energy: 1.0485236767581825
Energy: 0.9994109485891892
Energy: 1.0714151937102245
Energy: 1.0067723750669095
Energy: 1.0292941655000003
Energy: 1.0659409621289921
Energy: 0.9983431094640306
Energy: 1.0163245263861724
Energy: 1.0359111092963138
Energy: 1.0265086978219213
Energy: 1.0650896220090766
Energy: 0.9964589881995765
Energy: 1.0166975456203846
Energy: 1.0320520176154402
Energy: 1.055274283556784
Energy: 1.0185867402385385
Energy: 1.0355580464567447
Energy: 1.0162943392580892
Energy: 1.0288013009503545
Energy: 1.0246097521650082
Energy: 1.0269484848853025
Energy: 1.032448441583112
Energy: 1.0161351776180318
Energy: 1.0231421796684341
Energy: 1.0289959071092194
Energy: 1.0315414815435886
Energy: 1.0648124426388499
Energy: 1.0215884328685392
Energy: 1.0159073229639062
Energy: 1.019994751323292
Energy: 1.0480032833346218
Energy: 1.026622918651696
Energy: 1.0193134739028173
Energy: 1.016043666570087
Energy: 1.0203965610436316
Energy: 1.0471957201494757
Energy: 1.044517642369538
Energy: 1.0161954860169764
Energy: 1.0422682732418307
Energy: 1.045059198943063
Energy: 1.0412989791664045
Energy: 1.059514734569661
Energy: 1.01581784347129
Energy: 1.0227403141824503
Energy: 1.0430386382819141
Energy: 1.0457896528066102
Energy: 1.0431556123626504
Energy: 1.0228013852488422
Energy: 1.01828326447367
Energy: 1.0333338741538525
Energy: 1.025235385528602
Energy: 1.0434367780864549
Energy: 1.0208733888073531
Energy: 1.0177799788884123
Energy: 1.0333714848699438
Energy: 1.0267578595453932
Energy: 1.0566437179240082
Energy: 1.0713095580240994
Energy: 1.0411634360407653
Energy: 1.0157031275232573
Energy: 1.0137178630448445
Energy: 1.0552743834187361
Energy: 1.070325098203527
Energy: 1.0428335143471577
Energy: 1.0142553856369163
Energy: 1.0265921797067157
Energy: 1.0508720100826687
Energy: 1.0152897325312953
Energy: 1.0538419319107062
Energy: 1.0042060583481813
Energy: 1.0390630098513394
Energy: 1.0327212755539383
Energy: 1.0156770905922543
Energy: 1.053487185235716
Energy: 1.004010658511581
Energy: 1.048481247476307
Energy: 1.0376332500640146
Energy: 1.0565684896965666
Energy: 1.007358563351117
Energy: 1.0085391080024337
Energy: 1.0077589538930094
Energy: 1.0382505707967977
Energy: 1.0553344375248876
Energy: 1.0059755051075272
Energy: 1.0080237017585627
Energy: 1.0075636581510283
Energy: 1.0364760798258394
Energy: 1.0479186243322491
Energy: 1.0206664137337627
Energy: 1.0065530887736527
Energy: 1.0282215395076377
Energy: 1.0420787677295338
Energy: 1.036042566553733
Energy: 1.0061562938456614
Energy: 1.0029780754040232
Energy: 1.025808185802833
Energy: 1.042603937772142
Energy: 1.060670312528661
Energy: 1.0503272798726815
Energy: 1.005077756070729
Energy: 1.0311391996054875
Energy: 1.0227608791122214
Energy: 1.0591429943023294
Energy: 1.034335976234784
Energy: 1.004575974268936
Energy: 1.0414566182367813
Energy: 1.0396777210461086
Energy: 1.05982875478917
Energy: 1.0015606891919777
Energy: 1.0005923652203013
Energy: 1.072439538712913
Energy: 1.0339664213648114
Energy: 1.0612333141514274
Energy: 1.0008380712815665
Energy: 1.001299250406947
Energy: 1.0822729215341502
Energy: 1.0253539259582043
Energy: 1.046364912731477
Energy: 1.0344697419856752
Energy: 1.0463399734138243
Energy: 1.0194563897488347
Energy: 1.0287281080308803
Energy: 1.0431184298854854
Energy: 1.0337286580784004
Energy: 1.0192639617059427
Energy: 1.0175789946586395
Energy: 1.0182385168202688
Energy: 1.0304306063295903
Energy: 1.0034512430914264
Energy: 1.0344203235090241
Energy: 1.0417300510320102
Energy: 1.018333411340816
Energy: 1.0309297939843947
Energy: 1.0037176972910815
Energy: 1.05704352907103
Energy: 1.0702802881272773
Energy: 1.02472491466654
Energy: 1.0432930070013433
Energy: 1.0401347543445973
Energy: 1.0196776119028055
Energy: 1.019744146839445
Energy: 1.021280247232379
Energy: 1.0192027578509313
Energy: 1.0457201365541324
Energy: 1.0190814849520144
Energy: 1.0185791459187667
Energy: 1.0173526086517466
Energy: 1.0378090204559727
Energy: 1.0407522537244704
Energy: 1.0296724866335032
Energy: 1.0190048737696444
Energy: 1.0490548523476464
Energy: 1.0476476751474624
Energy: 1.040139985904113
Energy: 1.0319089009644062
Energy: 1.0177092300286694
Energy: 1.0345940724371547
Energy: 1.0055349727127663
Energy: 1.0507479849895853
Energy: 1.0304243143528018
Energy: 1.048127271787735
Energy: 1.0286583088291916
Energy: 1.0082822824252555
Energy: 1.0499173770827288
Energy: 1.0319034582831093
Energy: 1.047011097195948
Energy: 1.0467253363317222
Energy: 1.031203856104098
Energy: 1.0573176347262072
Energy: 0.9974491846274319
Energy: 1.022620012441257
Energy: 1.0473583881139263
Energy: 1.0304118259356603
Energy: 1.049886474662748
Energy: 0.9970991324875939
Energy: 1.031989302839274
Energy: 1.0169152463533417
Energy: 1.0308564764133077
Energy: 1.0394813347039051
Energy: 1.0334350802594061
Energy: 1.0361291734670077
Energy: 1.0293906308027214
Energy: 1.029775824336549
Energy: 1.0394718785274815
Energy: 1.0314512753535747
Energy: 1.0163243050772959
Energy: 1.0203048154016745
Energy: 1.0192139683689645
Energy: 1.0638528909627354
Energy: 1.0306313676850003
Energy: 1.0253701547206444
Energy: 1.0219851260948118
Energy: 1.019381762658196
Energy: 1.0647052575711198
Energy: 1.056389009047961
Energy: 1.0230675759900325
Energy: 1.0708138759489088
Energy: 1.055455738212176
Energy: 1.0216604770217752
Energy: 1.031968472761981
Energy: 1.0172965816634099
Energy: 1.02358121342664
Energy: 1.0449533637951172
Energy: 1.0232187887376725
Energy: 1.0313664664422502
Energy: 1.0168124737753512
Energy: 1.0367584825950193
Energy: 1.0187318554478728
Energy: 1.0328579317723061
Energy: 1.0434585304682542
Energy: 1.027510975968979
Energy: 1.0380767517012506
Energy: 1.0594539924041053
Energy: 1.0424747381637387
Energy: 1.0442021759196045
Energy: 1.0251841163951276
Energy: 1.0741653795727302
Energy: 1.0045558396369467
Energy: 1.017535107003911
Energy: 1.0620741762059427
Energy: 1.0434422819626665
Energy: 1.050072142258393
Energy: 1.018789805163945
Energy: 1.0186753361303533
Energy: 1.0605799620305616
Energy: 1.0410420898236394
Energy: 1.0420797893039033
Energy: 1.0390719181187875
Energy: 1.0321301104808263
Energy: 1.0284218680898831
Energy: 1.0018473050364165
Energy: 1.0455012579163567
Energy: 1.0377227876315505
Energy: 1.0219557148584795
Energy: 1.0374091729428032
Energy: 1.011898309136086
Energy: 1.0258981867684727
Energy: 1.0025252801017237
Energy: 1.006157548388182
Energy: 1.035957033760157
Energy: 0.9969444800146654
Energy: 1.0080291634223713
Energy: 1.0048445947894458
Energy: 1.006836042299734
Energy: 1.0379137238452674
Energy: 0.9968020302405651
Energy: 1.0074732610820005
Energy: 1.009049836170789
Energy: 1.0048273170483177
Energy: 1.0291558576457844
Energy: 1.0387588717946215
Energy: 1.0097038941394072
Energy: 1.0104069195580763
Energy: 1.0070301876588394
Energy: 1.030237749802459
Energy: 1.0378974757504902
Energy: 1.0469893204590066
Energy: 1.0041540470405232
Energy: 1.0512613392350239
Energy: 1.0050477317377389
Energy: 1.0366059973840973
Energy: 1.040840427445447
Energy: 1.042464539471615
Energy: 1.0517283340870232
Energy: 1.0047112382204153
Energy: 1.0347939753458855
Energy: 1.0143411460627563
Energy: 0.9992951207591341
Energy: 1.0288792035254615
Energy: 1.0699531137766018
Energy: 1.0582263700583727
Energy: 1.0059443955000633
Energy: 1.0005343794969783
Energy: 1.0267068909656838
Energy: 1.070845463040346
Energy: 1.0561642272537983
Energy: 1.0257283589709423
Energy: 1.033206798789135
Energy: 1.0163121086709812
Energy: 1.0208523199947817
Energy: 1.0451424724583314
Energy: 1.0243565096684648
Energy: 1.0359305034200021
Energy: 1.016683021855254
Energy: 1.023949120116787
Energy: 1.0446690844755473
Energy: 0.9953506306826224
Energy: 1.0419597996681111
Energy: 1.0184283928342772
Energy: 1.0163041653387235
Energy: 1.062408598591537
Energy: 1.0677900881007314
Energy: 1.0293890747717638
Energy: 1.0171221301541906
Energy: 1.0162597756539202
Energy: 1.0392482888350756

minimum gb energy = 0.9953506306826224 eV
minimum distance =  2.28687373278242 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

Energy: 1.4228879569699866
Energy: 1.028520390309909
Energy: 1.0407371113522843
Energy: 1.0101670252747208
Energy: 1.0260121701904903
Energy: 0.98320204707075
Energy: 1.0282202588027174
Energy: 1.0408670238996645
Energy: 1.0109397811842895
Energy: 1.023657457625768
Energy: 1.0349334055693449
Energy: 1.010003141134931
Energy: 1.014569891417894
Energy: 1.0153650703242323
Energy: 1.0090140822712939
Energy: 1.0165906156914002
Energy: 1.0107747131506881
Energy: 1.013382646298088
Energy: 1.016298258750304
Energy: 1.0178742214835828
Energy: 1.0120408224746764
Energy: 1.0074383262566797
Energy: 1.010689435408058
Energy: 1.0603558786624703
Energy: 1.047833206394732
Energy: 1.040750301421522
Energy: 1.00789533087779
Energy: 1.0104401045858393
Energy: 1.0615495012775868
Energy: 1.048587551599998
Energy: 1.0209055366364692
Energy: 1.041062921550188
Energy: 0.9867979814167506
Energy: 1.040083544298622
Energy: 1.0095437052470018
Energy: 1.0209229977701118
Energy: 1.041153527682438
Energy: 0.9876403141696166
Energy: 1.0369453389281664
Energy: 1.0106700290493702
Energy: 1.0355980202781883
Energy: 0.9887147136392506
Energy: 0.9886358043755451
Energy: 1.0602241689391556
Energy: 1.0164475092534444
Energy: 1.0349560497170651
Energy: 0.9882331418933867
Energy: 0.9890346910747844
Energy: 1.0607044582498966
Energy: 1.018078839526829
Energy: 1.0104301826715456
Energy: 1.043800405162737
Energy: 1.0187660236868976
Energy: 1.0138033598518135
Energy: 1.0100879199702875
Energy: 1.0105316302902256
Energy: 1.0483765442859185
Energy: 1.0185308898640943
Energy: 1.0136919284188015
Energy: 1.0125529839184046
Energy: 1.017358779569698
Energy: 1.0032091761396205
Energy: 1.0329255665577284
Energy: 1.0092132634627597
Energy: 1.0158167053837326
Energy: 1.015648583105534
Energy: 1.0031714190567789
Energy: 1.0345434410196213
Energy: 1.0089799862765638
Energy: 1.0165915388746656
Energy: 1.0483279218651094
Energy: 1.005074333454692
Energy: 1.0671984854549623
Energy: 1.0330961284323006
Energy: 1.010616735204356
Energy: 1.0317103430504457
Energy: 1.0053443713944163
Energy: 1.0775581040365256
Energy: 1.0329057996109585
Energy: 1.0094695914190002
Energy: 1.0386687958303196
Energy: 1.049331597120148
Energy: 1.0462722049886175
Energy: 1.0094955712233502
Energy: 1.0926081052951737
Energy: 1.0369364723467953
Energy: 1.047327798866721
Energy: 1.0473869598661478
Energy: 1.0229136104325014
Energy: 1.0942970220534431
Energy: 1.007102136887689
Energy: 1.0486775605449428
Energy: 1.0252899359561147
Energy: 1.012287151537333
Energy: 1.0103223031477295
Energy: 1.0152961725593121
Energy: 1.0505362154406197
Energy: 1.0205018016460696
Energy: 1.0132503081961262
Energy: 1.0117165169379323
Energy: 1.0086158713271902
Energy: 1.0396248728453898
Energy: 0.9828841685325413
Energy: 0.9830117680074233
Energy: 1.0409633891496735
Energy: 1.0085355869016146
Energy: 1.0353891576505492
Energy: 0.9831615311740518
Energy: 0.9841189724423763
Energy: 1.040627459179886
Energy: 0.9876350426360496
Energy: 1.0195521495534485
Energy: 1.0162602257023736
Energy: 1.0113138271385675
Energy: 1.0173243196504331
Energy: 0.98891612214571
Energy: 1.0190086023793108
Energy: 1.0186716683169081
Energy: 1.0099631013661359
Energy: 1.0112056457830054
Energy: 1.0210018205662332
Energy: 1.0667846889135262
Energy: 1.0038287526349285
Energy: 1.0330549944060488
Energy: 1.012382949885235
Energy: 1.0119194978203867
Energy: 1.0082396237448974
Energy: 1.004032270931387
Energy: 1.0332899348240208
Energy: 1.0165214295155154
Energy: 1.0322249558674244
Energy: 1.0121307995368265
Energy: 1.0079348757682913
Energy: 1.064529689554877
Energy: 0.9879043804349655
Energy: 1.0298416001105093
Energy: 1.0170293367509455
Energy: 1.0079787208591795
Energy: 1.0233685773640315
Energy: 1.044000899268954
Energy: 0.9896841258806292
Energy: 1.0193059287375612
Energy: 1.0074289538771255
Energy: 1.054867381131938
Energy: 0.9868883837337667
Energy: 1.0653221659822307
Energy: 1.0163009610602063
Energy: 1.0073410492183306
Energy: 1.0564244640658575
Energy: 1.0421326306371415
Energy: 1.0162536161787035
Energy: 1.011001836242828
Energy: 1.011097724507503
Energy: 1.0470112609868623
Energy: 1.0150867878201073
Energy: 1.0153825350030894
Energy: 1.0118935153015278
Energy: 1.0104619341893795
Energy: 1.0305972805437074
Energy: 1.0194596700780532
Energy: 1.0112800215296356
Energy: 1.0110314102211426
Energy: 1.0348484268171643
Energy: 1.0173713571927463
Energy: 1.0216609774736023
Energy: 1.0099609274521237
Energy: 1.011230091899917
Energy: 1.0287158300593817
Energy: 1.0091539747413651
Energy: 1.0046064106463666
Energy: 1.0804910485880002
Energy: 1.0338704107513579
Energy: 1.0103232303206682
Energy: 1.038429122272918
Energy: 1.0461340063478228
Energy: 1.0349880213039027
Energy: 1.0361266792624333
Energy: 1.0473276723335092
Energy: 1.0466480794951722
Energy: 1.0465630371562413
Energy: 1.0116084424741492
Energy: 1.0520014522458243
Energy: 1.0909449216879519
Energy: 1.0107324153397632
Energy: 1.0466968098836398
Energy: 1.0124036707278883
Energy: 1.0542260761618418
Energy: 1.0897625196743879
Energy: 1.0123656509595735
Energy: 1.0266658943323839
Energy: 1.0213467961462814
Energy: 1.0511397599461403
Energy: 1.016791884121933
Energy: 1.0171712029584201
Energy: 1.0474032329271503
Energy: 1.0326191383647243
Energy: 1.0471792238654196
Energy: 1.015737783682647
Energy: 1.020062267324464
Energy: 1.0464784078087332
Energy: 0.9845302569172294
Energy: 1.026375432114581
Energy: 1.0185333604607865
Energy: 1.0090642767011315
Energy: 1.0309438447799892
Energy: 0.9840527272524042
Energy: 1.027065025792533
Energy: 1.0186992774341597
Energy: 1.0109452095221685
Energy: 1.0277427815506404
Energy: 1.0218300165945833
Energy: 1.009410933654217
Energy: 1.0076425656685684
Energy: 1.0150083646469577
Energy: 1.0122631729089189
Energy: 1.0199233665108889
Energy: 1.0103274224454215
Energy: 1.0145913028644191
Energy: 1.0151631726083026
Energy: 1.017051959675976
Energy: 1.03474551848395
Energy: 1.0110391790790618
Energy: 1.0130101024734068
Energy: 1.060702318119755
Energy: 1.046592113708081
Energy: 1.0376987223237908
Energy: 1.0072148605919924
Energy: 1.0148705815611259
Energy: 1.0653261165004209
Energy: 1.0101765020392333
Energy: 1.064603792212027
Energy: 0.9899042647496689
Energy: 0.9870377321951141
Energy: 1.046713247567854
Energy: 1.0471818403131095
Energy: 1.0654417575769433
Energy: 0.9896021202289785
Energy: 0.987766875330136
Energy: 1.02970276127031
Energy: 1.0483256103495944
Energy: 1.0279380935699296
Energy: 0.988806126205812
Energy: 0.9942440915315226
Energy: 1.0126973937633514
Energy: 1.0144904667251917
Energy: 1.0339258250469887
Energy: 0.9880294249559692
Energy: 0.9904496646479527
Energy: 1.0150669173584843
Energy: 1.0172501402337721
Energy: 1.0089093789651131
Energy: 1.0246130418804116
Energy: 1.0197687912076903
Energy: 1.0131260156547475
Energy: 1.0189585641109276
Energy: 1.0098946741529358
Energy: 1.017956154142816
Energy: 1.0195249080606497
Energy: 1.0112316794341498
Energy: 1.0103735088079937
Energy: 1.0049717911637392
Energy: 1.0052975149380803
Energy: 1.032896284988268
Energy: 1.008828183195703
Energy: 1.040317138375556
Energy: 1.006941686891642
Energy: 1.0053803365916956
Energy: 1.03501811373093
Energy: 1.0085792823878557
Energy: 1.0416665531047162
Energy: 1.057985407088392
Energy: 1.0323336031154742
Energy: 1.0488905913559348
Energy: 1.0330015141528013
Energy: 1.0377084816457711
Energy: 1.0140145265855611
Energy: 1.046536314760054
Energy: 1.049664691191124
Energy: 1.033470014433616
Energy: 1.0184076360551153
Energy: 1.053112315019275
Energy: 1.0497337704888605
Energy: 1.0459414352720948
Energy: 1.0420442967378687
Energy: 1.0543328798458655
Energy: 1.0403222831395145
Energy: 1.0477698090841212
Energy: 1.0468378807186052
Energy: 1.038574971817537
Energy: 1.0158583205357743
Energy: 1.0175725233866244
Energy: 1.0186852956259032
Energy: 1.0601793792642202
Energy: 1.0272038200108988
Energy: 1.0103902246413121
Energy: 1.0150871954567837
Energy: 1.020116622920189
Energy: 1.0207347922354553
Energy: 1.0224371819898241
Energy: 1.011623162649479
Energy: 1.019654283741372
Energy: 1.0298059623555371
Energy: 0.982849741608549
Energy: 0.9842594555827421
Energy: 1.0160350116625532
Energy: 1.0111550624330143
Energy: 1.0364590712097383
Energy: 0.9828565290831296
Energy: 0.9835909538434469
Energy: 1.0156886829591394
Energy: 1.0140542602875298
Energy: 1.017880308497397
Energy: 1.0240372546798524
Energy: 1.0103811956011843
Energy: 1.0146456471162895
Energy: 1.0140269178204964
Energy: 1.017646077312571
Energy: 1.0249665064928413
Energy: 1.011454424197677
Energy: 1.013922625100311
Energy: 1.054150877603657
Energy: 1.0083433031587317
Energy: 1.0099688718254622
Energy: 1.0357618954792707
Energy: 1.0134579927550216
Energy: 1.0557815604265754
Energy: 1.008152028450496
Energy: 1.0116709387944225
Energy: 1.0342730895444714
Energy: 1.0170776982189291
Energy: 0.9895326552093154
Energy: 1.02979618619729
Energy: 1.0393793771194348
Energy: 1.019816580194513
Energy: 0.9872879657871864
Energy: 1.0357254722821618
Energy: 1.0096586501837799
Energy: 1.0546409182861143
Energy: 1.0180730409978767
Energy: 0.9867030707677602
Energy: 1.0670451431430408
Energy: 1.0111050979805647
Energy: 1.007599773925033
Energy: 1.0543499593008927
Energy: 1.0416557104519841
Energy: 1.0627695852505434
Energy: 1.010918287555491
Energy: 1.007594026828671
Energy: 1.054791755723671
Energy: 0.9869558232465326
Energy: 1.0183811651593582
Energy: 1.0109968131389988
Energy: 1.0127902866564231
Energy: 1.0470420176733604
Energy: 1.0146199153295223
Energy: 1.0169342290480423
Energy: 1.012959901841965
Energy: 1.0115988124117934
Energy: 1.0323517682209729
Energy: 1.0405275976738801
Energy: 1.0413711432168744
Energy: 1.038047457729279
Energy: 1.0346283042248148
Energy: 1.005469121058751
Energy: 1.0065608125199552
Energy: 1.0101011045223716
Energy: 1.0382640504813727
Energy: 1.0321099688021895
Energy: 1.0054487301231183
Energy: 1.0051841779103876
Energy: 1.0107063946760053
Energy: 1.0335534240020066
Energy: 1.0772452521901215
Energy: 1.018861467271645
Energy: 1.0454200606372643
Energy: 1.0376104262112258
Energy: 1.0328258470775076
Energy: 1.078113362942042
Energy: 1.0280378869960938
Energy: 1.0460883009738131
Energy: 1.0106901400207176
Energy: 1.0497659937812953
Energy: 1.0156706197179135
Energy: 1.0107303843333584
Energy: 1.0459988487771839
Energy: 1.0130138173130814
Energy: 1.0488894153053914
Energy: 1.0156733692499738
Energy: 1.0118583690881162
Energy: 1.0459832773918927
Energy: 0.9849475947864865
Energy: 1.049560954660518
Energy: 1.0096668162173696
Energy: 1.0145135475633165
Energy: 1.0492155736966646
Energy: 1.0383733060929248
Energy: 1.03258035608795
Energy: 1.0095913047617142
Energy: 1.0151491371793795
Energy: 1.0360850530683352

minimum gb energy = 0.982849741608549 eV
minimum distance =  2.29023621537103 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.9603852889336967
Energy: 0.9704560362217968
Energy: 1.0597947503110374
Energy: 0.985000890196748
Energy: 0.9689815670109189
Energy: 0.9609802336696814
Energy: 0.9874554360326063
Energy: 1.057984575489624
Energy: 0.9855443182012315
Energy: 0.9680952893164507
Energy: 0.964068385922423
Energy: 0.9795041792242815
Energy: 0.9780807505300363
Energy: 0.9773581772018787
Energy: 0.9805206680359037
Energy: 1.0386977416011318
Energy: 0.9796821809382565
Energy: 0.9674772249688042
Energy: 0.9785828953834704
Energy: 0.9811232124145769
Energy: 0.9812278216798987
Energy: 0.9795037558480925
Energy: 0.9808535669966102
Energy: 0.9857795646297829
Energy: 1.0388611446409042
Energy: 0.97998186663303
Energy: 0.9790486369314493
Energy: 0.9798796075192381
Energy: 1.0597674593122095
Energy: 1.0402091791583317
Energy: 1.0602572405880193
Energy: 0.9631785319016383
Energy: 0.9663663068001161
Energy: 0.9789985228114709
Energy: 1.062610576821385
Energy: 1.0598976007856027
Energy: 0.9627220011466532
Energy: 0.9675802034107459
Energy: 0.980230028604766
Energy: 0.9647852379027362
Energy: 0.980180622255368
Energy: 0.9670473496773323
Energy: 0.9623516946357256
Energy: 0.9856426910926963
Energy: 0.9892968838811078
Energy: 0.979671238446127
Energy: 0.9668786585973188
Energy: 0.9630736206348821
Energy: 0.9808001929057651
Energy: 0.979986462190036
Energy: 0.9794442572178397
Energy: 1.0605515158955714
Energy: 0.9868467388627818
Energy: 0.9797170326400879
Energy: 0.9679594418044105
Energy: 0.9798139017506994
Energy: 1.0590911935912848
Energy: 0.986554969318313
Energy: 0.9809864208585508
Energy: 0.9822143725639535
Energy: 0.9854379977609996
Energy: 0.9652480465585072
Energy: 0.9800727919885217
Energy: 0.9802391134870918
Energy: 0.9812625696937508
Energy: 0.9838848304792845
Energy: 0.964044320492504
Energy: 0.983798561939653
Energy: 0.9800619549692736
Energy: 0.9806060059602923
Energy: 0.9831663602285051
Energy: 1.0345547801939619
Energy: 0.9858956074209686
Energy: 0.9619301034776876
Energy: 0.9669835302852249
Energy: 0.9840114624462133
Energy: 1.0343776908922624
Energy: 0.9838362808084902
Energy: 0.9617960330796016
Energy: 0.9672134714681899
Energy: 0.9791536373279873
Energy: 0.9670357873463561
Energy: 0.977772303585693
Energy: 0.9656215954333425
Energy: 1.042666868934632
Energy: 0.9793323176265412
Energy: 0.9779210499820117
Energy: 0.977951830139881
Energy: 0.964484210567288
Energy: 1.044936908167022
Energy: 0.9809557037109844
Energy: 0.9814544976338964
Energy: 1.035274327762972
Energy: 1.0605962650288034
Energy: 0.9856192685723418
Energy: 0.9861652799899964
Energy: 0.9832311950107032
Energy: 1.0358650590430627
Energy: 0.9821595417297693
Energy: 0.9798417363821964
Energy: 0.964117314792039
Energy: 0.9892004300224898
Energy: 0.9767164662052749
Energy: 0.981256930089542
Energy: 1.041923889787826
Energy: 0.9647068247644187
Energy: 0.9896398860623782
Energy: 0.9631716752671562
Energy: 0.9833492185291214
Energy: 1.0405528732977445
Energy: 0.9605780336684203
Energy: 0.9850733544346515
Energy: 1.0572035504992268
Energy: 0.9851049422086253
Energy: 0.96915785534807
Energy: 0.9613411446624519
Energy: 0.986248114190841
Energy: 1.0588575923554844
Energy: 0.9856491283459479
Energy: 0.9682566327552046
Energy: 1.041946059720256
Energy: 0.9796858650719605
Energy: 0.9782406736519298
Energy: 0.9777289380222688
Energy: 0.9800798750470895
Energy: 1.0391207758196774
Energy: 0.9795208334060815
Energy: 0.9674031455979561
Energy: 0.978077312441056
Energy: 0.9818090889242772
Energy: 0.981519708464949
Energy: 0.9797732371286121
Energy: 0.9810279455035608
Energy: 1.060140042525111
Energy: 1.0387306407881147
Energy: 0.9800489372715397
Energy: 0.9792347660647235
Energy: 0.9801969634570022
Energy: 1.058542923904791
Energy: 1.0395185573662424
Energy: 1.0606760085732045
Energy: 0.9634328643494872
Energy: 0.9663023246639334
Energy: 0.9788510154560435
Energy: 1.0628024220906818
Energy: 1.0599739374966004
Energy: 0.9627438398847703
Energy: 0.9673929684426518
Energy: 0.9796414205204876
Energy: 1.0396476377132242
Energy: 0.9804852194131867
Energy: 0.9672670997266043
Energy: 0.9622118927506975
Energy: 0.9812565732015365
Energy: 0.9849981796751975
Energy: 0.9795662904666582
Energy: 0.9670233446946028
Energy: 0.9628506792269649
Energy: 0.9801602699503802
Energy: 0.9800738757337929
Energy: 0.9793919841875485
Energy: 1.0606814545539356
Energy: 0.9872458625774343
Energy: 0.9793716690911313
Energy: 0.9680880260580018
Energy: 0.9800327387875112
Energy: 1.0594587110436484
Energy: 0.9869554343531936
Energy: 0.980401807625438
Energy: 0.9827114194930018
Energy: 0.9927540225945867
Energy: 0.9652065489838558
Energy: 0.9807287928315175
Energy: 0.9805594326088527
Energy: 0.9815327896929741
Energy: 0.9837941659307686
Energy: 0.9640049333231162
Energy: 0.9848025135436536
Energy: 0.9798454175361975
Energy: 0.9804164586081228
Energy: 0.9855063952413144
Energy: 1.0347890068844072
Energy: 0.9871884101065058
Energy: 0.9620547647530828
Energy: 0.967089918543057
Energy: 1.0283376750114366
Energy: 1.0341359357493547
Energy: 0.984345484808875
Energy: 0.9617408571143966
Energy: 0.9675711927122711
Energy: 0.9794152885646614
Energy: 0.9673022739048225
Energy: 0.9783646266349004
Energy: 0.9653696434797735
Energy: 1.043193621712299
Energy: 0.9792781571311586
Energy: 0.9777005502488042
Energy: 0.9784097924659351
Energy: 0.9647844145522383
Energy: 0.9818626264864898
Energy: 0.9809728043674077
Energy: 0.9815008180784626
Energy: 1.0346007936865735
Energy: 1.0605198269828946
Energy: 0.9849021439865993
Energy: 0.9843972023163725
Energy: 0.9828352146269843
Energy: 1.0375353146896775
Energy: 0.9819189578106167
Energy: 0.980137867121769
Energy: 0.9640090856881842
Energy: 0.9888898729362942
Energy: 0.9768214023316588
Energy: 0.9813739034074214
Energy: 1.042901914058888
Energy: 0.9646894653358339
Energy: 0.9892367120811415
Energy: 0.9630950526681616
Energy: 0.9823933884225956
Energy: 1.0412047020308806

minimum gb energy = 0.9603852889336967 eV
minimum distance =  2.30353131957705 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.6333646232210268
Energy: 1.0843440548614214
Energy: 1.0882905153490723
Energy: 1.0225397885631642
Energy: 1.1110809898782743
Energy: 1.0935020080396245
Energy: 1.067597501414218
Energy: 1.0801757005025385
Energy: 0.9989952314631829
Energy: 1.0415509809467773
Energy: 0.950131460285039
Energy: 1.043926573877326
Energy: 0.9915295378595862
Energy: 0.9930918337460818
Energy: 0.9873576841236542
Energy: 0.9598704548831104
Energy: 1.0469425612748735
Energy: 0.9891338099425792
Energy: 1.0681142597152693
Energy: 1.0968407350967115
Energy: 1.082097688816252
Energy: 0.9880745612790629
Energy: 0.9661419621768356
Energy: 1.0262195109254273
Energy: 0.9794739266809515
Energy: 1.0811486522915823
Energy: 1.0145070748117213
Energy: 0.9654188462247806
Energy: 1.0191623782592167
Energy: 1.0996228985936423
Energy: 1.0223391105406903
Energy: 0.9722652196289608
Energy: 1.0260478198619538
Energy: 1.0890240540058742
Energy: 1.106798142605584
Energy: 1.028071755531952
Energy: 1.040592588229162
Energy: 1.0270424556466025
Energy: 1.1035754538354832
Energy: 1.1005072372273041
Energy: 1.1084267820373048
Energy: 1.0459368562984157
Energy: 0.9609331975505764
Energy: 0.9668143693125377
Energy: 1.0786158836377475
Energy: 1.0786550714823468
Energy: 1.0444658693075963
Energy: 1.0121180603558937
Energy: 0.9671346333793913
Energy: 0.9505392840023913
Energy: 0.9520455146044078
Energy: 0.9658566750974549
Energy: 0.9660444409519844
Energy: 1.077233064313024
Energy: 1.2005455323588847
Energy: 0.9710677682281494
Energy: 0.96606168111466
Energy: 0.9660763709503101
Energy: 1.1104631726405871
Energy: 1.2420563405912048
Energy: 0.9686364600052125
Energy: 0.966504533658986
Energy: 0.9680106749512015
Energy: 0.9763396254977945
Energy: 1.0557730489023804
Energy: 0.9693032483173525
Energy: 0.9665769846286397
Energy: 0.9671503869700349
Energy: 0.9918056123528939
Energy: 1.0925535628888527
Energy: 0.9715914598715666
Energy: 0.968804592236293
Energy: 0.977619431007594
Energy: 1.064315612433338
Energy: 1.0703758141188384
Energy: 0.9702648723567465
Energy: 0.9658543321619748
Energy: 0.9676236828860394
Energy: 1.0623464413896593
Energy: 1.084139720299316
Energy: 0.9732423926579936
Energy: 1.201118978160319
Energy: 1.0331722610445975
Energy: 1.0609502241766584
Energy: 0.9686295598396926
Energy: 0.9724722088553832
Energy: 1.1973052661736343
Energy: 1.037801319919123
Energy: 1.1165801348667053
Energy: 0.977108131524815
Energy: 1.0558417787217707
Energy: 0.9686481579186407
Energy: 0.9814535281438179
Energy: 0.9747856849717835
Energy: 0.9786615402289962
Energy: 0.9739847047487864
Energy: 0.9693280141378691
Energy: 0.9803416709806336
Energy: 0.9752932704321231
Energy: 0.9795871425691265
Energy: 1.0660532624283858
Energy: 0.968125793771266
Energy: 0.9736955275820417
Energy: 0.9758046880428478
Energy: 0.9772750620475478
Energy: 1.0315353430244003
Energy: 0.9820113268116445
Energy: 0.9746912076621744
Energy: 0.9749816247792172
Energy: 0.9774279874024115
Energy: 1.1067442609490161
Energy: 1.0745164492526869
Energy: 0.9743616896322754
Energy: 0.9585839353840693
Energy: 1.1173681759583514
Energy: 1.106405870482344
Energy: 1.0770780001929974
Energy: 0.9591059162475016
Energy: 0.9596717542264818
Energy: 1.0575155604587703
Energy: 1.0659869037129364
Energy: 1.0531298510147309
Energy: 0.9737701135297809
Energy: 0.9790126002449696
Energy: 1.0549736851391542
Energy: 1.0673652650017087
Energy: 1.0127034222578757
Energy: 0.9721773205755703
Energy: 1.0926338159357427
Energy: 1.091636730900356
Energy: 0.9874875956130965
Energy: 1.0632734161416655
Energy: 1.0927652978678684
Energy: 1.0625247977609573
Energy: 1.0540183916598778
Energy: 0.9878703751264533
Energy: 1.065149309050402
Energy: 0.9478340354575099
Energy: 1.0659623043295339
Energy: 1.0528608229161125
Energy: 0.9668918847546787
Energy: 1.0301838482391483
Energy: 1.1064287130097745
Energy: 1.0412167546875557
Energy: 1.0418114320552339
Energy: 1.003061425916882
Energy: 0.9809221547879634
Energy: 1.107180680896696
Energy: 0.9906190422533522
Energy: 1.0432888633965265
Energy: 1.1507095972064783
Energy: 1.1079124410825507
Energy: 0.9766173778465496
Energy: 1.0342216057175384
Energy: 1.0266316124020456
Energy: 1.1021863354579755
Energy: 1.1069394888099244
Energy: 0.9779880245488316
Energy: 1.0230457281610752
Energy: 1.012223761389298
Energy: 0.9590092541823375
Energy: 0.9741890849267411
Energy: 1.178293308548774
Energy: 1.1053162680474287
Energy: 1.0786637837194253
Energy: 0.9605840981032024
Energy: 0.9816271843504527
Energy: 1.1196714086077382
Energy: 1.1168498288929634
Energy: 1.064682647106384
Energy: 1.0995342113702036
Energy: 1.1753354042995932
Energy: 1.18112740678167
Energy: 1.0261306366951608
Energy: 0.9701083561998779
Energy: 1.0858313674558322
Energy: 1.1752457083334324
Energy: 1.180995964269318
Energy: 1.029113646663915
Energy: 0.9680982326841241
Energy: 0.9675155621703507
Energy: 1.0222877513877806
Energy: 0.9888542960824003
Energy: 0.9666827575644612
Energy: 0.9721695050564445
Energy: 0.9681096566610848
Energy: 0.9739113904623766
Energy: 0.9747015103907777
Energy: 0.9666365270678462
Energy: 0.9754105459966261
Energy: 0.9615898605603262
Energy: 1.0787665559427249
Energy: 1.000894683458951
Energy: 0.9670761689738891
Energy: 0.9685860314226787
Energy: 0.9637114990682515
Energy: 1.0791191471942556
Energy: 1.0139049442583694
Energy: 0.9668698140941115
Energy: 0.9694055333142695
Energy: 1.076906425512612
Energy: 0.9637332154227358
Energy: 0.9753769039462166
Energy: 0.9689341371804462
Energy: 0.9822077363196674
Energy: 1.0752562325365798
Energy: 0.9653399559064613
Energy: 0.9743428865061831
Energy: 0.9525175230887409
Energy: 1.0559746806574082
Energy: 0.9773525520041829
Energy: 0.9753688798809759
Energy: 1.0750851725985993
Energy: 1.1987636858261976
Energy: 0.9732648365248439
Energy: 0.9768434820744977
Energy: 0.975379299141712
Energy: 1.0247282134418838
Energy: 1.193157635566044
Energy: 0.9735962564815667
Energy: 0.9845927429867048
Energy: 0.9779344634667042
Energy: 0.9657217774340449
Energy: 1.0213831276249723
Energy: 0.9840745316921268
Energy: 0.9813420950116687
Energy: 0.9761876130451997
Energy: 0.9623316431001817
Energy: 0.9786649464548195
Energy: 0.9815946139292306
Energy: 0.9604475617811445
Energy: 0.969234080390913
Energy: 1.1064219951682848
Energy: 1.107297097092842
Energy: 1.1337760195990216
Energy: 0.9620255638216584
Energy: 0.9693731791028123
Energy: 1.1056840520328501
Energy: 1.121361451428072
Energy: 1.131076890059371
Energy: 0.9691811805239102
Energy: 1.0617902746106767
Energy: 1.028779615360792
Energy: 1.0531981283516365
Energy: 0.9520137206231959
Energy: 0.96927604862591
Energy: 1.1165828431219207
Energy: 1.028185869494932
Energy: 1.0591500373628788
Energy: 0.9701775806437205
Energy: 1.0304437298927003
Energy: 1.05282124028632
Energy: 0.9864172875099192
Energy: 1.0719794620546683
Energy: 1.0515650309217899
Energy: 0.9680580447318624
Energy: 1.0373956480471689
Energy: 0.9859537732239776
Energy: 1.0588822650807066
Energy: 1.0531482597572128
Energy: 1.0796921144629594
Energy: 1.0121098091792196
Energy: 1.0715438494635083
Energy: 1.0243397181501008
Energy: 0.9766314095828591
Energy: 1.0788258057410827
Energy: 1.0076921887443346
Energy: 1.0339275213817491
Energy: 1.0238850855755026
Energy: 1.1079376674553358
Energy: 0.9789130372248118
Energy: 1.0969420854399985
Energy: 1.025882237713966
Energy: 1.1205729581359674
Energy: 1.1073255899217571
Energy: 0.9858603334394747
Energy: 1.1053818720681856
Energy: 1.0182153568438073
Energy: 1.1173525170853738
Energy: 1.1094474460295352
Energy: 1.1227911474586538
Energy: 1.0452584407494434
Energy: 1.0615363356820298
Energy: 0.9680806545778317
Energy: 1.0250080629097302
Energy: 1.1239011989307393
Energy: 1.0618554298423242
Energy: 1.0621001266719394
Energy: 1.0313657562480774
Energy: 1.0229684033821531
Energy: 1.1800105731731827
Energy: 0.9664088839028272
Energy: 0.9672484214297115
Energy: 1.125578447669042
Energy: 1.1827593780283967
Energy: 1.144660359080257
Energy: 0.9667090053249644
Energy: 0.9670579299380926
Energy: 1.1308117431667912
Energy: 1.240082885454958
Energy: 0.9690555415567519
Energy: 0.9659778721411522
Energy: 0.9676583275270013
Energy: 0.9788851340708321
Energy: 1.052411866136995
Energy: 0.9684224900589654
Energy: 0.9661579625090374
Energy: 0.9667431925002603
Energy: 0.983843680630601
Energy: 1.1274509214756858
Energy: 0.9711797285689765
Energy: 0.9683749711030863
Energy: 0.9759480278471463
Energy: 0.9621987385696318
Energy: 1.074853313542902
Energy: 0.9698304710996024
Energy: 0.9681799386702321
Energy: 0.9763124007101135
Energy: 0.9656216758905226
Energy: 1.0734231946448733
Energy: 0.9795416759618019
Energy: 0.9703529122713322
Energy: 1.0294404611760115
Energy: 1.0792231169642064
Energy: 0.9612769336937399
Energy: 0.989392799955598
Energy: 0.9795349211738286
Energy: 1.0056650872930644
Energy: 1.0609710433268924
Energy: 0.9635140198719854
Energy: 0.9769192443630295
Energy: 1.1880838739820003
Energy: 1.0142339680356047
Energy: 0.9591872731524611
Energy: 0.9796894409448268
Energy: 0.982401410810969
Energy: 0.9529459824208947
Energy: 0.9621582980985289
Energy: 0.9606043861173569
Energy: 0.9804241348509946
Energy: 1.0729188079474061
Energy: 0.9604141409026079
Energy: 0.9733474892313371
Energy: 0.9765279537248021
Energy: 0.9774940138406902
Energy: 1.0306222626737864
Energy: 0.9832614951054387
Energy: 0.9742543604024455
Energy: 0.9741074469070049
Energy: 0.9777994775616266
Energy: 1.1068778311500782
Energy: 1.0632291008203536
Energy: 0.9586108592253689
Energy: 0.9585273582125144
Energy: 1.0545457592982668
Energy: 1.1060601774724848
Energy: 1.0778467518071984
Energy: 0.9585534166890632
Energy: 0.9585087210189575
Energy: 1.053463229977476
Energy: 1.066218454820602
Energy: 0.9599576861777972
Energy: 0.9707331355554312
Energy: 0.9775164950850176
Energy: 1.0453573877079705
Energy: 1.0673346013033926
Energy: 0.9590673710482333
Energy: 0.9695801149921365
Energy: 0.9802680144609014
Energy: 1.0581874721265818
Energy: 0.9859830682953529
Energy: 1.0724624273243086
Energy: 1.0633272332548758
Energy: 0.9729910122471285
Energy: 0.9871346978958331
Energy: 0.9862114039308654
Energy: 1.0739154209275528
Energy: 0.9695977051673643
Energy: 0.9700679911508919
Energy: 0.9875825046946931
Energy: 0.9673540958653027
Energy: 1.027587618288903
Energy: 1.1065284456948534
Energy: 0.9910217039946005
Energy: 1.046997310936694
Energy: 1.0035778859628444
Energy: 1.0291461998396099
Energy: 1.1069105478091135
Energy: 0.9895158560773653
Energy: 1.069286895588429
Energy: 1.1043465048215166
Energy: 1.1073063082473305
Energy: 1.1118201446880374
Energy: 1.1072826133074898
Energy: 1.0090715594441386
Energy: 1.0960581849596256
Energy: 1.1061407481252403
Energy: 0.9777632921353956
Energy: 1.107036819396723
Energy: 0.9756400254620241
Energy: 0.9587724264588456
Energy: 1.092240072405073
Energy: 1.0205108034503108
Energy: 1.1177610875285653
Energy: 1.0597212202006516
Energy: 0.9604677762543866
Energy: 1.0830745654506706
Energy: 1.0209184673915428
Energy: 1.1212322738176488
Energy: 1.0630727717787019
Energy: 1.1410942852359753
Energy: 1.178508507213244
Energy: 1.1774557146116127
Energy: 1.00347288889059
Energy: 0.9690498954078617
Energy: 1.1377453068338177
Energy: 1.1782154325999612
Energy: 1.1766854804014304
Energy: 1.0614723324218391
Energy: 0.9671171654048454
Energy: 0.9674537658131895
Energy: 0.9749118290580878
Energy: 0.9736541480941329
Energy: 0.9667871098047096
Energy: 0.972761779856985
Energy: 0.9681787057068597
Energy: 1.0136665346648737
Energy: 0.9732526818942996
Energy: 0.9693932666532576
Energy: 0.9741038587269139
Energy: 0.9779546135272749
Energy: 1.0790111762042973
Energy: 1.0166631711811147
Energy: 0.9663430496584855
Energy: 0.9683178345174172
Energy: 1.030261477400125
Energy: 1.0796293773985588
Energy: 1.0466741082694184
Energy: 0.9659993194014144
Energy: 0.9685871430516401
Energy: 1.0740339576491307
Energy: 0.9654452752328427
Energy: 0.9841263549317293
Energy: 0.9729301236595127
Energy: 1.041618200511162
Energy: 1.0522744880347148
Energy: 0.9621404251955773
Energy: 0.9757117885262228
Energy: 0.9724111588939602
Energy: 1.0580997833262995
Energy: 0.9693059483763807
Energy: 0.9671404712974973
Energy: 1.068948009796791
Energy: 1.1949390123701842
Energy: 0.9731862282256653
Energy: 0.9603438823037785
Energy: 0.959178434958526
Energy: 1.0210397280870847
Energy: 1.1980805869861084
Energy: 0.9740218983142942
Energy: 0.9742512665128052
Energy: 0.9668264842734479
Energy: 0.9736585259476828
Energy: 0.9666808792013981
Energy: 0.9752220948204248
Energy: 0.9774445469595251
Energy: 0.9745403636716649
Energy: 0.981839010430634
Energy: 0.9664586252377365
Energy: 0.9714781949319453
Energy: 0.9687770765757214
Energy: 0.9629823426260724
Energy: 1.1094366221242935
Energy: 1.1062659599798403
Energy: 1.0861233234132603
Energy: 0.9617911933075463
Energy: 1.0182420115953594
Energy: 1.1086289133578966
Energy: 1.0692048150062556
Energy: 1.0021231836758764
Energy: 0.9673124772613926
Energy: 1.0601549889836734
Energy: 1.0668034501475778
Energy: 0.9692090025012468
Energy: 0.9487922076700709
Energy: 0.9702215675314282
Energy: 1.0603433723512297
Energy: 1.030140201227397
Energy: 0.9685933155051117
Energy: 0.9520256770902581

minimum gb energy = 0.9478340354575099 eV
minimum distance =  2.27632080975682 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.3157933784506664
Energy: 0.9140386329470392
Energy: 1.0425371849331253
Energy: 0.9115916189915818
Energy: 0.9158127431928393
Energy: 1.3134059552621924
Energy: 0.9536098696578501
Energy: 1.0448290001896117
Energy: 1.0007180392881223
Energy: 0.9197696027587197
Energy: 0.8914610887924347
Energy: 1.0299011945215262
Energy: 0.900706641564163
Energy: 1.0827983574629259
Energy: 0.9275229311580223
Energy: 0.8948624098544162
Energy: 1.0288294847646473
Energy: 0.8992195544827349
Energy: 1.0286015506499462
Energy: 0.9055793787525979
Energy: 0.9920877275908884
Energy: 1.008145405467601
Energy: 1.0275425833390281
Energy: 0.9301399076534854
Energy: 0.9005644464094065
Energy: 0.9913642348245111
Energy: 1.0085051961023694
Energy: 1.0276744097073511
Energy: 0.928214321710115
Energy: 0.9913596488402932
Energy: 0.9274892809637536
Energy: 0.9315232140488136
Energy: 0.9331289875867809
Energy: 0.9929967830651629
Energy: 0.9905510091361386
Energy: 0.9289095362675068
Energy: 0.9295866041822688
Energy: 1.0251142209419881
Energy: 0.9934782549781159
Energy: 0.9007053648717822
Energy: 0.9228843849059319
Energy: 0.9543227844670782
Energy: 0.928566072956748
Energy: 0.9383539650535588
Energy: 0.9335866190944261
Energy: 0.9218652807193572
Energy: 1.0321754813477064
Energy: 0.9284354540569421
Energy: 0.9297094439407408
Energy: 0.8937470461593063
Energy: 0.9499395554267849
Energy: 0.9270347317395808
Energy: 0.8938736198248243
Energy: 0.9254850505744053
Energy: 0.9699221497664982
Energy: 0.9506565883031263
Energy: 0.9263439354672595
Energy: 0.8937854281809587
Energy: 0.9241634484112463
Energy: 1.3160229874709737
Energy: 0.9947607383821857
Energy: 0.9912847554561203
Energy: 0.9896848945694504
Energy: 0.9299077167589596
Energy: 0.9341695433753895
Energy: 0.9930419368825499
Energy: 0.990355773859521
Energy: 0.9900653481779931
Energy: 0.9296709265247867
Energy: 0.9343970225593818
Energy: 1.0058783748371372
Energy: 0.9913514645401095
Energy: 0.9266327270254149
Energy: 0.927439650938585
Energy: 1.02816086957465
Energy: 1.0066966248210085
Energy: 0.8936512694617222
Energy: 0.9266289613756772
Energy: 0.928309399847526
Energy: 1.028183142789823
Energy: 0.9269694983579726
Energy: 1.0237469468273326
Energy: 0.9534349353369442
Energy: 0.9364749014561916
Energy: 0.92701144486229
Energy: 0.9255208163813874
Energy: 1.0230323346767363
Energy: 0.9558279550188419
Energy: 0.9410748109407735
Energy: 0.9258958140946881
Energy: 0.8977160158578387
Energy: 0.9282355750351646
Energy: 0.9003278244749926
Energy: 0.8996515329267155
Energy: 0.9629544638401523
Energy: 0.9264271098815325
Energy: 0.9316125383298636
Energy: 0.9013436534088661
Energy: 0.8999261106003391
Energy: 0.9599417577262881
Energy: 0.8957368550226629
Energy: 0.8946941479137166
Energy: 0.9015124233954848
Energy: 0.9700054659798966
Energy: 0.89638187280266
Energy: 0.8950881976839924
Energy: 0.8944191670665483
Energy: 0.9558085063977266
Energy: 0.9700743808712037
Energy: 0.9316814214917856
Energy: 0.9023264219531635
Energy: 0.8999537271181475
Energy: 0.8998719135366072
Energy: 1.0046233111157832
Energy: 0.8973428969947557
Energy: 0.8967551619355496
Energy: 0.9033853948168956
Energy: 0.9011746106009296
Energy: 1.0043815844737516
Energy: 0.8962556825205117
Energy: 0.8955700585425692
Energy: 0.8989246878619994
Energy: 0.9468470715706955
Energy: 1.0257621726281743
Energy: 0.8965144539875395
Energy: 0.8960527150516304
Energy: 0.9043793256478311
Energy: 0.9458630087266224
Energy: 1.0260898288087086
Energy: 0.8955296240146605
Energy: 0.9459575160128685
Energy: 0.902975370947825
Energy: 1.078257066993758
Energy: 0.8967184763445257
Energy: 0.9037714308496106
Energy: 1.0880910354886604
Energy: 0.9545463524680516
Energy: 1.1307382981273684
Energy: 0.8964120534888508
Energy: 0.9473266910928904

minimum gb energy = 0.8914610887924347 eV
minimum distance =  2.33287445980634 Angstroms
sigma value = 33