Model name: model_name=MEAM_LAMMPS_LeeShimBaskes_2003_Au__MO_774911580446_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.0729350447654715
cohesive_energy=3.930309114047675
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4168416475087818e-19, 2.0537501182928997e-19, 2.56953884207652e-19, 3.0123804637141195e-19, 3.4030552141486793e-19, 3.7528103733508795e-19, 4.0685353008469195e-19, 4.35484426534272e-19, 4.61497366363896e-19, 4.851374825985659e-19, 5.0659222990446e-19, 5.260058041786379e-19, 5.43501573021918e-19, 5.591772692089739e-19, 5.7311460374814e-19, 5.8538727676458e-19, 5.960561709703859e-19, 6.051741581944799e-19, 6.12787701559248e-19, 6.18941662010442e-19, 6.23672889610644e-19, 6.27015030069168e-19, 6.29000126918694e-19, 6.29655417162e-19, 6.289360398533339e-19, 6.265744314948179e-19, 6.222213175802399e-19, 6.154473147716879e-19, 6.057269091332099e-19, 5.924144234813039e-19, 5.747103716756039e-19, 5.51619802026396e-19, 5.21894618935794e-19, 4.83966291479112e-19, 4.358320988638499e-19, 3.7493977371204603e-19, 2.97979219097856e-19, 2.0063417116928399e-19, 7.721514048133259e-20, -7.988548827722039e-20, -2.8095769453824e-19, -5.40132195560616e-19, -8.77137233109444e-19, -1.3200541570488417e-18, -1.90969841712996e-18, -2.70686140137666e-18, -3.80467283099346e-18, -5.3506130651400595e-18, -7.58745992916648e-18, -1.0934166591097379e-17, -1.6156509394919397e-17, -2.4759076395855596e-17, -3.9989367478659594e-17, -6.98055542020728e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.011941940401323237
Energy: 0.4373337450925911
Energy: 0.4374589052018712
Energy: 0.01214819769988765
Energy: 0.4447191921224602
Energy: 0.01240645646312679
Energy: 0.4373337450925911
Energy: 0.522369677343311
Energy: 0.2576921378088449
Energy: 0.25829781535730384
Energy: 0.5151207772286147
Energy: 0.2566644147259355
Energy: 0.4374589052014045
Energy: 0.25769213780739003
Energy: 0.06824470120655231
Energy: 0.4383124535193959
Energy: 0.2569286747387943
Energy: 0.06913939483871742
Energy: 0.012148197699420998
Energy: 0.2582978153597195
Energy: 0.4383124535203567
Energy: 0.01211399095214701
Energy: 0.2567157072400685
Energy: 0.012402539251394265
Energy: 0.4447191921311619
Energy: 0.5151207772307833
Energy: 0.2569286747332493
Energy: 0.25671570724273113
Energy: 0.5076684855613953
Energy: 0.25875905048040426
Energy: 0.012406456463373843
Energy: 0.2566644147215984
Energy: 0.06913939483871742
Energy: 0.012402539251641318
Energy: 0.25875905048257286
Energy: 0.012644422921781147

minimum gb energy = 0.011941940401323237 eV
minimum distance =  2.87057304532 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.9210655553920889
Energy: 0.9822431642707115
Energy: 0.8602216573972926
Energy: 0.9222329713791534
Energy: 1.0520414781326346
Energy: 0.8666148961570459
Energy: 0.9649435011859061
Energy: 0.7035755636452091
Energy: 0.7299874602816073
Energy: 0.8656492976996083
Energy: 0.7035271261941315
Energy: 0.7297423621154322
Energy: 0.8949126197486792
Energy: 0.6975511424375989
Energy: 0.7143507717331166
Energy: 0.8946012990879373
Energy: 0.697376652147938
Energy: 0.7269788033156398
Energy: 0.9693492325622637
Energy: 0.9315582556215867
Energy: 0.8353729126429692
Energy: 0.9706618992366105
Energy: 0.940057146365907
Energy: 0.8143883642568612
Energy: 0.8802137259540349
Energy: 0.6672295075028869
Energy: 0.6759997686507917
Energy: 0.8200352455534958
Energy: 0.6749869392418968
Energy: 0.6819341708257203
Energy: 0.8204415027743938
Energy: 0.6679038734449478
Energy: 0.6644285585775213
Energy: 0.819823574609415
Energy: 0.743913374949808
Energy: 0.663127121244724
Energy: 0.8519381785047644
Energy: 0.7683334859383442
Energy: 0.7637909158870442
Energy: 0.8532394030085984
Energy: 0.8246546171391922
Energy: 0.7119822553564594
Energy: 0.8533093053064172
Energy: 0.7472567137660376
Energy: 0.7027107469791822
Energy: 0.7974667564523233
Energy: 0.7954824711196258
Energy: 0.7435873864324899
Energy: 0.7283966552871913
Energy: 0.6833226796853682
Energy: 0.6649923670849905
Energy: 0.7096463141999387
Energy: 0.8009555136144461
Energy: 0.6654679458142703
Energy: 0.7237930176354528
Energy: 0.7438925440402895
Energy: 0.7116912925123955
Energy: 0.7245146468134113
Energy: 0.7684852109348216
Energy: 0.7040733256168541
Energy: 0.9379234443456189
Energy: 0.8701540340999793
Energy: 0.7911654418868361
Energy: 0.9383524958389334
Energy: 0.8912800577669884
Energy: 0.847054636854657
Energy: 0.6868360370788946
Energy: 0.745160234319701
Energy: 0.6689617422936417
Energy: 0.6857018719271167
Energy: 0.8959294061255526
Energy: 0.6344357188957747
Energy: 0.6704075294129502
Energy: 0.7018914440542495
Energy: 0.6069600612034488
Energy: 0.6706926944028809
Energy: 0.9684973644156392
Energy: 0.6526788654004925
Energy: 1.0557320124979066
Energy: 0.9489462036408358
Energy: 0.8693068465102363
Energy: 1.0559583890954125
Energy: 0.9703246110636617
Energy: 0.9168476864311107
Energy: 0.6771309461839691
Energy: 0.701892770739615
Energy: 0.6874458330841297
Energy: 0.6780316712724945
Energy: 0.7847483831703134
Energy: 0.6813759840061506
Energy: 0.6943803028328761
Energy: 0.7845116007224329
Energy: 0.686327484968234
Energy: 0.6953463414768897
Energy: 0.8534376514735473
Energy: 0.6877016033681216
Energy: 0.8672413481944606
Energy: 0.8310845870888326
Energy: 0.7754434825500094
Energy: 0.8412239623290431
Energy: 0.8450736095998851
Energy: 0.7989159718222818
Energy: 0.7307122442650835
Energy: 0.7239803420537093
Energy: 0.719228159195797
Energy: 0.7314994163886689
Energy: 0.802968669508073
Energy: 0.7071718261547827
Energy: 0.7678127675659208
Energy: 0.698536124694489
Energy: 0.6860180369325982
Energy: 0.7683739243961069
Energy: 0.7686552668890111
Energy: 0.6843530771663731
Energy: 0.8674656866104623
Energy: 0.7447882520857222
Energy: 0.7410137457590127
Energy: 0.8110503811531878
Energy: 0.7734969395906909
Energy: 0.7364074741651838
Energy: 0.8904966791814157
Energy: 0.8334407551853572
Energy: 0.792638929514475
Energy: 0.8915849913820673
Energy: 0.8664618371421922
Energy: 0.7543539825208917
Energy: 0.8327579137224006
Energy: 0.6713910450500403
Energy: 0.6731712334774501
Energy: 0.8344275065313919
Energy: 0.674403119206808
Energy: 0.6924153897417052
Energy: 0.9650685044214597
Energy: 0.7294987557257068
Energy: 0.7466104570905197
Energy: 0.9879353277955446
Energy: 0.7295365277621526
Energy: 0.7539533812523651

minimum gb energy = 0.6069600612034488 eV
minimum distance =  2.65671398029184 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.0043980754825244
Energy: 0.8525494158943158
Energy: 0.8319346697513926
Energy: 0.9742797835592518
Energy: 0.9501929558893225
Energy: 0.8110192626517173
Energy: 0.9221830375417421
Energy: 0.6567288027459107
Energy: 0.650361107911165
Energy: 0.8479878376855111
Energy: 0.6900029319169981
Energy: 0.6713760588176804
Energy: 0.8939792433235765
Energy: 0.7313800909919292
Energy: 0.7153912817884845
Energy: 0.893097682399389
Energy: 0.7280070713950397
Energy: 0.8018106789753133
Energy: 0.846009736538272
Energy: 1.0137458517903102
Energy: 1.0068973026432475
Energy: 0.8473561691353366
Energy: 1.0274916507246197
Energy: 0.7922450966951456
Energy: 0.8819884158386334
Energy: 0.6913990454152404
Energy: 0.7020729003307878
Energy: 0.8762665293480313
Energy: 0.701510196438413
Energy: 0.8018741494718244
Energy: 0.8520797622412084
Energy: 0.747230340304284
Energy: 0.7251382284719624
Energy: 0.8435678599439442
Energy: 0.7424954627490317
Energy: 0.7152190330373598
Energy: 0.8840812716125095
Energy: 0.828851030246331
Energy: 0.8289115152692198
Energy: 0.8863901619471991
Energy: 0.8516966102931877
Energy: 0.7371091070008348
Energy: 0.9069840632914599
Energy: 0.6945236302249228
Energy: 0.704156226486856
Energy: 0.7652273022824903
Energy: 0.6996939301958811
Energy: 0.7034457551555241
Energy: 0.7243305098775056
Energy: 0.7885349881139762
Energy: 0.7166032090482053
Energy: 0.7258694777051591
Energy: 0.7603458387538776
Energy: 0.7162794070422195
Energy: 0.731223939388513
Energy: 0.7473247860565518
Energy: 0.7407494884667811
Energy: 0.7328973380399806
Energy: 0.8645110107318644
Energy: 0.7135220455569531
Energy: 0.9200483976299835
Energy: 0.88964226469886
Energy: 0.7822503239087393
Energy: 0.8226592907758875
Energy: 0.976000351414931
Energy: 0.7825335208480553
Energy: 0.7254355679758321
Energy: 0.7913050848537562
Energy: 0.7168174319325697
Energy: 0.7263836653309726
Energy: 0.8983046774629547
Energy: 0.6763655256700868
Energy: 0.7339205422024176
Energy: 0.8071049200617317
Energy: 0.7940739190911328
Energy: 0.731693181863434
Energy: 0.9540849916158987
Energy: 0.7597805482051866
Energy: 1.0381267953787061
Energy: 0.8504546006594031
Energy: 0.7921813988464967
Energy: 0.9892335432824688
Energy: 0.8470276395257202
Energy: 0.7664996035435016
Energy: 0.7908080135959855
Energy: 0.8099636653410553
Energy: 0.795855010908192
Energy: 0.7861969791764742
Energy: 0.8535019148333435
Energy: 0.7947939578142138
Energy: 0.742781285483771
Energy: 0.8123891112549511
Energy: 0.7228141002225806
Energy: 0.7350819132281172
Energy: 0.8447408216474117
Energy: 0.688674470896313
Energy: 0.875323386700749
Energy: 0.8120657512241857
Energy: 0.7602591005408305
Energy: 0.8603817205771989
Energy: 0.8780855466377842
Energy: 0.7718406770512085
Energy: 0.6943905777834655
Energy: 0.7534710092188391
Energy: 0.7597380259466755
Energy: 0.6944955431139337
Energy: 0.769382897151564
Energy: 0.7067360136926697
Energy: 0.7475927484644324
Energy: 0.7264332080172556
Energy: 0.7392328090891388
Energy: 0.7481549424384131
Energy: 0.7285406990192657
Energy: 0.7503431420570973
Energy: 0.8770149200972631
Energy: 0.6865842780898
Energy: 0.7141265577199156
Energy: 0.8586225545137033
Energy: 0.7184013735083858
Energy: 0.7180310199073542
Energy: 0.9745983742625502
Energy: 0.858454898452621
Energy: 0.840867168760857
Energy: 0.9763443099812495
Energy: 0.8567490358127551
Energy: 0.78264690811265
Energy: 0.8971459109554294
Energy: 0.7231427698670572
Energy: 0.6884529265542753
Energy: 0.8981658226681289
Energy: 0.724706748572902
Energy: 0.719120850821726
Energy: 0.943000250256163
Energy: 0.7315030053678323
Energy: 0.7403032749220124
Energy: 0.8695841157546644
Energy: 0.734339429971322
Energy: 0.7773944675561014
Energy: 0.8446189951689997
Energy: 0.9990332092490742
Energy: 1.0049921381159437
Energy: 0.8450526786971475
Energy: 0.9899296773121099
Energy: 0.7679263558088595
Energy: 0.9238000966584586
Energy: 0.7787346047991307
Energy: 0.7687178091937452
Energy: 0.8905575009114336
Energy: 0.7888089726858466
Energy: 0.7939618208758943
Energy: 0.8507063391931394
Energy: 0.7254276158848876
Energy: 0.7227080354860512
Energy: 0.8441865998004747
Energy: 0.7338635419811533
Energy: 0.6900750723045408
Energy: 0.8649732817619231
Energy: 0.8260957606482247
Energy: 0.8023270875002495
Energy: 0.8582069472290453
Energy: 0.8395212491311246
Energy: 0.7539614639144759
Energy: 0.8854516125001398
Energy: 0.6949487033816506
Energy: 0.7079978783820375
Energy: 0.8812961451675607
Energy: 0.6946748576093641
Energy: 0.7540963732088787
Energy: 0.750965703522991
Energy: 0.7342515572675222
Energy: 0.7287666024556371
Energy: 0.7536543651481532
Energy: 0.7342646186944861
Energy: 0.7488779442385513
Energy: 0.6804394849855036
Energy: 0.7386711311657759
Energy: 0.7225414686831366
Energy: 0.6801876703043124
Energy: 0.7820198859807442
Energy: 0.7141098482050088
Energy: 0.8118995030251449
Energy: 0.8903278635788584
Energy: 0.7832780821733131
Energy: 0.8095000033203724
Energy: 0.9958226488207619
Energy: 0.7827051272745579
Energy: 0.7248198569447192
Energy: 0.8283005402809211
Energy: 0.7227030994210509
Energy: 0.7236359851435991
Energy: 0.9051135097921477
Energy: 0.6848897193594583
Energy: 0.7301441330122129
Energy: 0.7999473322504361
Energy: 0.7566104272197917
Energy: 0.7318844035344387
Energy: 0.864976659247409
Energy: 0.7687497872454999
Energy: 0.9858147409951882
Energy: 0.8502211303191658
Energy: 0.7918503988485884
Energy: 0.9834749215371157
Energy: 0.8470948573875307
Energy: 0.7698494328747291
Energy: 0.7939028662847909
Energy: 0.8164510546798479
Energy: 0.7903549581593405
Energy: 0.7894751036961191
Energy: 0.8611128650408553
Energy: 0.7843953777020938
Energy: 0.7383872971319968
Energy: 0.7913709993084883
Energy: 0.7184530033869122
Energy: 0.7317390288502114
Energy: 0.8417109247665259
Energy: 0.6869944653272818
Energy: 0.8389240913619312
Energy: 0.8132676263446642
Energy: 0.7540838597107213
Energy: 0.8302278464462852
Energy: 0.8552964396555274
Energy: 0.7590724957775957
Energy: 0.7744785333229234
Energy: 0.7405428952640885
Energy: 0.7408020991526448
Energy: 0.7622827926880775
Energy: 0.7671419557196377
Energy: 0.7444331761063548
Energy: 0.7363932695532293
Energy: 0.7658416282496048
Energy: 0.6861067349251218
Energy: 0.7359000356707912
Energy: 0.7378414423004872
Energy: 0.7004520757716606
Energy: 0.9231795821452654
Energy: 0.6822964230104133
Energy: 0.6935234072074273
Energy: 0.7426141536581222
Energy: 0.6735816215275436
Energy: 0.7171402200639094
Energy: 1.0265518254618744
Energy: 0.7684172840017844
Energy: 0.8206912762004269
Energy: 0.9989250609591251
Energy: 0.7558163485735256
Energy: 0.8117857973915175

minimum gb energy = 0.650361107911165 eV
minimum distance =  2.63277122569929 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.9102797878739263
Energy: 0.9900379383367379
Energy: 0.9513312508743622
Energy: 0.9118013864754946
Energy: 1.080104996011056
Energy: 0.8067355039473161
Energy: 0.9919564094704123
Energy: 0.7197779290363833
Energy: 0.7198532729566072
Energy: 0.904652697183274
Energy: 0.7193457810383477
Energy: 0.6908588255542669
Energy: 0.8649718486212089
Energy: 0.687344360979199
Energy: 0.6953349609181345
Energy: 0.9401231654289277
Energy: 0.6874088673284928
Energy: 0.5894951252500051
Energy: 0.8221869407663717
Energy: 0.9305951438078646
Energy: 0.9142716411027507
Energy: 0.8229482115568401
Energy: 0.919392445972367
Energy: 0.7678518045349753
Energy: 0.9004228595329393
Energy: 0.7376676451734003
Energy: 0.7210308625948348
Energy: 0.9032735371643932
Energy: 0.7429144017880359
Energy: 0.7732758384719782
Energy: 0.7535862311753765
Energy: 0.7659377169526673
Energy: 0.7456593277525826
Energy: 0.7548930751625678
Energy: 0.7578841661292245
Energy: 0.7070300957264678
Energy: 0.764924880675685
Energy: 0.7576426678763613
Energy: 0.6883801916922323
Energy: 0.7661579460256019
Energy: 0.7907730340923532
Energy: 0.6919783579557138
Energy: 0.9027992437126737
Energy: 0.8687022513675764
Energy: 0.7669080682797886
Energy: 0.9038905323232461
Energy: 0.9144465566833619
Energy: 0.8148848094186792
Energy: 0.7384517678906749
Energy: 0.9021232577755111
Energy: 0.7582531815106229
Energy: 0.7390591142571326
Energy: 0.9061288530945295
Energy: 0.6174505968847439
Energy: 0.6753614724400832
Energy: 0.6975569673649861
Energy: 0.6437524536031409
Energy: 0.636572692172982
Energy: 0.8548553590322504
Energy: 0.690933090189506
Energy: 1.0545713762876248
Energy: 0.9823100692507726
Energy: 0.8956979182660727
Energy: 1.0548292375486934
Energy: 1.0637947680690116
Energy: 0.8987552344120445
Energy: 0.6669126496111135
Energy: 0.668470349495081
Energy: 0.6513327112446979
Energy: 0.744534471420538
Energy: 0.8769914276334634
Energy: 0.6618105078904333
Energy: 0.6780986686657866
Energy: 0.7819763013287875
Energy: 0.6539375576855995
Energy: 0.6794315190459368
Energy: 0.8340325675770993
Energy: 0.6777332691850717
Energy: 0.8644669885417272
Energy: 0.7941674652329336
Energy: 0.7292289092488917
Energy: 0.7793599969357617
Energy: 0.8238981895468566
Energy: 0.7571377243539651
Energy: 0.8258911149451363
Energy: 0.8125218172467774
Energy: 0.773936209176361
Energy: 0.8273654311129949
Energy: 0.8227582071483032
Energy: 0.7628052121734638
Energy: 0.7555265612597515
Energy: 0.7377244618923171
Energy: 0.7189880243354255
Energy: 0.7555730514222045
Energy: 0.7712255002213193
Energy: 0.7084673178285482
Energy: 0.8739030694154954
Energy: 0.6691295169674916
Energy: 0.6568257813298275
Energy: 0.8348814802880973
Energy: 0.6688763642797607
Energy: 0.6938076582498124
Energy: 0.9688560938634155
Energy: 0.779798496347352
Energy: 0.7738288057875973
Energy: 0.9697506311660351
Energy: 0.7803939890659976
Energy: 0.7185235283580167

minimum gb energy = 0.5894951252500051 eV
minimum distance =  2.67317777251295 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.744853050647699
Energy: 0.6301597195897052
Energy: 0.6686346011921218
Energy: 0.7466954217819495
Energy: 0.9267410316408357
Energy: 0.6692199300506918
Energy: 0.8127299627095526
Energy: 0.6097498623427994
Energy: 0.5955012773000614
Energy: 0.7779033620497176
Energy: 0.6100893217161556
Energy: 0.6917253051588585
Energy: 0.8269433527769567
Energy: 0.6903604588803414
Energy: 0.6902544096565837
Energy: 0.8271190328382342
Energy: 0.6904135119894605
Energy: 0.6007714047399181
Energy: 0.6693674655174631
Energy: 0.9575884060086167
Energy: 0.9314895028516982
Energy: 0.6705252223702517
Energy: 0.9005757630957958
Energy: 0.9309128104290698
Energy: 0.8699538783140817
Energy: 0.6726297005465403
Energy: 0.6733522850083292
Energy: 0.7928766260830782
Energy: 0.6710780599149206
Energy: 0.6747983082842394
Energy: 0.6693586528343759
Energy: 0.60814879593019
Energy: 0.6840163392351963
Energy: 0.6696582695503276
Energy: 0.6083061357846786
Energy: 0.64142151538522
Energy: 0.669656528072276
Energy: 0.7907010537356168
Energy: 0.6414069377402839
Energy: 0.6698948937389387
Energy: 0.7670325428997691
Energy: 0.6413665584005609
Energy: 0.742737623745447
Energy: 0.669739920591007
Energy: 0.6697466481007925
Energy: 0.742820625703044
Energy: 0.7469981958412283
Energy: 0.6540254800303695
Energy: 0.6334404219727555
Energy: 0.7448311973107512
Energy: 0.7017741218186414
Energy: 0.6339990443956837
Energy: 0.7740212921583592
Energy: 0.6399547889188841
Energy: 0.6898402449945741
Energy: 0.6734912444779236
Energy: 0.6002236236577947
Energy: 0.6009892093038963
Energy: 0.8016441504945307
Energy: 0.6000912984802985
Energy: 0.8987513079498735
Energy: 0.6665052419856725
Energy: 0.7150009191976344
Energy: 0.9003862631520012
Energy: 0.6681325009478424
Energy: 0.9279557547638041
Energy: 0.7913877366088572
Energy: 0.6783709365567648
Energy: 0.6794071649477121
Energy: 0.790917510184741
Energy: 0.7710365518487848
Energy: 0.6805570982478588
Energy: 0.5819439958699021
Energy: 0.6827619921687971
Energy: 0.6410710186014307
Energy: 0.5841159735789828
Energy: 0.7088942010871552
Energy: 0.6413914391845216
Energy: 0.8163905767605127
Energy: 0.641073640435328
Energy: 0.6418484840294012
Energy: 0.8174116915212611
Energy: 0.6695230470698117
Energy: 0.641039164593015
Energy: 0.7844243801181822
Energy: 0.7430145853163634
Energy: 0.6810851724713116
Energy: 0.7870007477947066
Energy: 0.7427587539158882
Energy: 0.6598050292634275
Energy: 0.7463323925882809
Energy: 0.6337296576734324
Energy: 0.6538955668756136
Energy: 0.7468609660472842
Energy: 0.6336545485253646
Energy: 0.6697399269390166
Energy: 0.8037580793974212
Energy: 0.5952419914776292
Energy: 0.5953861481055966
Energy: 0.749156691361394
Energy: 0.6001925737683349
Energy: 0.650035165610791
Energy: 0.6896148095715521
Energy: 0.6901404626325878
Energy: 0.690391612551558
Energy: 0.68975375122668
Energy: 0.6901990912252847
Energy: 0.7711063298445885
Energy: 0.6747618801721024
Energy: 0.6782694689811458
Energy: 0.6782316783157182
Energy: 0.6746919016596892
Energy: 0.7684843578922984
Energy: 0.7684792241038019
Energy: 0.7091770652186713
Energy: 0.5815070724005554
Energy: 0.6413908469598811
Energy: 0.7089859878638914
Energy: 0.5814498378675287
Energy: 0.690041190141751
Energy: 0.6687217344718547
Energy: 0.6837314425715738
Energy: 0.6847859500303621
Energy: 0.6694135777644482
Energy: 0.6826846258314082
Energy: 0.6417336641955195
Energy: 0.7091772301449332
Energy: 0.7991917762733668
Energy: 0.7547196288546715
Energy: 0.6913888681038405
Energy: 0.7487373341171891
Energy: 0.6650633382978568
Energy: 0.8480785502038317
Energy: 0.6692880951427254
Energy: 0.6691239734201115
Energy: 0.8325073949473295
Energy: 0.7486861094408311
Energy: 0.6693090824657368
Energy: 0.5997734166081199
Energy: 0.713194153436365
Energy: 0.6918283148911017
Energy: 0.6000586197392285
Energy: 0.7847944829021999
Energy: 0.5953480857451886
Energy: 0.6904020432569894
Energy: 0.6788466117154289
Energy: 0.6800270504621274
Energy: 0.6904002758237306
Energy: 0.8084107087129142
Energy: 0.6012562297428492
Energy: 0.9011007980907333
Energy: 0.6661661775131484
Energy: 0.7148326490336564
Energy: 0.9021915115121704
Energy: 0.6661031159031472
Energy: 0.930455687476511
Energy: 0.6971636699609063
Energy: 0.6736177428475093
Energy: 0.6754891974817657
Energy: 0.6981134363031725
Energy: 0.7930352627489166
Energy: 0.6742578577728872
Energy: 0.6074809952731117
Energy: 0.6648512999674466
Energy: 0.6650509055066507
Energy: 0.6084441308716599
Energy: 0.6945333559547704
Energy: 0.682960368407318
Energy: 0.8177533299316512
Energy: 0.6414240396905756
Energy: 0.641128637466149
Energy: 0.7661880828003228
Energy: 0.6697166008409108
Energy: 0.6411285451671204
Energy: 0.7465116130708617
Energy: 0.6704770994825373
Energy: 0.6549745875946152
Energy: 0.7470311379632198
Energy: 0.7429269131146137
Energy: 0.669867371664866

minimum gb energy = 0.5814498378675287 eV
minimum distance =  2.63240399759953 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.6430989476444102
Energy: 0.816021489200239
Energy: 0.8724030255195095
Energy: 0.6448243764921906
Energy: 1.02731209974086
Energy: 0.872216037313162
Energy: 0.9488175253317073
Energy: 0.6422373881583138
Energy: 0.6431683266389246
Energy: 0.8882881737177573
Energy: 0.6424444968512489
Energy: 0.642218331762089
Energy: 0.8882954678460625
Energy: 0.6089670756683991
Energy: 0.5574816762666495
Energy: 0.7038211640686608
Energy: 0.6091802891199712
Energy: 0.6092584695968811
Energy: 0.8020810404723183
Energy: 0.7517898701028939
Energy: 0.748034751013348
Energy: 0.8401950242901091
Energy: 0.6959337104870299
Energy: 0.740617662746286
Energy: 0.8097466900851653
Energy: 0.6692510347836251
Energy: 0.6548446197588434
Energy: 0.7589503570517818
Energy: 0.779905364952322
Energy: 0.5919050244089551
Energy: 0.6301687362268126
Energy: 0.6199836988432035
Energy: 0.6189590863092165
Energy: 0.6299395828532136
Energy: 0.6502872899640344
Energy: 0.6573780811872165
Energy: 0.6308270071328009
Energy: 0.6268178922887225
Energy: 0.6279440144251973
Energy: 0.6321740425712743
Energy: 0.6863685607775235
Energy: 0.6302666878879896
Energy: 0.6211420847744162
Energy: 0.7448325978226339
Energy: 0.7926379333766085
Energy: 0.6123051091857195
Energy: 0.8526316991395262
Energy: 0.7687656837637831
Energy: 0.7171656762322689
Energy: 0.829417145248549
Energy: 0.8577935746271754
Energy: 0.690549476597017
Energy: 0.9510229039229784
Energy: 0.5962514197763483
Energy: 0.5785284590186329
Energy: 0.6399579078906172
Energy: 0.6383449796723523
Energy: 0.5942157236881876
Energy: 0.6459366382618213
Energy: 0.6072591541971117
Energy: 0.6932807672247164
Energy: 0.5821131159572268
Energy: 0.5836953316445457
Energy: 0.6944509754853263
Energy: 0.594038343420375
Energy: 0.5832259461480718
Energy: 0.9488175254899399
Energy: 0.7164745684310043
Energy: 0.6897152221853105
Energy: 0.8854811970798158
Energy: 0.7165384564852969
Energy: 0.6893988178594491

minimum gb energy = 0.5574816762666495 eV
minimum distance =  2.65869766105922 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.9747485250085128
Energy: 0.9713893138400937
Energy: 0.8255289330975368
Energy: 0.9769145992018823
Energy: 1.096897475709703
Energy: 0.850023148608246
Energy: 0.6842309602615295
Energy: 0.5498940844735739
Energy: 0.5523668526461032
Energy: 0.6413551938254898
Energy: 0.5498311562347958
Energy: 0.6010144013823475
Energy: 0.6784699440957729
Energy: 0.4995218939261206
Energy: 0.4994490232784832
Energy: 0.6789922136897664
Energy: 0.4999414157547231
Energy: 0.5585560735731435
Energy: 0.6345645391258267
Energy: 0.56668707092011
Energy: 0.6048390300795153
Energy: 0.6354107457015943
Energy: 0.548563826926697
Energy: 0.5912365354106349
Energy: 0.8323781361357628
Energy: 0.6783762702725069
Energy: 0.6768971141453383
Energy: 0.8334459958580862
Energy: 0.7900545614509902
Energy: 0.6556977873062723
Energy: 0.5420444611384517
Energy: 0.7119204590111551
Energy: 0.7552048030332338
Energy: 0.6766699078019376
Energy: 0.737977992072398
Energy: 0.6631892249251377
Energy: 0.5790948465632489
Energy: 0.5274010662285646
Energy: 0.6539387017751058
Energy: 0.5804780036891165
Energy: 0.7448577435246495
Energy: 0.5792701355184099
Energy: 0.6135116940479173
Energy: 0.6150382272293975
Energy: 0.6809037095749944
Energy: 0.6133680759789798
Energy: 0.6344101624217412
Energy: 0.6661934067330453
Energy: 0.8031231570957544
Energy: 0.604006259385935
Energy: 0.6197964506090069
Energy: 0.8027659839383098
Energy: 0.6733119737362214
Energy: 0.6621058209574032
Energy: 0.7371287773919982
Energy: 0.7181750184780293
Energy: 0.6578435736602417
Energy: 0.7380091396894343
Energy: 0.7159650246393896
Energy: 0.6672383045929626
Energy: 0.8214673615569201
Energy: 0.5411374654875691
Energy: 0.5407616617759587
Energy: 0.6278232959143197
Energy: 0.5437157003975259
Energy: 0.5922867755727232
Energy: 0.7741921148817592
Energy: 0.5409760375402816
Energy: 0.5410470458555181
Energy: 0.6767157332545967
Energy: 0.5454437008544307
Energy: 0.5588801724715446
Energy: 0.8538393893238354
Energy: 0.8794367970067932
Energy: 0.755959891408697
Energy: 0.8562599452677563
Energy: 0.8814712769387476
Energy: 0.7713845136371007
Energy: 0.741401108839721
Energy: 0.5871651800116624
Energy: 0.5997471149067338
Energy: 0.7546265528277913
Energy: 0.6966517961058305
Energy: 0.5941844862740687
Energy: 0.5934108574599553
Energy: 0.5143983895514158
Energy: 0.5167646167130093
Energy: 0.5944572599563576
Energy: 0.5297728901183035
Energy: 0.5972168009420648
Energy: 0.538234038330354
Energy: 0.4819092815958414
Energy: 0.5907765034074428
Energy: 0.5157508215050125
Energy: 0.5432076238254979
Energy: 0.5188391552396964
Energy: 0.63035121105622
Energy: 0.7631639701667311
Energy: 0.7437215252060365
Energy: 0.6299928148696691
Energy: 0.911307699503048
Energy: 0.6328516403740793
Energy: 0.7381702606440328
Energy: 0.8335141326231896
Energy: 0.8340802162272434
Energy: 0.7601860738462515
Energy: 0.8583951805926161
Energy: 0.7409339659985789
Energy: 0.6125655951561262
Energy: 0.5198407672449803
Energy: 0.5397096583723348
Energy: 0.6135180279705867
Energy: 0.5199493396412674
Energy: 0.5351564410807392
Energy: 0.5082611409315676
Energy: 0.5054043913390796
Energy: 0.5423273213910501
Energy: 0.5091818461275099
Energy: 0.5105189475927349
Energy: 0.5502803677394511
Energy: 0.5540412431770075
Energy: 0.5139767433035887
Energy: 0.5365637988202303
Energy: 0.6380762423854547
Energy: 0.5979502648283801
Energy: 0.659973859867472
Energy: 0.9788995108652961
Energy: 0.6457623823426367
Energy: 0.7388374866530371
Energy: 0.9800673450302362
Energy: 0.8389968503049886
Energy: 0.8303235181788613
Energy: 1.045886849417097
Energy: 0.634759463687626
Energy: 0.7498106631772359
Energy: 0.8463831671565538
Energy: 0.7104956124525396
Energy: 0.7452986006995947
Energy: 0.6847497976047099
Energy: 0.5157181915899958
Energy: 0.5190588574989996
Energy: 0.6814068378285291
Energy: 0.5419910558429176
Energy: 0.5820189332319721
Energy: 0.630591181180204
Energy: 0.564045044935915
Energy: 0.583410933582144
Energy: 0.6322544637340088
Energy: 0.5490610906408516
Energy: 0.6004505811792701
Energy: 0.722219767074615
Energy: 0.7047786842372933
Energy: 0.6525530546289173
Energy: 0.7232722516527623
Energy: 0.7240298016860929
Energy: 0.6461931883997427
Energy: 0.8996697697492473
Energy: 0.7299385735562782
Energy: 0.6611766256983201
Energy: 0.9006592845340986
Energy: 0.7353575904964891
Energy: 0.8361324789626601
Energy: 0.5425669929401838
Energy: 0.6709772807651933
Energy: 0.5939600715423367
Energy: 0.5435688457661962
Energy: 0.6492148387115335
Energy: 0.5417813237543385
Energy: 0.588418805677212
Energy: 0.594710704857185
Energy: 0.6090965184005749
Energy: 0.5894927016389879
Energy: 0.6729406861388907
Energy: 0.5357073584239532
Energy: 0.7712824727532636
Energy: 0.6147461118012759
Energy: 0.6821222772562636
Energy: 0.7573638155413968
Energy: 0.634773691178572
Energy: 0.6803227950055858
Energy: 0.8242647189040196
Energy: 0.72422165382644
Energy: 0.6164173762467638
Energy: 0.6634624774022541
Energy: 0.7230518252365477
Energy: 0.6407890799321134
Energy: 0.7369034148770929
Energy: 0.5905443007490141
Energy: 0.6179814279653764
Energy: 0.7363746587510938
Energy: 0.6300831938711509
Energy: 0.676125417329547
Energy: 0.8123285002176667
Energy: 0.6103780063406008
Energy: 0.6105748878808508
Energy: 0.8135694125256356
Energy: 0.6111582749274188
Energy: 0.6555118521594536
Energy: 0.8576391859667988
Energy: 0.6178221922227595
Energy: 0.6370234698435734
Energy: 0.8587625420027137
Energy: 0.6715388699220565
Energy: 0.7557008800102617
Energy: 0.9400570467704716
Energy: 0.7483769425829401
Energy: 0.7124012053754932
Energy: 0.7449002762122089
Energy: 0.7249367805425135
Energy: 0.6696286719777859
Energy: 0.6484490827026901
Energy: 0.5192345492011149
Energy: 0.5570416100261204
Energy: 0.6290040941894747
Energy: 0.5333061413872058
Energy: 0.5726990393470877
Energy: 0.5108962494508492
Energy: 0.5457651934516004
Energy: 0.5632788554487888
Energy: 0.5120173797245252
Energy: 0.5470175859806274
Energy: 0.5402322023705413
Energy: 0.5503676764644732
Energy: 0.7746072905902883
Energy: 0.7019182750413058
Energy: 0.5504741085799816
Energy: 0.7552203389017312
Energy: 0.5514448613605605
Energy: 1.1156125329988027
Energy: 0.8452968344311677
Energy: 0.7793557111343035
Energy: 1.115035033479894
Energy: 0.8562806375979931
Energy: 0.9213805153828711
Energy: 0.6129520169518012
Energy: 0.7757030125384835
Energy: 0.6932524424400904
Energy: 0.6129609133779935
Energy: 0.5803627925704279
Energy: 0.5808100452615329
Energy: 0.5081378106079916
Energy: 0.5079833140263578
Energy: 0.526289072563466
Energy: 0.5092962965596958
Energy: 0.5088711895127362
Energy: 0.5282055951944364
Energy: 0.5546220192425059
Energy: 0.4955760037969743
Energy: 0.5108387588453496
Energy: 0.5555722437643279
Energy: 0.5011581600296038
Energy: 0.5226806756642296
Energy: 1.0460679165788305
Energy: 0.7605517636641742
Energy: 0.7968836765066967
Energy: 0.8757969246170808
Energy: 0.7704360992698578
Energy: 0.6414015910422475

minimum gb energy = 0.4819092815958414 eV
minimum distance =  2.66122941917644 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.2765579228775327
Energy: 0.27617504172089086
Energy: 0.23299597800526736
Energy: 0.20831149618521116
Energy: 0.6823163613444356
Energy: 0.27750325163499223
Energy: 0.27757937132554183
Energy: 0.4225706583462471
Energy: 0.45537373375501167
Energy: 0.4270630895103415
Energy: 0.4289222482872349
Energy: 0.3895749542271689
Energy: 0.4047963282988145
Energy: 0.3746412784771726
Energy: 0.39365164603736646
Energy: 0.40070039797419893
Energy: 0.3735127289597004
Energy: 0.3998581214265232
Energy: 0.9431588246035746
Energy: 0.41278164848861476
Energy: 0.3943536183435646
Energy: 0.9378251631271687
Energy: 0.4132542389494811
Energy: 0.4127615704577586
Energy: 0.3918317941064395
Energy: 0.20743212098901964
Energy: 0.20755363892149975
Energy: 0.38967843894232507
Energy: 0.20727299209768307
Energy: 0.40667003528127466
Energy: 0.3654016318378119
Energy: 0.20731308714743
Energy: 0.20742613999715107
Energy: 0.365206799340365
Energy: 0.20750703667904882
Energy: 0.2252576262609072
Energy: 0.36193209424858025
Energy: 0.387846820807516
Energy: 0.38799576648157386
Energy: 0.36229762146908856
Energy: 0.3790124676634073
Energy: 0.3901952548822823
Energy: 0.7871467634792949
Energy: 0.8164741631861503
Energy: 0.8150041087136062
Energy: 0.7938228905598699
Energy: 0.9430847507421249
Energy: 0.8172169432726306
Energy: 0.4747610726055438
Energy: 0.3987893730659981
Energy: 0.39834084588684626
Energy: 0.42557836363544405
Energy: 0.3916229485471903
Energy: 0.39337987458850326
Energy: 0.21102731201649055
Energy: 0.4037251705256636
Energy: 0.2843918646585439
Energy: 0.20714170751997982
Energy: 0.3998209745295664
Energy: 0.20739794747490542
Energy: 0.20716486809728238
Energy: 0.38604939998410065
Energy: 0.39095045506719006
Energy: 0.20726901017238203
Energy: 0.37398730915908013
Energy: 0.26728949675486546
Energy: 0.39037343446394857
Energy: 0.3879638773400084
Energy: 0.38928113000676934
Energy: 0.42395525356763725
Energy: 0.37234339134603717
Energy: 0.3918434514597708
Energy: 0.9295106039309372
Energy: 0.8144051260712476
Energy: 0.8140153161512969
Energy: 0.9418913213769818
Energy: 0.7873435539650563
Energy: 0.8112181714006099
Energy: 0.3880856020176679
Energy: 0.3750532541128334
Energy: 0.39444173565634794
Energy: 0.38845527668483537
Energy: 0.37736595618382957
Energy: 0.3985075592051365
Energy: 0.3905280107983896
Energy: 0.2072576292184536
Energy: 0.20720964412709797
Energy: 0.39089856219883284
Energy: 0.20881900625412791
Energy: 0.2920563611336114
Energy: 0.368715876606923
Energy: 0.3868159481235392
Energy: 0.3855528360260735
Energy: 0.3656616546403031
Energy: 0.20743953293259945
Energy: 0.39793696013859503
Energy: 0.37060115884384626
Energy: 0.4037154789773337
Energy: 0.396639402524091
Energy: 0.3719017808124076
Energy: 0.4028286259806276
Energy: 0.40357016622571223
Energy: 0.7932779871232525
Energy: 0.8104244467304592
Energy: 0.819222494529555
Energy: 0.8122985190946451
Energy: 0.94381445103472
Energy: 0.8321279218170909
Energy: 0.277508398024518
Energy: 0.44728126943294017
Energy: 0.47127614437572524
Energy: 0.20725230420910928
Energy: 0.4464888294637034
Energy: 0.4601357613534243

minimum gb energy = 0.20714170751997982 eV
minimum distance =  2.66314017051596 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.8047310699405339
Energy: 0.9966162759527116
Energy: 0.810768883527343
Energy: 0.806313555744303
Energy: 1.0938694138989298
Energy: 0.8657225594974077
Energy: 0.8891292643978254
Energy: 0.4407571550452194
Energy: 0.45327450976315725
Energy: 0.5951522204131457
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Energy: 0.4584771778806642
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Energy: 0.43803927359633515
Energy: 0.4419357914123037
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Energy: 0.4389392862065385
Energy: 0.3979055355635042
Energy: 0.39112241841520573
Energy: 0.424856269283482
Energy: 0.531113557147043
Energy: 0.6969204023219706
Energy: 0.5281283699273603
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Energy: 0.7318348695775442
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Energy: 0.6905682935321381
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Energy: 0.7371902139763246
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Energy: 0.7871841391412613
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Energy: 0.595753172677441
Energy: 0.5963034243120554
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Energy: 0.7015681151464223
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Energy: 0.6044405382809939
Energy: 0.760296635661759
Energy: 0.7065669247707638
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Energy: 0.7580740952608692
Energy: 0.7325747745501887
Energy: 0.8742579032323988
Energy: 0.6153296829362273
Energy: 0.6103977396502035
Energy: 0.6622086228687382
Energy: 0.6121793716133882
Energy: 0.6341746383191317
Energy: 0.782606190787231
Energy: 0.5506698969144052
Energy: 0.5614609054309695
Energy: 0.5027931717421256
Energy: 0.5494502788794737
Energy: 0.5686709884444039
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Energy: 0.6213807177529072
Energy: 0.6442451461068374
Energy: 0.516634913433387
Energy: 0.6061075799423727
Energy: 0.665052184364975
Energy: 0.7867392643735374
Energy: 0.6039621745771493
Energy: 0.6222488455426873
Energy: 0.7664089170142475
Energy: 0.8696736677823765
Energy: 0.6905743815117319
Energy: 0.9039830122656666
Energy: 0.7789102935083442
Energy: 0.7284711514514967
Energy: 0.9045137153317321
Energy: 0.8076880041902673
Energy: 0.8525197914312362
Energy: 0.4923481430495116
Energy: 0.5807337952377273
Energy: 0.5094696927285223
Energy: 0.4927692220070523
Energy: 0.6312875106452734
Energy: 0.4916898284407671
Energy: 0.4701595089006847
Energy: 0.49728987627547744
Energy: 0.5296096454871208
Energy: 0.47169941714481045
Energy: 0.5193525830172211
Energy: 0.48550374640626276
Energy: 0.5246248090669279
Energy: 0.5150561891361062
Energy: 0.49942625467388235
Energy: 0.44396865058685675
Energy: 0.5135952781473818
Energy: 0.5116928675493595
Energy: 1.0568063138018746
Energy: 0.5386891016209532
Energy: 0.5611897168207077
Energy: 0.8337127540164089
Energy: 0.6012822424945925
Energy: 0.7844188723549178

minimum gb energy = 0.39112241841520573 eV
minimum distance =  2.65893701562497 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.7672112170261307
Energy: 0.8811304785198385
Energy: 0.8798332405671203
Energy: 0.7683728934060405
Energy: 1.0348749314806491
Energy: 0.6876973793702946
Energy: 0.8347189015614728
Energy: 0.45557056207931507
Energy: 0.46634116011412646
Energy: 0.6071910491692423
Energy: 0.48515046678602114
Energy: 0.4654404731708595
Energy: 0.4424534958337436
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Energy: 0.4523947291677799
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Energy: 0.5438748717647558
Energy: 0.5015673201572783
Energy: 0.5825437512617259
Energy: 0.44964964809499525
Energy: 0.48850506932128396
Energy: 0.5448368824393924
Energy: 0.5720977866661213
Energy: 0.4898660245693542
Energy: 0.5423627630141667
Energy: 0.5158339310223381
Energy: 0.8325385317097044
Energy: 0.5086619783963969
Energy: 0.5092963099814483
Energy: 0.6574876080380949
Energy: 0.5076093754101623
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Energy: 0.789773001730866
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Energy: 0.5251433763918525
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Energy: 0.6726590523270545
Energy: 0.6706233032661268
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Energy: 0.6317478091860582
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Energy: 0.4349325343082424
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Energy: 0.4991714026253784
Energy: 1.0104546584171363
Energy: 0.9169757742910948
Energy: 0.8588488974658767
Energy: 1.0089453517347131
Energy: 0.9344013735594436
Energy: 0.7921536441100397
Energy: 0.6675363719652042
Energy: 0.5318001232633102
Energy: 0.5297618557325483
Energy: 0.5016878034121081
Energy: 0.5174960530575375
Energy: 0.5179266992074094
Energy: 0.48812137781483483
Energy: 0.5364201196235358
Energy: 0.5689424780141046
Energy: 0.48983259572587234
Energy: 0.5339059564106333
Energy: 0.4964497448844838
Energy: 0.8265870698629195
Energy: 0.5120893283126916
Energy: 0.5173571750087373
Energy: 0.6667861328549254
Energy: 0.5118515477870935
Energy: 0.5348684133790694
Energy: 0.634838357031417
Energy: 0.5235796008707978
Energy: 0.6592768520539998
Energy: 0.6347458278483679
Energy: 0.5233267354761193
Energy: 0.6597157707631399
Energy: 0.6350700813088391
Energy: 0.8189753863896958
Energy: 0.8179294495682347
Energy: 0.6357789731509553
Energy: 0.7352419840440378
Energy: 0.5694873246613833
Energy: 0.8443307268626665
Energy: 0.5399441364007155
Energy: 0.5062054329680156
Energy: 0.6605449884450271
Energy: 0.4535557470392492
Energy: 0.5883346821982279
Energy: 0.7448950971306363
Energy: 0.7595940284502584
Energy: 0.7218148669286029
Energy: 0.7459822398395168
Energy: 0.7726753499306002
Energy: 0.6974019966697785
Energy: 0.5394304091064668
Energy: 0.5197325474190116
Energy: 0.5369788807791582
Energy: 0.5399102541221713
Energy: 0.8179805106236079
Energy: 0.5493276419997812
Energy: 0.5156145186210325
Energy: 0.5991879564757845
Energy: 0.5952187212330853
Energy: 0.5156306376749009
Energy: 0.6292882990885807
Energy: 0.573092907013506
Energy: 0.6242825199713733
Energy: 0.46644785970683844
Energy: 0.4807109830743043
Energy: 0.6243538456239397
Energy: 0.4625023571586509
Energy: 0.5445398052750132
Energy: 0.7813445001934001
Energy: 0.6280764752324814
Energy: 0.7982521920698944
Energy: 0.781453802768332
Energy: 0.6050645257513957
Energy: 0.7665157970100175

minimum gb energy = 0.43489381190073206 eV
minimum distance =  2.63396380993684 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.5596843544751425
Energy: 0.7324455433635624
Energy: 0.7324219676401255
Energy: 0.5608986059285805
Energy: 0.9412303417097031
Energy: 0.8255555819073246
Energy: 0.8895520759212835
Energy: 0.5255152350537549
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Energy: 0.7173582324546289
Energy: 0.5127081180798042
Energy: 0.5052835670255784
Energy: 0.5008822323885226
Energy: 0.5452413227833125
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Energy: 0.4711221746855707
Energy: 0.4929253986097165
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Energy: 0.6941793805888136
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Energy: 0.5284956819581454
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Energy: 0.6091923559383368
Energy: 0.5411986224772454
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Energy: 0.6922472273250312
Energy: 0.5097240663656806
Energy: 0.6138527766680271
Energy: 0.9699229950701788
Energy: 0.6255365200730862
Energy: 0.7762050825499387
Energy: 0.9707748493613401
Energy: 0.6238430152706541
Energy: 0.7761937694339572

minimum gb energy = 0.4700053304283991 eV
minimum distance =  2.66774297979561 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.6669932919206571
Energy: 0.5133601661195257
Energy: 0.5133612796485658
Energy: 0.6677849940609648
Energy: 0.7648305511363869
Energy: 0.6741145736100479
Energy: 0.6977416191622386
Energy: 0.5006660487680251
Energy: 0.5187752515035964
Energy: 0.5795045452087744
Energy: 0.500604133891974
Energy: 0.4557723794716689
Energy: 0.5663180842189691
Energy: 0.4682535183973184
Energy: 0.5303198183735277
Energy: 0.5663227585149428
Energy: 0.46815034674337397
Energy: 0.6409446220736782
Energy: 0.5577012230105793
Energy: 0.5370667445056787
Energy: 0.5259116519696252
Energy: 0.5583415104546229
Energy: 0.549890264956093
Energy: 0.5361078245358508
Energy: 0.5135962038942705
Energy: 0.5131148344646278
Energy: 0.57838471587193
Energy: 0.5135653194421365
Energy: 0.5900639556707973
Energy: 0.5339120228446866
Energy: 0.770371675541203
Energy: 0.5759981101546101
Energy: 0.5808082403173054
Energy: 0.7696375118685008
Energy: 0.550168510892263
Energy: 0.8272557410087763
Energy: 0.6968388484668583
Energy: 0.5808423978370094
Energy: 0.5901931213927479
Energy: 0.6979606443338683
Energy: 0.5172127050084561
Energy: 0.5357360601637615

minimum gb energy = 0.4557723794716689 eV
minimum distance =  2.68378246471844 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.9071998342986138
Energy: 0.6366247010719467
Energy: 0.6018443946007659
Energy: 0.9068700705404705
Energy: 1.0104232357271121
Energy: 0.8414848454683638
Energy: 0.8515646806842332
Energy: 0.7361394447960417
Energy: 0.7229151627308181
Energy: 0.7537498429879506
Energy: 0.7648709195587531
Energy: 0.634811794288696
Energy: 0.7376340743675839
Energy: 0.7157030490976528
Energy: 0.7101846496507236
Energy: 0.6631354915781105
Energy: 0.7780459946645074
Energy: 0.7272284371745383
Energy: 0.5154053416886342
Energy: 0.7049346017723385
Energy: 0.5466471468276998
Energy: 0.5163002325449043
Energy: 0.7720284454249681
Energy: 0.5331185291082641
Energy: 0.532898048799234
Energy: 0.7032592388078147
Energy: 0.6572571388660835
Energy: 0.5535730068251099
Energy: 0.7322254907057929
Energy: 0.571610684326147
Energy: 0.6462063162209265
Energy: 0.6831586137814714
Energy: 0.6789144705160053
Energy: 0.6271418845522625
Energy: 0.7027695606326326
Energy: 0.7041906345010344
Energy: 0.8466585067937249
Energy: 0.6628462999328371
Energy: 0.626194831798317
Energy: 0.7035477983880317
Energy: 0.661140002789803
Energy: 0.6709709152384687
Energy: 0.846037180637797
Energy: 0.8661007421017748
Energy: 0.7843114433693111
Energy: 0.8466884204365502
Energy: 0.8534765592496317
Energy: 0.8126613816507794
Energy: 0.8444688897791977
Energy: 0.5793151372916251
Energy: 0.6325764838989725
Energy: 0.7008502139659932
Energy: 0.7676060811519531
Energy: 0.7749195696738059
Energy: 0.8285626135607754
Energy: 0.8110534171133882
Energy: 0.7587693719207237
Energy: 0.8247921673824025
Energy: 0.9087547972162924
Energy: 0.8378836435817353
Energy: 0.6236262576839484
Energy: 0.698451926881316
Energy: 0.5879982932651129
Energy: 0.624797284296115
Energy: 0.7391092469873322
Energy: 0.6264140357382227
Energy: 0.7398552716568867
Energy: 0.7032233092778026
Energy: 0.7028902274224574
Energy: 0.731887875035005
Energy: 0.6942399265558499
Energy: 0.6971126691731088
Energy: 0.7488295663801019
Energy: 0.5836650779903907
Energy: 0.6044810420565273
Energy: 0.6771505148015415
Energy: 0.5993294314062838
Energy: 0.6512993781512503
Energy: 0.8228621058192965
Energy: 0.5176242290228084
Energy: 0.5142009936718226
Energy: 0.7530304292220157
Energy: 0.5144646674964773
Energy: 0.5143389619039442
Energy: 0.727378418545939
Energy: 0.6379519722224423
Energy: 0.7203110179906181
Energy: 0.7281782268170147
Energy: 0.6126559241487188
Energy: 0.7479998143065829
Energy: 0.8135493762972011
Energy: 0.6722266633702959
Energy: 0.5563576723785632
Energy: 0.7641977631667607
Energy: 0.7584334385444944
Energy: 0.6785532153304914
Energy: 0.8583674701498967
Energy: 0.8397846382116457
Energy: 0.8073627131977644
Energy: 0.8580235600134621
Energy: 0.9843258675042669
Energy: 0.9160308955280757
Energy: 0.7838587398538965
Energy: 0.6695070790401225
Energy: 0.6349851508560552
Energy: 0.7850478676773057
Energy: 0.73629879543745
Energy: 0.6469530359272736
Energy: 0.9041536345978617
Energy: 0.7603156115838463
Energy: 0.7623328017698621
Energy: 0.7440516191470644
Energy: 0.7301830248570959
Energy: 0.7437753366105777
Energy: 0.8411654167629566
Energy: 0.5609406840320614
Energy: 0.5509348446967433
Energy: 0.9262907093030146
Energy: 0.5583217895441664
Energy: 0.5845253838997538
Energy: 0.7574998338807161
Energy: 0.5691946875842646
Energy: 0.5581941600993344
Energy: 0.6512462001971387
Energy: 0.5591930283515052
Energy: 0.6070428194062552
Energy: 0.6535255743655666
Energy: 0.6793571177407313
Energy: 0.7014360058173035
Energy: 0.6546325705943518
Energy: 0.6550160691127489
Energy: 0.7020650616247404
Energy: 0.5744331175990783
Energy: 0.5879842355730385
Energy: 0.5767043841780718
Energy: 0.5539990630274111
Energy: 0.6450413259186991
Energy: 0.5553993075292251
Energy: 0.7011704670634041
Energy: 0.7735701471743357
Energy: 0.7483987204631847
Energy: 0.5855878604501815
Energy: 0.8477819997706247
Energy: 0.7630048047523955
Energy: 0.76838492447673
Energy: 0.7787022228042331
Energy: 0.7140396768565465
Energy: 0.7688587229266455
Energy: 0.8018080838121072
Energy: 0.7057272834564525
Energy: 0.9801766331214545
Energy: 0.8241085586468663
Energy: 0.7818514583782371
Energy: 0.7882543434006759
Energy: 0.8067556804534558
Energy: 0.7461693272711635
Energy: 0.9040756635430541
Energy: 0.7664883410199461
Energy: 0.7791616981819453
Energy: 0.8309788432351589
Energy: 0.7634481877766054
Energy: 0.7738710491470419
Energy: 0.7684766452559959
Energy: 0.7984257422753773
Energy: 0.7277780949566204
Energy: 0.7683125813636711
Energy: 0.8082918718435141
Energy: 0.69025949765803
Energy: 0.6157834369532881
Energy: 0.7595301812896509
Energy: 0.7174658864273408
Energy: 0.6166627334627071
Energy: 0.7850716723395085
Energy: 0.700975387533653
Energy: 0.5137489853731768
Energy: 0.5431584208963509
Energy: 0.5162726694307479
Energy: 0.514695661489388
Energy: 0.7099604421308737
Energy: 0.5160297653011252
Energy: 0.604588754411103
Energy: 0.7101786668309309
Energy: 0.7056416822300896
Energy: 0.6054151234090083
Energy: 0.7381313710809724
Energy: 0.6901974532506778
Energy: 0.7302790560951264
Energy: 0.6593004062329306
Energy: 0.65635507425871
Energy: 0.6789733013735498
Energy: 0.6561845432174445
Energy: 0.7013882982534033
Energy: 0.9020661303888118
Energy: 0.6969216312338337
Energy: 0.656786440691349
Energy: 0.9519336176899168
Energy: 0.6956928606527332
Energy: 0.7308296068429987
Energy: 0.888933898463181
Energy: 0.7784164630619814
Energy: 0.7861929837207176
Energy: 0.876501906010017
Energy: 0.7605208106596508
Energy: 0.7516062262138333
Energy: 0.7626269636954932
Energy: 0.6912880672434573
Energy: 0.7017912649839614
Energy: 0.7640634239400759
Energy: 0.7336221924044919
Energy: 0.7656233352923376
Energy: 0.68184317383039
Energy: 0.8140114538019705
Energy: 0.7813526950430898
Energy: 0.6775034322397193
Energy: 0.9088172008604978
Energy: 0.7014868902247613
Energy: 0.6531885219692283
Energy: 0.6498303131192129
Energy: 0.6202964596861407
Energy: 0.661141773221622
Energy: 0.6986977283052975
Energy: 0.6807547798187267
Energy: 0.6810560148841173
Energy: 0.6046834174063899
Energy: 0.6779023507663616
Energy: 0.6822318804653611
Energy: 0.6114177468586219
Energy: 0.7128052694958832
Energy: 0.8009561087874166
Energy: 0.5181294234931255
Energy: 0.5254547994870442
Energy: 0.7707843671925074
Energy: 0.5149570257934823
Energy: 0.5176064394978751
Energy: 0.7600026798234832
Energy: 0.6051542328344047
Energy: 0.6090576546030925
Energy: 0.7400603194482079
Energy: 0.6020144391227181
Energy: 0.703745048341387
Energy: 0.847732441305468
Energy: 0.7353031289220059
Energy: 0.7371706411952199
Energy: 0.849450088988905
Energy: 0.7267840245992937
Energy: 0.7375716420519313
Energy: 0.7398292414766178
Energy: 0.7124422142659371
Energy: 0.6852168175868972
Energy: 0.7408999117517497
Energy: 1.0201630362828582
Energy: 0.7399211165242228
Energy: 0.8702304643361917
Energy: 0.8450842818002434
Energy: 0.8145523449486112
Energy: 0.8409105537460744
Energy: 0.8412333691631694
Energy: 0.7616370951132091
Energy: 0.873722041245666
Energy: 0.7052282458626626
Energy: 0.5593539003471812
Energy: 0.7509875012631707
Energy: 0.7662072523362121
Energy: 0.7970271098484422
Energy: 0.7850285731528991
Energy: 0.668195245917641
Energy: 0.6747149149092694
Energy: 0.785664580959126
Energy: 0.6952246138990046
Energy: 0.7361825243799414
Energy: 0.7586263365865987
Energy: 0.5559347648175887
Energy: 0.552065336009846
Energy: 0.7156645560441955
Energy: 0.5531163463980391
Energy: 0.5697642910771027
Energy: 0.6371095686756306
Energy: 0.6308629753887494
Energy: 0.6247990577622009
Energy: 0.6460453702434447
Energy: 0.6350257621491145
Energy: 0.6945519704971156
Energy: 0.5904312047452894
Energy: 0.6814488727779827
Energy: 0.6431681673686679
Energy: 0.5911972079959862
Energy: 0.6936359420809881
Energy: 0.6172854825547008
Energy: 0.5560898735890002
Energy: 0.8330863630648591
Energy: 0.6221289306460176
Energy: 0.5744719317499669
Energy: 0.8656607036119338
Energy: 0.5693296105553908
Energy: 0.8289201168294505
Energy: 0.7185744075659473
Energy: 0.7134938677509234
Energy: 0.7741179258773304
Energy: 0.8269739773713968
Energy: 0.8079696867029871
Energy: 0.8525459370177565
Energy: 0.7561563897440916
Energy: 0.6618711206266087
Energy: 0.7604521926326392
Energy: 0.7854146942214968
Energy: 0.6468553333881125

minimum gb energy = 0.5137489853731768 eV
minimum distance =  2.67143718441648 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.048907252782777
Energy: 0.7124350137395655
Energy: 0.6993641857948342
Energy: 0.9685078965294667
Energy: 0.7702875690727728
Energy: 0.8650306676890602
Energy: 0.9995699706941628
Energy: 0.6825404540137896
Energy: 0.659089884967299
Energy: 0.9131967103055789
Energy: 0.6844291925182079
Energy: 0.6169866696541073
Energy: 0.7366403952418472
Energy: 0.7241525116167694
Energy: 0.6971047362653484
Energy: 0.6819264695187843
Energy: 0.719679290698652
Energy: 0.7742414198175259
Energy: 0.5934775276550676
Energy: 0.6202322363084689
Energy: 0.6435045200167614
Energy: 0.5955262259168119
Energy: 0.687177080631406
Energy: 0.5788782353184274
Energy: 0.6241226267762269
Energy: 0.7753319991913389
Energy: 0.6765887880090767
Energy: 0.6157246097500628
Energy: 0.8313322192758011
Energy: 0.5862045070857974
Energy: 0.9013951742182328
Energy: 0.7732475824557317
Energy: 0.7718263385335578
Energy: 0.8016689136031523
Energy: 0.8200332086557702
Energy: 0.7796577674894348
Energy: 0.819390600154734
Energy: 0.5947669921873695
Energy: 0.5950961366977555
Energy: 0.7967946150133486
Energy: 0.5972187726758774
Energy: 0.6084604820508566
Energy: 0.8898099184388891
Energy: 0.9401562796924703
Energy: 0.9593870565410174
Energy: 0.8966147419505888
Energy: 0.9359557383367573
Energy: 0.6723091012474399
Energy: 0.8199668529301334
Energy: 0.6358485520206475
Energy: 0.7079417193338416
Energy: 0.8210579123741776
Energy: 0.6492480699522555
Energy: 0.655090060505759
Energy: 0.8147370769295014
Energy: 0.832699311477718
Energy: 0.8326297392972252
Energy: 0.8071308085124703
Energy: 0.8887779239973471
Energy: 0.8231308696813422
Energy: 0.6948020017908696
Energy: 0.7865945330521784
Energy: 0.6082760427696714
Energy: 0.6922993814101747
Energy: 0.9469280307479226
Energy: 0.6484915580695576
Energy: 0.7866400832571825
Energy: 0.6937712110490208
Energy: 0.6809005841974686
Energy: 0.7620466519105401
Energy: 0.7050317852356808
Energy: 0.6663643729948244
Energy: 0.714463688474951
Energy: 0.6526307545446379
Energy: 0.6505521376111089
Energy: 0.7141707375196675
Energy: 0.7048508198390266
Energy: 0.6456908089450628
Energy: 0.8681400315336214
Energy: 0.613941977206193
Energy: 0.5959501444759382
Energy: 0.8606187827872022
Energy: 0.6206027942094646
Energy: 0.6053198077597407
Energy: 0.8360486690154393
Energy: 0.7899342387483846
Energy: 0.7954558389632531
Energy: 0.8298912234816009
Energy: 0.7264086052038176
Energy: 0.7972398780194344
Energy: 0.8157669499529892
Energy: 0.5981844399669825
Energy: 0.6273530179134162
Energy: 0.8136626575480105
Energy: 0.7475165669942866
Energy: 0.7346039204860991
Energy: 0.7731174460454348
Energy: 0.8778522326681079
Energy: 0.7258540381521202
Energy: 0.7184886722030022
Energy: 0.8982583770102036
Energy: 0.6400599533712387
Energy: 0.5979647133701621
Energy: 0.57083446738248
Energy: 0.5711853447085442
Energy: 0.5848146596224775
Energy: 0.7117657684399342
Energy: 0.6075015484021011
Energy: 0.9269453026396683
Energy: 0.7312437275633332
Energy: 0.7522671657807254
Energy: 0.9283694888183395
Energy: 0.7346453269025893
Energy: 0.7793259930698138
Energy: 1.0146146837083663
Energy: 0.648352296716897
Energy: 0.6468623831679645
Energy: 0.9295286350912095
Energy: 0.6417384765018794
Energy: 0.6467417244586147
Energy: 0.640382127055213
Energy: 0.570922878444181
Energy: 0.5710288975150517
Energy: 0.5640488247988109
Energy: 0.6217147637843274
Energy: 0.6007155999211862
Energy: 0.6769029659575297
Energy: 0.7443719484566044
Energy: 0.7093027074416296
Energy: 0.6776072948082191
Energy: 0.7395283867146186
Energy: 0.6937669734694141
Energy: 0.6347103816338293
Energy: 0.6023779038300068
Energy: 0.6073792590351555
Energy: 0.5971923460089904
Energy: 0.633109918117688
Energy: 0.591139068618156
Energy: 0.6516111287071547
Energy: 0.7907847883967732
Energy: 0.8018055502476554
Energy: 0.7146099894000931
Energy: 0.8524779399587238
Energy: 0.8001314774092605
Energy: 0.7822779659663242
Energy: 0.77565326406178
Energy: 0.7216524901081316
Energy: 0.779263288672598
Energy: 0.8066898455558857
Energy: 0.7182267862006836
Energy: 0.9044380979083856
Energy: 0.7109015205922283
Energy: 0.7019075395972688
Energy: 0.9049514990430668
Energy: 0.6935084884145749
Energy: 0.6082311578668922
Energy: 0.9572947928978233
Energy: 0.7904219890989768
Energy: 0.6493587255855584
Energy: 0.9637869398459681
Energy: 0.7829085052610006
Energy: 0.6524144570901957
Energy: 0.7880778300029473
Energy: 0.8255212323685417
Energy: 0.735321708605458
Energy: 0.751275307406289
Energy: 0.9469931412474286
Energy: 0.7777693638729939
Energy: 0.7658141645808028
Energy: 0.8330185208323548
Energy: 0.8306828186970422
Energy: 0.7030928338579048
Energy: 0.8883503697523146
Energy: 0.7024855396770356
Energy: 0.7043148508704419
Energy: 0.6852052315443699
Energy: 0.7006244765680832
Energy: 0.7051468536726955
Energy: 0.7078858018940132
Energy: 0.6547583462669249
Energy: 0.7184149793734269
Energy: 0.7479419598372639
Energy: 0.7714958960810544
Energy: 0.7192711561219464
Energy: 0.7102159762431944
Energy: 0.6978640698567042
Energy: 0.7387132629053653
Energy: 0.5932208481108037
Energy: 0.5931982611613742
Energy: 0.6843410201610706
Energy: 0.5968774660885175
Energy: 0.5941474643122767
Energy: 0.9391374854620553
Energy: 0.6384793147433101
Energy: 0.6383315612425287
Energy: 0.9206472377889695
Energy: 0.6401237391870844
Energy: 0.7802246056771054
Energy: 0.8170012872242493
Energy: 0.7869701040864487
Energy: 0.8109755143589163
Energy: 0.8085290372564377
Energy: 0.7745223435065102
Energy: 0.7565699456904823
Energy: 0.5909062638947583
Energy: 0.5765208823546584
Energy: 0.6080016679306531
Energy: 0.5995759917362228
Energy: 0.9396244890367547
Energy: 0.5818094233469768
Energy: 0.8007146383365257
Energy: 0.8075278496615738
Energy: 0.6406461647584573
Energy: 0.7169941165886901
Energy: 0.8905572214437782
Energy: 0.7504611929346269
Energy: 0.9877927824128453
Energy: 0.6835325145370921
Energy: 0.6445365497291619
Energy: 0.9134274350010935
Energy: 0.7731660283134733
Energy: 0.8525815660726109
Energy: 1.0610124942235128
Energy: 0.7529250358801199
Energy: 0.8261278982861971
Energy: 0.9686279112029158
Energy: 0.7230197210005584
Energy: 0.8629545951812584

minimum gb energy = 0.5640488247988109 eV
minimum distance =  2.67587268805837 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.9756673593258752
Energy: 0.6532851362651745
Energy: 0.7136896603829219
Energy: 0.9401494345760724
Energy: 0.8575524822923363
Energy: 0.7471947158939013
Energy: 0.7997386420168978
Energy: 0.5977259656173831
Energy: 0.5965817862506231
Energy: 0.7369121016499535
Energy: 0.6043859954673608
Energy: 0.5808417142135784
Energy: 0.7523178115902528
Energy: 0.7387572520758988
Energy: 0.7266541165856857
Energy: 0.6859220457878443
Energy: 0.7684696996752451
Energy: 0.7740279974444186
Energy: 0.5242713243589497
Energy: 0.7376932150935951
Energy: 0.5223553141772974
Energy: 0.5251210678282359
Energy: 0.744186191509966
Energy: 0.522259429378935
Energy: 0.5590248399539777
Energy: 0.6664925999828314
Energy: 0.6546517702557746
Energy: 0.5590453316081635
Energy: 0.6510890829365581
Energy: 0.568855908912657
Energy: 0.7005768704399934
Energy: 0.6432845733145341
Energy: 0.589684084309796
Energy: 0.7019971650904545
Energy: 0.6526941480549513
Energy: 0.6477315423977333
Energy: 0.8040181315058028
Energy: 0.5230877938204334
Energy: 0.5229627063389537
Energy: 0.5874116454792832
Energy: 0.5230593704351572
Energy: 0.522745279263546
Energy: 0.803736290504507
Energy: 0.5704662676763083
Energy: 0.742986028306737
Energy: 0.809904244514995
Energy: 0.5502958186685212
Energy: 0.7578817199892024
Energy: 0.7367549769736486
Energy: 0.6642264546123763
Energy: 0.5719764972601256
Energy: 0.7368002622048303
Energy: 0.6533114204996223
Energy: 0.6196521668426845
Energy: 0.819605607372361
Energy: 0.79050798186069
Energy: 0.7941211042426959
Energy: 0.816148788089479
Energy: 0.8459530505608049
Energy: 0.7210198747625588
Energy: 0.722100886982725
Energy: 0.6858912065759162
Energy: 0.6937571805023969
Energy: 0.7194341569146582
Energy: 0.9228835963415534
Energy: 0.6916982289864199
Energy: 0.8147942070432819
Energy: 0.681602991457618
Energy: 0.712385097076405
Energy: 0.8660836364740364
Energy: 0.7311525518164592
Energy: 0.7197916335468681
Energy: 0.8877718709997134
Energy: 0.5693696924839042
Energy: 0.596505286271766
Energy: 0.9107239739163433
Energy: 0.5688426721319114
Energy: 0.7515225118824449
Energy: 0.7841470713222629
Energy: 0.5786099248183099
Energy: 0.5760427445158584
Energy: 0.703980538223726
Energy: 0.605414346099522
Energy: 0.5818639928013221
Energy: 0.6096054190327828
Energy: 0.71548682916368
Energy: 0.6988174403614247
Energy: 0.6096867796956287
Energy: 0.6809998098642618
Energy: 0.6905348390642115
Energy: 0.5092801546617027
Energy: 0.545815763930431
Energy: 0.5086413386626809
Energy: 0.50960669920582
Energy: 0.6898929224138957
Energy: 0.5086168373362585
Energy: 0.6429412656551053
Energy: 0.7118587476688091
Energy: 0.7117759833886126
Energy: 0.5854309887819189
Energy: 0.7282777913017316
Energy: 0.6716633439236194
Energy: 0.7431908687645786
Energy: 0.6989326577014964
Energy: 0.7312546087996207
Energy: 0.6846093474868606
Energy: 0.6982201763070244
Energy: 0.6229226554142593
Energy: 0.9397940978907197
Energy: 0.677034292875961
Energy: 0.6767918239267129
Energy: 0.8904251359882749
Energy: 0.6761829814011404
Energy: 0.6672634433316833
Energy: 0.9368011777483477
Energy: 0.764720894790532
Energy: 0.7901199597768919
Energy: 0.8592746312786967
Energy: 0.7472866248721949
Energy: 0.7255760345560187
Energy: 0.7055424840391854
Energy: 0.6496214489007746
Energy: 0.6643018412273404
Energy: 0.7051934748455108
Energy: 0.7312303837225109
Energy: 0.6336875004472252
Energy: 0.6610317463180465
Energy: 0.7854850306903544
Energy: 0.7855159166813862
Energy: 0.7406182717328933
Energy: 0.8940089828108525
Energy: 0.7280930117462011
Energy: 0.6621373111272334
Energy: 0.6111994729412873
Energy: 0.62678021932474
Energy: 0.6631875150528861
Energy: 0.6856764507091186
Energy: 0.6252901577784785
Energy: 0.7479085878184633
Energy: 0.647111905692546
Energy: 0.7236287610893438
Energy: 0.7492923362582622
Energy: 0.6813604579647845
Energy: 0.7133845216734651
Energy: 0.7932773158529045
Energy: 0.509139494927483
Energy: 0.5091422323056111
Energy: 0.7785722251959872
Energy: 0.509231793480448
Energy: 0.5092327341976601
Energy: 0.7440745794979525
Energy: 0.5314641784843083
Energy: 0.5600163703769405
Energy: 0.6761215563832288
Energy: 0.521674255057545
Energy: 0.5693774830802357
Energy: 0.7223374830475264
Energy: 0.6595007838108061
Energy: 0.6755284526306407
Energy: 0.6539656591127773
Energy: 0.6405988134609854
Energy: 0.6778805358570458
Energy: 0.5934392665114998
Energy: 0.5992813200134616
Energy: 0.5917784669364908
Energy: 0.5796425774035567
Energy: 0.7043976947994085
Energy: 0.5682941095182017
Energy: 0.7722753627819456
Energy: 0.7725938613097849
Energy: 0.7455020214979017
Energy: 0.7588417644618136
Energy: 0.8489353295023301
Energy: 0.7386475184530058
Energy: 0.7484382283585899
Energy: 0.603725985299669
Energy: 0.654009264807653
Energy: 0.6954238348306087
Energy: 0.6013658476010602
Energy: 0.6265396809074434
Energy: 0.9621895674424918
Energy: 0.7360403176856934
Energy: 0.7661487201666265
Energy: 0.9768257221173385
Energy: 0.9039380968677093
Energy: 0.8213434080897944

minimum gb energy = 0.5086168373362585 eV
minimum distance =  2.66737553020762 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.7651764164017264
Energy: 0.5525772880009727
Energy: 0.5538953377873355
Energy: 0.7665197720338762
Energy: 0.7988705923231396
Energy: 0.7824356376338715
Energy: 0.7860826425032897
Energy: 0.5495887552107712
Energy: 0.5790294862456745
Energy: 0.6791594377159383
Energy: 0.5498990379873827
Energy: 0.5778089205344927
Energy: 0.6372036754449079
Energy: 0.650406563997121
Energy: 0.648436992935756
Energy: 0.6654641122691963
Energy: 0.6868573178530766
Energy: 0.6794555680255698
Energy: 0.524253857412623
Energy: 0.5893261965372829
Energy: 0.5883856208024975
Energy: 0.5252560873615087
Energy: 0.7368170989397903
Energy: 0.5242068997382829
Energy: 0.623468496788008
Energy: 0.6373021275269296
Energy: 0.6481007882533534
Energy: 0.6247250841127456
Energy: 0.6843031782797141
Energy: 0.558072531498418
Energy: 0.6967136203937728
Energy: 0.602073318910928
Energy: 0.6009298139298582
Energy: 0.6571901942477358
Energy: 0.5815927960785322
Energy: 0.6061010099865066
Energy: 0.7227565388244673
Energy: 0.5256857516767194
Energy: 0.525669865464452
Energy: 0.718746335596013
Energy: 0.5268606944580714
Energy: 0.5254902603927654
Energy: 0.7565548939392239
Energy: 0.7292706358420618
Energy: 0.7169794796304404
Energy: 0.7098194141247578
Energy: 0.5876930869516223
Energy: 0.7033819906050162
Energy: 0.6791273137703646
Energy: 0.5785758924611233
Energy: 0.5790686106842416
Energy: 0.6794025925781484
Energy: 0.6639906854584263
Energy: 0.5781291678800251
Energy: 0.6440048692150754
Energy: 0.7685136324499408
Energy: 0.7274404253245289
Energy: 0.687301230467591
Energy: 0.870703052115219
Energy: 0.7274381415921889
Energy: 0.6121545501373458
Energy: 0.6250727626913575
Energy: 0.5840894708525762
Energy: 0.6118897800134998
Energy: 0.6803412072805121
Energy: 0.5500678867515143
Energy: 0.7676267144030671
Energy: 0.6704039871655507
Energy: 0.693001958736074
Energy: 0.7667140362843335
Energy: 0.6402387888176162
Energy: 0.6409050208158731
Energy: 0.90392221301441
Energy: 0.5859614118222206
Energy: 0.6720024299827808
Energy: 0.7656456048703564
Energy: 0.5768556910557902
Energy: 0.6636493755770884
Energy: 0.787007115121252
Energy: 0.5494763364568582
Energy: 0.5793568589425142
Energy: 0.7840121517938499
Energy: 0.5492582401962519
Energy: 0.6198100609707242
Energy: 0.6576045640913704
Energy: 0.7513303274111878
Energy: 0.6790296137638191
Energy: 0.6576927638182375
Energy: 0.7697412105052692
Energy: 0.6781370094390929
Energy: 0.524616552394348
Energy: 0.5341640531871209
Energy: 0.5366509796058136
Energy: 0.525777069553562
Energy: 0.5812049930740094
Energy: 0.534355131326963
Energy: 0.7029137994668148
Energy: 0.6854976044109493
Energy: 0.6487697509842167
Energy: 0.640288604682323
Energy: 0.7153557703833685
Energy: 0.6485761703521737
Energy: 0.6257015184851524
Energy: 0.5267122519847288
Energy: 0.5819557441242537
Energy: 0.6262643889232167
Energy: 0.5858546312121059
Energy: 0.6017186721557984
Energy: 0.7157349621356286
Energy: 0.5244423393777807
Energy: 0.5242021330194281
Energy: 0.7159315990017694
Energy: 0.5255538983528506
Energy: 0.5749494755939827
Energy: 0.7590410843178045
Energy: 0.6740053392376197
Energy: 0.7016574814088113
Energy: 0.694451146723651
Energy: 0.6966368060088995
Energy: 0.6706507792577144
Energy: 0.5501079918825207
Energy: 0.5735563897579191
Energy: 0.5789720585596542
Energy: 0.550266198860105
Energy: 0.6396736734886808
Energy: 0.5596978796710848
Energy: 0.805768058951797
Energy: 0.7683956644994335
Energy: 0.7353082094840026
Energy: 0.8062787268505818
Energy: 0.8783619020263569
Energy: 0.6179717940320731
Energy: 0.7426554646568749
Energy: 0.5492338387537624
Energy: 0.5783239364494006
Energy: 0.7429145699768009
Energy: 0.6356642322595675
Energy: 0.5488755676076971
Energy: 0.9037336855229798
Energy: 0.6736934144984255
Energy: 0.6712601097663096
Energy: 0.7657348260700839
Energy: 0.6706775228733589
Energy: 0.6635187200154046

minimum gb energy = 0.5242021330194281 eV
minimum distance =  2.67936295488834 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.8226327476808891
Energy: 0.6280424756502252
Energy: 0.7614697068828061
Energy: 0.8236516051780228
Energy: 0.8431426017143293
Energy: 0.7089125582955184
Energy: 0.702358237550296
Energy: 0.5985687820673952
Energy: 0.6113274865154577
Energy: 0.6515488948203612
Energy: 0.5740102132431394
Energy: 0.611071680634896
Energy: 0.7525156673959519
Energy: 0.6205175276798082
Energy: 0.5567124654421242
Energy: 0.6962994283563695
Energy: 0.710545421708929
Energy: 0.5828009740913535
Energy: 0.5546034972299511
Energy: 0.5708840309641352
Energy: 0.5709678197193014
Energy: 0.5551247378385847
Energy: 0.7278098876001123
Energy: 0.5529688223096922
Energy: 0.591453093336628
Energy: 0.6660624370757207
Energy: 0.5975677639454638
Energy: 0.570662482009611
Energy: 0.6855962430948626
Energy: 0.5985856534792524
Energy: 0.7400555906347162
Energy: 0.5327611275140554
Energy: 0.58711554786424
Energy: 0.7204728394186238
Energy: 0.5327996747852323
Energy: 0.6155994829226421
Energy: 0.721687234487935
Energy: 0.47676045586072
Energy: 0.4769631892673287
Energy: 0.6370445702315941
Energy: 0.47999182113396044
Energy: 0.47723672386109195
Energy: 0.6845742717050635
Energy: 0.6624123371471722
Energy: 0.6269878093873318
Energy: 0.6858807529929329
Energy: 0.6588263991678396
Energy: 0.5704490619349346
Energy: 0.47881157917116896
Energy: 0.5333453516098154
Energy: 0.47753525562725047
Energy: 0.4796975623488655
Energy: 0.6030190093090744
Energy: 0.47705148513283047
Energy: 0.5332351392511374
Energy: 0.6068055549932846
Energy: 0.5788387641101885
Energy: 0.5332114909297526
Energy: 0.6088827680513144
Energy: 0.5616738805724002
Energy: 0.7542619015167361
Energy: 0.6879804199735133
Energy: 0.5869273130235166
Energy: 0.6611158374834811
Energy: 0.6745952921101729
Energy: 0.5948237021345192
Energy: 0.7715736921260211
Energy: 0.5535254064835763
Energy: 0.5537416903467505
Energy: 0.7255943064646663
Energy: 0.555832600294269
Energy: 0.5535671996616175
Energy: 0.8146997559731383
Energy: 0.7046247162902226
Energy: 0.6931633986103222
Energy: 0.8156724068138772
Energy: 0.6974963924168809
Energy: 0.7091380188165959
Energy: 0.6580949147353329
Energy: 0.614674733332512
Energy: 0.5993816536007215
Energy: 0.6579454365812367
Energy: 0.740206864437289
Energy: 0.661503552597206
Energy: 0.8000112355751224
Energy: 0.7559758461716931
Energy: 0.7175074733541847
Energy: 0.8000187713902912
Energy: 0.8067500456687515
Energy: 0.7012196865125188
Energy: 0.6432740610249792
Energy: 0.6862124818194041
Energy: 0.6192799232316799
Energy: 0.6399455996633232
Energy: 0.8039159180246077
Energy: 0.6269410509797786
Energy: 0.8325918135429301
Energy: 0.6409838955090279
Energy: 0.6797325023312583
Energy: 0.715558347545425
Energy: 0.7150416024008877
Energy: 0.6803068865490215

minimum gb energy = 0.47676045586072 eV
minimum distance =  2.66878565515415 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.8629283106389314
Energy: 0.6083393385004167
Energy: 0.5417131517617818
Energy: 0.863670806245045
Energy: 0.7909006694322334
Energy: 0.6090973060317719
Energy: 0.7226651311957012
Energy: 0.5928941032801758
Energy: 0.5961058808123331
Energy: 0.5669626205607179
Energy: 0.5746315852552978
Energy: 0.6551169598113029
Energy: 0.702914846685654
Energy: 0.5894681665809361
Energy: 0.5695256454789974
Energy: 0.6586194400927798
Energy: 0.6860386806639459
Energy: 0.5698786269508567
Energy: 0.553194815499963
Energy: 0.5495923352328489
Energy: 0.531304186165837
Energy: 0.554040059496024
Energy: 0.6112816472782351
Energy: 0.5569511356004528
Energy: 0.6668096966097918
Energy: 0.5803359104728054
Energy: 0.530028617091845
Energy: 0.6285069824558824
Energy: 0.5943764443055042
Energy: 0.5286283744898295
Energy: 0.7707231745574068
Energy: 0.5060046895136419
Energy: 0.5659973639897704
Energy: 0.7496057974612161
Energy: 0.5055496545047465
Energy: 0.6151695790009841
Energy: 0.6467202446965076
Energy: 0.47469274899322805
Energy: 0.46905513713068914
Energy: 0.6769018894483283
Energy: 0.47163407277175134
Energy: 0.5212860035521303
Energy: 0.6515353111942556
Energy: 0.6480986260307233
Energy: 0.5737832344813417
Energy: 0.6625656629968473
Energy: 0.6518701295551926
Energy: 0.5718579282948992
Energy: 0.44288928398389665
Energy: 0.5068998854408608
Energy: 0.4627145691326265
Energy: 0.44371207835447196
Energy: 0.6102895825023075
Energy: 0.46234462579126784
Energy: 0.5048187690797573
Energy: 0.609363183013841
Energy: 0.5685776949247937
Energy: 0.49730988089444467
Energy: 0.6499158859403311
Energy: 0.5281687459282475
Energy: 0.6943528874488227
Energy: 0.48289087818822535
Energy: 0.5272462319977249
Energy: 0.6614631695885785
Energy: 0.4871174459401905
Energy: 0.5279933737808323
Energy: 0.6402895395788731
Energy: 0.45800204929893046
Energy: 0.45143227682648085
Energy: 0.6090621130725047
Energy: 0.4549577785755828
Energy: 0.4516986758784505
Energy: 0.6951978224226193
Energy: 0.6362270885966729
Energy: 0.5406292722386983
Energy: 0.563093555783784
Energy: 0.6437054450674238
Energy: 0.5671807186573836
Energy: 0.4691098363976473
Energy: 0.575504455595069
Energy: 0.520249668458192
Energy: 0.47013332605099395
Energy: 0.5926373132014039
Energy: 0.4690995543800481
Energy: 0.5061587408135421
Energy: 0.7048332083424759
Energy: 0.6286629729422614
Energy: 0.5057686338083448
Energy: 0.715227024931385
Energy: 0.5475594779309624
Energy: 0.6982931648647951
Energy: 0.5997453000889542
Energy: 0.5635975900881068
Energy: 0.6751338733715279
Energy: 0.5641324118420269
Energy: 0.5168582340764384
Energy: 0.6993289805694336
Energy: 0.5584186217586989
Energy: 0.5525697917491442
Energy: 0.6998082436205382
Energy: 0.5559531105626139
Energy: 0.5089764146566806
Energy: 0.6674601992193586
Energy: 0.6222423883430269
Energy: 0.6750023689810063
Energy: 0.646532284259957
Energy: 0.6636911542889055
Energy: 0.5529102660212767
Energy: 0.6413458622653236
Energy: 0.5607812648308618
Energy: 0.5601818874182797
Energy: 0.6422868919936682
Energy: 0.7420704589669869
Energy: 0.6488926697090165
Energy: 0.7785924228972718
Energy: 0.7426351551386877
Energy: 0.6926747040413133
Energy: 0.7680035634303185
Energy: 0.7995130279808169
Energy: 0.6548413173619261
Energy: 0.6994471098327382
Energy: 0.5908688949814663
Energy: 0.5847306937681221
Energy: 0.6934383398931682
Energy: 0.7674527901487573
Energy: 0.6154115887567777
Energy: 0.7661850232702405
Energy: 0.6844382828173569
Energy: 0.6570552086630378
Energy: 0.6572967656607178
Energy: 0.6820679737447896
Energy: 0.5458899521302775
Energy: 0.7122669178112413
Energy: 0.6221669248529507
Energy: 0.5945464032282388
Energy: 0.664917950015137
Energy: 0.6124223962799679
Energy: 0.6006046051989281
Energy: 0.7078822693003398
Energy: 0.646649156208423
Energy: 0.5902898523091402
Energy: 0.7089055470388148
Energy: 0.6545479571512498
Energy: 0.5520299248994466
Energy: 0.5687657409217464
Energy: 0.7336427866259009
Energy: 0.6611132999096513
Energy: 0.5687115288565765
Energy: 0.7712278321153642
Energy: 0.5466704360163571
Energy: 0.5390104667575947
Energy: 0.5466918305927255
Energy: 0.5401917062860487
Energy: 0.5399871512323355
Energy: 0.5990788020513026
Energy: 0.5391104177424391
Energy: 0.7730262567910959
Energy: 0.6395003658394105
Energy: 0.6191977304688311
Energy: 0.7401819258268975
Energy: 0.6384897176218977
Energy: 0.6260316057680767
Energy: 0.6224788827415005
Energy: 0.4741400748194885
Energy: 0.4872899482206795
Energy: 0.6226094561714669
Energy: 0.4714280082401366
Energy: 0.4875815735965148
Energy: 0.667632164386494
Energy: 0.5506523177518007
Energy: 0.5360294716081767
Energy: 0.645036733596389
Energy: 0.5241832924952544
Energy: 0.5354502503562641
Energy: 0.4758439777746813
Energy: 0.57725170704642
Energy: 0.5136740490934515
Energy: 0.4766792063135492
Energy: 0.6519864410999865
Energy: 0.4991826695775556
Energy: 0.45577164214371463
Energy: 0.5583652713220235
Energy: 0.554834003463026
Energy: 0.4568308650980205
Energy: 0.6253964860872427
Energy: 0.4532159271293313
Energy: 0.676569801342512
Energy: 0.5558605415833627
Energy: 0.5545504932742602
Energy: 0.6786026199877321
Energy: 0.5344641321669898
Energy: 0.5782668654859695
Energy: 0.6706825534083763
Energy: 0.44640915662580366
Energy: 0.4413783026162388
Energy: 0.6495174896269932
Energy: 0.44307266199563644
Energy: 0.44153745498309155
Energy: 0.7214993564168687
Energy: 0.537962060214897
Energy: 0.5502705191416118
Energy: 0.7228117529952536
Energy: 0.4793268048776203
Energy: 0.5507056499897225
Energy: 0.502429986621953
Energy: 0.5670284292350128
Energy: 0.5602176295560763
Energy: 0.5031908757644269
Energy: 0.6654519528039357
Energy: 0.5657699773263037
Energy: 0.4925076338020866
Energy: 0.5860265679050966
Energy: 0.48832866112301027
Energy: 0.4932411120954311
Energy: 0.6643437777690525
Energy: 0.48806919882273625
Energy: 0.6882177903861185
Energy: 0.5832870484283451
Energy: 0.5506890930646138
Energy: 0.6844406820792521
Energy: 0.6289835293080479
Energy: 0.5896591712984195
Energy: 0.6985654005643775
Energy: 0.5478228746774063
Energy: 0.5435321724516697
Energy: 0.6304165757449858
Energy: 0.544955240812063
Energy: 0.5523223428639819
Energy: 0.7439180888603373
Energy: 0.662905506596587
Energy: 0.5708830890868609
Energy: 0.7767027746885888
Energy: 0.6618525455211657
Energy: 0.6178745848910108
Energy: 0.7022008025512697
Energy: 0.5437571008706877
Energy: 0.5376418147560971
Energy: 0.6715770242173001
Energy: 0.5914860315785089
Energy: 0.5707255953321626
Energy: 0.6537461177789229
Energy: 0.7438265127047105
Energy: 0.6123677554831662
Energy: 0.6539082165610173
Energy: 0.766575212541125
Energy: 0.61243267611863
Energy: 0.691718589177198
Energy: 0.6176528905778412
Energy: 0.5998274335179319
Energy: 0.6925280651435723
Energy: 0.7075779278497605
Energy: 0.7047746708127918
Energy: 0.7010490936735777
Energy: 0.6330075722822144
Energy: 0.6535070026193958
Energy: 0.6549665232738717
Energy: 0.6184334411485112
Energy: 0.5961054835115144

minimum gb energy = 0.4413783026162388 eV
minimum distance =  2.68325098084841 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.7936290453811511
Energy: 0.5842028788630743
Energy: 0.521856164536255
Energy: 0.7949671230197776
Energy: 0.7455410497098779
Energy: 0.5245912820838512
Energy: 0.7237484607604836
Energy: 0.5697308268273196
Energy: 0.5878476871576698
Energy: 0.5675301032559087
Energy: 0.552198282260118
Energy: 0.592921901888475
Energy: 0.6649225200458134
Energy: 0.5590795842774581
Energy: 0.5558066877807913
Energy: 0.6278150730883562
Energy: 0.5962833973834992
Energy: 0.5525381963266951
Energy: 0.5345127823495465
Energy: 0.5562639555504774
Energy: 0.4935255565018761
Energy: 0.5352356723930095
Energy: 0.6020664935397827
Energy: 0.544583582068354
Energy: 0.603236384739676
Energy: 0.5797702987828943
Energy: 0.47740216352383685
Energy: 0.6036352082618911
Energy: 0.5760413383578982
Energy: 0.4720966994158556
Energy: 0.7382008739517887
Energy: 0.5012572812953038
Energy: 0.5120422157705068
Energy: 0.7215320904514526
Energy: 0.4954102894218354
Energy: 0.6164828829038537
Energy: 0.6597040797285896
Energy: 0.4642080844130193
Energy: 0.46706458885294744
Energy: 0.6344821593083266
Energy: 0.4617719817008629
Energy: 0.48214420523686463
Energy: 0.6081840801080995
Energy: 0.5836948836798053
Energy: 0.59884462841577
Energy: 0.6092235451309309
Energy: 0.5752985918108975
Energy: 0.5563474847949837
Energy: 0.42903142969372227
Energy: 0.5405264227582532
Energy: 0.4398832923984443
Energy: 0.4294220759373654
Energy: 0.566520016975249
Energy: 0.4500353987072408
Energy: 0.5429619565846571
Energy: 0.5896632712333193
Energy: 0.5203039831385081
Energy: 0.47731227555655165
Energy: 0.6302742024301206
Energy: 0.49890822001431134
Energy: 0.682834644800184
Energy: 0.4476370034267046
Energy: 0.49208645403310486
Energy: 0.6844986982947749
Energy: 0.4467172720247743
Energy: 0.535738610666199
Energy: 0.6108479553272027
Energy: 0.4247779617471029
Energy: 0.4283975411987911
Energy: 0.5678234837419529
Energy: 0.41537770727344164
Energy: 0.4694972574581905
Energy: 0.6513134988368399
Energy: 0.578301911279797
Energy: 0.5826646536004626
Energy: 0.5939564718114512
Energy: 0.5960938671542919
Energy: 0.5417168304044622
Energy: 0.41300485447804436
Energy: 0.5314602563334312
Energy: 0.41236383087060335
Energy: 0.41424322419849774
Energy: 0.6047074617081882
Energy: 0.4212374507319846
Energy: 0.4463838516035403
Energy: 0.6016007300158585
Energy: 0.5781068917058378
Energy: 0.4495038252127316
Energy: 0.6317556922908639
Energy: 0.5282965605564419
Energy: 0.6316924417283901
Energy: 0.4489933148195513
Energy: 0.5174369707635023
Energy: 0.6091305139094171
Energy: 0.4934020464366992
Energy: 0.5062351530371952
Energy: 0.6553873712993025
Energy: 0.4466437218625221
Energy: 0.4496553439761812
Energy: 0.6140850059338585
Energy: 0.44405043366441216
Energy: 0.44065286743748444
Energy: 0.6358029298096092
Energy: 0.6041807452540267
Energy: 0.5607024101271899
Energy: 0.6136328875949568
Energy: 0.611915397514902
Energy: 0.546430448993275
Energy: 0.460088145390208
Energy: 0.577980447906552
Energy: 0.4651239953281002
Energy: 0.46027287567962427
Energy: 0.6221845286112523
Energy: 0.4741494575223258
Energy: 0.6063099133990282
Energy: 0.6238882383782226
Energy: 0.5992135410525643
Energy: 0.5751137011701529
Energy: 0.7222923086480868
Energy: 0.5958463497569002
Energy: 0.6776703258951293
Energy: 0.5346547317952159
Energy: 0.5273161522622762
Energy: 0.6781436316829629
Energy: 0.5441579932885656
Energy: 0.5025233082943704
Energy: 0.7811598347722714
Energy: 0.5417180817207574
Energy: 0.5210972047655018
Energy: 0.6894168732473497
Energy: 0.539375484211882
Energy: 0.5123722329792901
Energy: 0.6120688665564105
Energy: 0.5755089401470805
Energy: 0.6078627203341532
Energy: 0.598272897364622
Energy: 0.6331059688044497
Energy: 0.6153759808294713
Energy: 0.617233968741123
Energy: 0.6692418365569425
Energy: 0.6246917825482268
Energy: 0.6179673471389403
Energy: 0.6709087245763409
Energy: 0.6477614785296566
Energy: 0.7077897718307373
Energy: 0.6781852696800887
Energy: 0.5825346869979281
Energy: 0.708976560564716
Energy: 0.6514874489287643
Energy: 0.6022066757279251
Energy: 0.6779137776491556
Energy: 0.5613338492133843
Energy: 0.5655804080591462
Energy: 0.6152670080361882
Energy: 0.6592695960731548
Energy: 0.5892289016684107
Energy: 0.8131170658117535
Energy: 0.6516941935110965
Energy: 0.5393273737589765
Energy: 0.7507793149156797
Energy: 0.6488829466445672
Energy: 0.5306171459524578

minimum gb energy = 0.41236383087060335 eV
minimum distance =  2.6501315247921 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.7344870967812259
Energy: 0.5221593271866984
Energy: 0.502930503474655
Energy: 0.7352200127567626
Energy: 0.599485263729707
Energy: 0.4796749274252042
Energy: 0.6110167931546119
Energy: 0.5045875334664153
Energy: 0.49967047008267673
Energy: 0.5504536169628015
Energy: 0.4698579827404258
Energy: 0.4791313152538789
Energy: 0.5691799192586661
Energy: 0.45303099131273344
Energy: 0.41484829793211747
Energy: 0.5426980705003159
Energy: 0.5164983412745104
Energy: 0.4133710100925011
Energy: 0.47047115119010485
Energy: 0.4391863413143944
Energy: 0.4377045865155409
Energy: 0.47087524445084494
Energy: 0.5512341344500237
Energy: 0.4375458915968526
Energy: 0.519140538749468
Energy: 0.4979011124376535
Energy: 0.4175174767442623
Energy: 0.5201143617128908
Energy: 0.4995011103718944
Energy: 0.4466135613834339
Energy: 0.6945355812378521
Energy: 0.4239598969681406
Energy: 0.4189482664196768
Energy: 0.6651452311970122
Energy: 0.4237221997517438
Energy: 0.435059202562244
Energy: 0.5860194785466172
Energy: 0.4153378722759951
Energy: 0.41522574239990695
Energy: 0.5601527969067716
Energy: 0.41859157857415236
Energy: 0.4092080170240285
Energy: 0.5251318970223166
Energy: 0.4523249837015758
Energy: 0.4459676196767249
Energy: 0.5259186250714597
Energy: 0.48815863266250836
Energy: 0.41750694248499665
Energy: 0.3840326366545952
Energy: 0.40013488199083047
Energy: 0.391747578087763
Energy: 0.38500012811066425
Energy: 0.5430805265028957
Energy: 0.391432140331428
Energy: 0.5560070674935381
Energy: 0.5208999712777159
Energy: 0.43995686279764473
Energy: 0.47928895850974523
Energy: 0.5639758399552387
Energy: 0.4402703816861672
Energy: 0.6500785272841654
Energy: 0.37845328772845893
Energy: 0.4014590112300816
Energy: 0.553433431758963
Energy: 0.3775651935685724
Energy: 0.4968414599390288
Energy: 0.5327848191046156
Energy: 0.36516896129597615
Energy: 0.36957088175591823
Energy: 0.5020540089278758
Energy: 0.36886983560765
Energy: 0.4389722402814153
Energy: 0.546660517273385
Energy: 0.5096594353382474
Energy: 0.5087104237767803
Energy: 0.5243555656976282
Energy: 0.4801001125416566
Energy: 0.4494355485078927
Energy: 0.3549637342553738
Energy: 0.4738153666626828
Energy: 0.36381149225589376
Energy: 0.35587909482845087
Energy: 0.5080978111036388
Energy: 0.3548346608326679
Energy: 0.5407338703008676
Energy: 0.5135855365894657
Energy: 0.4392623177879119
Energy: 0.5159644352045705
Energy: 0.5513367551198297
Energy: 0.4395178377373493
Energy: 0.5345794259609764
Energy: 0.35831071061333525
Energy: 0.3594751563037565
Energy: 0.45727913114209184
Energy: 0.3582922100300789
Energy: 0.4241511744093159
Energy: 0.5032231436246181
Energy: 0.35852961244487574
Energy: 0.359709031246144
Energy: 0.4660076383836955
Energy: 0.3645198711025681
Energy: 0.4249379140911621
Energy: 0.5498587434910515
Energy: 0.48394012433316735
Energy: 0.4694770611181985
Energy: 0.5284464341932528
Energy: 0.5362920577189073
Energy: 0.4510371652861731
Energy: 0.34984145166124725
Energy: 0.47678311903306553
Energy: 0.3515229274352501
Energy: 0.35093196769544915
Energy: 0.5049463085409677
Energy: 0.3521090177774962
Energy: 0.5391205890202805
Energy: 0.5028708554785595
Energy: 0.46535198101653585
Energy: 0.5285857969813748
Energy: 0.4596053655280005
Energy: 0.4677111694849805
Energy: 0.5346448608203411
Energy: 0.36381461879318566
Energy: 0.3652349082670913
Energy: 0.4811951425806165
Energy: 0.3696912804495845
Energy: 0.42849840041914694
Energy: 0.5343630683118912
Energy: 0.3630447796776192
Energy: 0.3643766709038437
Energy: 0.4736012315398898
Energy: 0.3630538134488275
Energy: 0.4371274946194023
Energy: 0.5580073664875197
Energy: 0.5095148990024679
Energy: 0.42028090918726063
Energy: 0.5323499107329318
Energy: 0.5273044375150733
Energy: 0.444356552771532
Energy: 0.3652702202180773
Energy: 0.47994516478762506
Energy: 0.37381532942058954
Energy: 0.3661797807431888
Energy: 0.5165304873554097
Energy: 0.37108682337167176
Energy: 0.5389367025791589
Energy: 0.4519884617223705
Energy: 0.5004849055640397
Energy: 0.5299911463254294
Energy: 0.48338105292971445
Energy: 0.42113526587164035
Energy: 0.5574554447956463
Energy: 0.38265844724601966
Energy: 0.38266121717313734
Energy: 0.5451490415533583
Energy: 0.3865007656740529
Energy: 0.45201568985381924
Energy: 0.6731831721452368
Energy: 0.39096875854754826
Energy: 0.392713138934757
Energy: 0.594121989962618
Energy: 0.3908132396962216
Energy: 0.4447895187910147
Energy: 0.5208372918307637
Energy: 0.5473913920049758
Energy: 0.4081750286655789
Energy: 0.5005262324050181
Energy: 0.5693776636375878
Energy: 0.43468651105075945
Energy: 0.4166647214047975
Energy: 0.410887242905159
Energy: 0.42013760200400363
Energy: 0.4177024283051292
Energy: 0.5383847218856259
Energy: 0.41973489519753104
Energy: 0.5239660532407495
Energy: 0.45100382932812627
Energy: 0.43153163595803246
Energy: 0.5241873542622849
Energy: 0.5244668671583783
Energy: 0.4157621874423102
Energy: 0.5950636822001648
Energy: 0.4823703529151069
Energy: 0.4823010279390325
Energy: 0.5638125498188853
Energy: 0.4715564112913621
Energy: 0.41112864606239174
Energy: 0.7217908093211094
Energy: 0.4736410938440438
Energy: 0.469052022253372
Energy: 0.6929966062745173
Energy: 0.46747785206177583
Energy: 0.48535026657544184
Energy: 0.5492980032334949
Energy: 0.4616655123688902
Energy: 0.4681831398501608
Energy: 0.5495400334887686
Energy: 0.4962801966691223
Energy: 0.47230090572388356
Energy: 0.5473755392945173
Energy: 0.46394927848211404
Energy: 0.4615338886906442
Energy: 0.5379779045100039
Energy: 0.5819921675699941
Energy: 0.5108557791172186
Energy: 0.5673154105795278
Energy: 0.43312426268179044
Energy: 0.4323213278601948
Energy: 0.5677628484310037
Energy: 0.5337148944212036
Energy: 0.43267510617525995
Energy: 0.6110168827978212
Energy: 0.493254589034701
Energy: 0.4833818654059959
Energy: 0.5336917248896279
Energy: 0.4965486268344368
Energy: 0.4977730875339963

minimum gb energy = 0.34984145166124725 eV
minimum distance =  2.67257148487288 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.15187209557738873
Energy: 0.17300578964291763
Energy: 0.033197022094887556
Energy: 0.03415738401681125
Energy: 0.4178600800612446
Energy: 0.15189535566816664
Energy: 0.4075440075896823
Energy: 0.3406815118724394
Energy: 0.27560602921345806
Energy: 0.2984065595813436
Energy: 0.3532018208321437
Energy: 0.34265604146567963
Energy: 0.6113972582127437
Energy: 0.033072314879109034
Energy: 0.03301193614854213
Energy: 0.572748111609025
Energy: 0.03306728659352848
Energy: 0.03319821094329838
Energy: 0.2753016641034223
Energy: 0.03305736844929309
Energy: 0.03303647745826759
Energy: 0.35915409752600624
Energy: 0.03316661006493147
Energy: 0.054106069892327115
Energy: 0.05375256938998714
Energy: 0.6061137526305452
Energy: 0.3575813846984287
Energy: 0.05433801492843217
Energy: 0.5293834726280688
Energy: 0.28839753418619224
Energy: 0.03346145142183659
Energy: 0.26822398728632224
Energy: 0.03289721658387946
Energy: 0.03443665113451207
Energy: 0.2681492694457328
Energy: 0.03302571140080607
Energy: 0.5327389615774417
Energy: 0.33581645411377503
Energy: 0.3406398982725033
Energy: 0.5375813612719403
Energy: 0.34034391893160587
Energy: 0.268326794475926
Energy: 0.5448704627331048
Energy: 0.0331166947133268
Energy: 0.0331114178018283
Energy: 0.6544553789781281
Energy: 0.03294423260787144
Energy: 0.033279080877431505
Energy: 0.3508998721137324
Energy: 0.03315020727432261
Energy: 0.033693143799045186
Energy: 0.2789234950688745
Energy: 0.03300015383479004
Energy: 0.05498739162237042
Energy: 0.15246717097088702
Energy: 0.6080888709763018
Energy: 0.33792104422356994
Energy: 0.03396748847238166
Energy: 0.6122337887366459
Energy: 0.3596179540617286

minimum gb energy = 0.03289721658387946 eV
minimum distance =  2.64733330093877 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.7557223189304987
Energy: 0.5562856888948737
Energy: 0.4969695282091983
Energy: 0.7566739891845539
Energy: 0.5765396618596744
Energy: 0.630447056808645
Energy: 0.5014732584767256
Energy: 0.5009026804832492
Energy: 0.5074392767192378
Energy: 0.5240829818043801
Energy: 0.5046699738490994
Energy: 0.5074148665415853
Energy: 0.5149681769084913
Energy: 0.5495089392790873
Energy: 0.5353672362403776
Energy: 0.5158148153131711
Energy: 0.49989253512892584
Energy: 0.5050829793786534
Energy: 0.4902031897934482
Energy: 0.514101735479974
Energy: 0.5071153691395535
Energy: 0.4908423715179652
Energy: 0.5079681497202538
Energy: 0.5140998120883448
Energy: 0.4603587283791024
Energy: 0.5184947789797015
Energy: 0.526499285355104
Energy: 0.4398058008502452
Energy: 0.5229224930347035
Energy: 0.5213890877860264
Energy: 0.7428682467024234
Energy: 0.5352317772115399
Energy: 0.5159156459880797
Energy: 0.7242852786153658
Energy: 0.5303025911188485
Energy: 0.5745154786371853
Energy: 0.48624970281829455
Energy: 0.4837549889262173
Energy: 0.46443155890305066
Energy: 0.4843581012856627
Energy: 0.4674912699929334
Energy: 0.48611523912354987
Energy: 0.4942868643195767
Energy: 0.49817854937798695
Energy: 0.4724610328906184
Energy: 0.4951492581638342
Energy: 0.5247315860176371
Energy: 0.4614118589999778
Energy: 0.5244255671629098
Energy: 0.49725754581873033
Energy: 0.5187007170040518
Energy: 0.5254464800298715
Energy: 0.39213048115875565
Energy: 0.48642808010988864
Energy: 0.5552723146322961
Energy: 0.4225139188386287
Energy: 0.4210244907465359
Energy: 0.3949565510852933
Energy: 0.4507333093878185
Energy: 0.4478046317666238
Energy: 0.6685805163859524
Energy: 0.464918819979368
Energy: 0.4858854152151751
Energy: 0.5439989610120312
Energy: 0.4679141569693841
Energy: 0.5232028695489084
Energy: 0.3958295021948249
Energy: 0.4848530201476445
Energy: 0.4736173292623346
Energy: 0.39300738235511856
Energy: 0.5008791772279144
Energy: 0.42004381849915484
Energy: 0.39481646828207767
Energy: 0.5200645597187876
Energy: 0.5086020462836596
Energy: 0.3907989931142314
Energy: 0.5672821393821079
Energy: 0.4183854022089257
Energy: 0.5499106167448263
Energy: 0.461224930955235
Energy: 0.4640616483923052
Energy: 0.5511456225647068
Energy: 0.37471304284163454
Energy: 0.4713830404788326
Energy: 0.5481351897735793
Energy: 0.3736142088825393
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Energy: 0.4942536505469162
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Energy: 0.4194544634665681
Energy: 0.6194841831061879
Energy: 0.4479910428900311
Energy: 0.46766757110579843
Energy: 0.5342691992269959
Energy: 0.43459263507830287
Energy: 0.47861931072159325
Energy: 0.3654278145388932
Energy: 0.46957902651077693
Energy: 0.45083669343200505
Energy: 0.36647230757457555
Energy: 0.4785899595683523
Energy: 0.3907845261455815
Energy: 0.36535730774025316
Energy: 0.5132420154863768
Energy: 0.49815274258044223
Energy: 0.3653764173602231
Energy: 0.5624265455837887
Energy: 0.4606169536270138
Energy: 0.5885317141564579
Energy: 0.3932225009747015
Energy: 0.4622204894822212
Energy: 0.571884490474347
Energy: 0.39555899361272806
Energy: 0.4904588808661385
Energy: 0.49083546309209214
Energy: 0.3627965147735633
Energy: 0.3629222217198949
Energy: 0.47814113481976833
Energy: 0.3662027462914986
Energy: 0.3910216273497673
Energy: 0.5576122772877582
Energy: 0.48974976068319975
Energy: 0.4922193860144419
Energy: 0.5462439419901484
Energy: 0.46254832124655293
Energy: 0.4698693160779931
Energy: 0.3744618303411009
Energy: 0.463396258312366
Energy: 0.4203352836575272
Energy: 0.3758160354633384
Energy: 0.44798832537913813
Energy: 0.3704361771263434
Energy: 0.3722005426964205
Energy: 0.5275629725445721
Energy: 0.4828451641383128
Energy: 0.3721346378252722
Energy: 0.5136696778274418
Energy: 0.4533002426399436
Energy: 0.6353644962270035
Energy: 0.3914114216428005
Energy: 0.4250729991830147
Energy: 0.6367037261634454
Energy: 0.3915839114540531
Energy: 0.5362678575593911
Energy: 0.5367784412662894
Energy: 0.3876756031213117
Energy: 0.391201177415819
Energy: 0.4611629404881826
Energy: 0.39441632123594084
Energy: 0.42075968071353925
Energy: 0.5287773869294929
Energy: 0.4901331708016073
Energy: 0.49268085169124853
Energy: 0.4654453694969737
Energy: 0.4950889887160256
Energy: 0.5008772626941
Energy: 0.4209624479621088
Energy: 0.502070268578823
Energy: 0.47972892606992523
Energy: 0.4363239693908693
Energy: 0.46917346403920457
Energy: 0.435710662413194
Energy: 0.4035327275720146
Energy: 0.48483170374732176
Energy: 0.4867103680379431
Energy: 0.40360146532643015
Energy: 0.5003004783208876
Energy: 0.4940756202717719
Energy: 0.6952365293530631
Energy: 0.4642216743311628
Energy: 0.46210960835887854
Energy: 0.5721644925511972
Energy: 0.47648503835068734
Energy: 0.5260579095307837
Energy: 0.48357406661922153
Energy: 0.46772221311687034
Energy: 0.48712233024579593
Energy: 0.48219397060316466
Energy: 0.4712412057599919
Energy: 0.4779293008882389
Energy: 0.49629703147284293
Energy: 0.5376993269181883
Energy: 0.48149922785832067
Energy: 0.5261339572065361
Energy: 0.5208338525253401
Energy: 0.4857878539299411
Energy: 0.5189322399787375
Energy: 0.511361364448175
Energy: 0.5298528798039988
Energy: 0.5192586646137325
Energy: 0.4231657539810165
Energy: 0.5259772256536847
Energy: 0.5221073226668133
Energy: 0.4857510373212255
Energy: 0.48893231137631965
Energy: 0.5211805185948243
Energy: 0.4847877080358047
Energy: 0.52794509696083

minimum gb energy = 0.3627965147735633 eV
minimum distance =  2.65707964688093 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.7469883147996116
Energy: 0.6925975013355881
Energy: 0.5634777343725282
Energy: 0.7476011932491062
Energy: 0.7842067777238553
Energy: 0.7396612543125491
Energy: 0.5527271789731102
Energy: 0.5814590667673167
Energy: 0.5870878675002318
Energy: 0.6106489336219255
Energy: 0.5811052506954705
Energy: 0.6054812230748599
Energy: 0.5927982859479856
Energy: 0.6923666071279574
Energy: 0.6859985684117312
Energy: 0.5936013823071088
Energy: 0.6525790909349035
Energy: 0.6159880384057214
Energy: 0.5587283686088711
Energy: 0.6590457918706705
Energy: 0.6556504622855747
Energy: 0.5656655409405065
Energy: 0.549649056706116
Energy: 0.6106680823018781
Energy: 0.5474219490620428
Energy: 0.6067001167603902
Energy: 0.6130321656347745
Energy: 0.5258740265519937
Energy: 0.6044253700324723
Energy: 0.6033762054703937
Energy: 0.7345429067961249
Energy: 0.6306207862024448
Energy: 0.6194076093218863
Energy: 0.7648505913093594
Energy: 0.6246561858488628
Energy: 0.6804490844481619
Energy: 0.5205892023249085
Energy: 0.5806757460242462
Energy: 0.5773849554221628
Energy: 0.5216794562675372
Energy: 0.5565474327052187
Energy: 0.5536453491833082
Energy: 0.5429475322784778
Energy: 0.6093937923296521
Energy: 0.565657981363596
Energy: 0.5428921200375095
Energy: 0.6338863238682274
Energy: 0.5502700131095691
Energy: 0.6267312282474571
Energy: 0.5728760936341132
Energy: 0.570136594970281
Energy: 0.6270368757553106
Energy: 0.4729848343690086
Energy: 0.6184355095592964
Energy: 0.5541020873312718
Energy: 0.47352412115743336
Energy: 0.47791924977812605
Energy: 0.5553352835765546
Energy: 0.4926495758408216
Energy: 0.5146079846191031
Energy: 0.7188872234307819
Energy: 0.5404344073060864
Energy: 0.5568014520261292
Energy: 0.5823908822941641
Energy: 0.5279623275453603
Energy: 0.59766060659867
Energy: 0.4497758741826881
Energy: 0.5858534061944466
Energy: 0.5621476786989109
Energy: 0.45057478300297304
Energy: 0.587370419742117
Energy: 0.4904663040765648
Energy: 0.44941358007637333
Energy: 0.6126567118655947
Energy: 0.5766476631735464
Energy: 0.45015422176842496
Energy: 0.6381133688056905
Energy: 0.49472194895068833
Energy: 0.6700541379208121
Energy: 0.5360815987071399
Energy: 0.5357832936054898
Energy: 0.6189079462226239
Energy: 0.4848777560066824
Energy: 0.5620122357100793
Energy: 0.6095012385173184
Energy: 0.4491658493674025
Energy: 0.4530821130398388
Energy: 0.5836193640591186
Energy: 0.44741989111110025
Energy: 0.5115848179316628
Energy: 0.6461600949556817
Energy: 0.5445992093140312
Energy: 0.5427326187393747
Energy: 0.646635789710072
Energy: 0.45215890405777276
Energy: 0.5506535646791413
Energy: 0.4718981388659772
Energy: 0.5376112955986668
Energy: 0.5243384159470864
Energy: 0.47281060281255893
Energy: 0.6191358789174215
Energy: 0.5190405955315953
Energy: 0.4785058077933432
Energy: 0.6018448159710145
Energy: 0.5756086065290281
Energy: 0.47843687152050335
Energy: 0.5634284446209068
Energy: 0.5080728134559372
Energy: 0.6929580010348948
Energy: 0.5739925215183409
Energy: 0.5943197059168137
Energy: 0.7086966737941182
Energy: 0.5634437980859961
Energy: 0.6346545659391677
Energy: 0.6178256758237093
Energy: 0.5474097138384594
Energy: 0.5768122844043664
Energy: 0.5019135648814909
Energy: 0.5422175513294802
Energy: 0.5724259925115801
Energy: 0.5922757068917379
Energy: 0.6234569969770677
Energy: 0.6186217148091507
Energy: 0.5952795967443724
Energy: 0.5614043794688981
Energy: 0.6193603229846802
Energy: 0.6117156155263729
Energy: 0.6400896954664151
Energy: 0.6490994000814497
Energy: 0.6134336488803734
Energy: 0.5452060017900756
Energy: 0.6222903008538514
Energy: 0.5473058502907858
Energy: 0.5650966481175167
Energy: 0.5927209422942153
Energy: 0.5512103139832442
Energy: 0.5629752901266585
Energy: 0.5926258706933983

minimum gb energy = 0.44741989111110025 eV
minimum distance =  2.65143836909225 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.8374315004428465
Energy: 0.7387314192399368
Energy: 0.7453068395083557
Energy: 0.8387439922960442
Energy: 0.8161355324970003
Energy: 0.7368303759535082
Energy: 0.576087234674694
Energy: 0.6198777842199946
Energy: 0.6259839370457486
Energy: 0.6551324237490833
Energy: 0.6244785893431478
Energy: 0.6459984224324967
Energy: 0.6394779434687855
Energy: 0.7110766089690306
Energy: 0.7148486965240279
Energy: 0.6403129849595189
Energy: 0.6975351210049427
Energy: 0.6329752414406028
Energy: 0.5999519265971758
Energy: 0.6987223747400341
Energy: 0.6957721881322527
Energy: 0.6010951677727013
Energy: 0.5783445478311054
Energy: 0.6536107710769195
Energy: 0.6219797952956517
Energy: 0.6478451235078952
Energy: 0.6865851442893107
Energy: 0.6225823811067658
Energy: 0.6377129713463486
Energy: 0.6417059459078507
Energy: 0.7732127072334823
Energy: 0.6917457376923594
Energy: 0.6911013121040703
Energy: 0.7742454808391955
Energy: 0.6738211613361735
Energy: 0.680371177979108
Energy: 0.5430423113127862
Energy: 0.6429459526732356
Energy: 0.6465134523154111
Energy: 0.5432043202365764
Energy: 0.609878421412612
Energy: 0.5880471816028963
Energy: 0.543572590376091
Energy: 0.678019255969734
Energy: 0.5890764761255886
Energy: 0.5445384550922516
Energy: 0.6475806978026835
Energy: 0.5643516167262436
Energy: 0.6942019956250843
Energy: 0.6036280992972992
Energy: 0.6015016315828753
Energy: 0.6286937686042942
Energy: 0.49694259673183955
Energy: 0.6013904628871842
Energy: 0.6819952425320568
Energy: 0.5021509258414049
Energy: 0.5032707122435279
Energy: 0.6537004845547306
Energy: 0.49925382631735415
Energy: 0.5833381212901051
Energy: 0.7459600060632599
Energy: 0.5781668928890105
Energy: 0.5879768668155351
Energy: 0.6620383588374235
Energy: 0.5279308800387613
Energy: 0.6233850579666337
Energy: 0.498342658419512
Energy: 0.656945054100155
Energy: 0.6019101279170589
Energy: 0.4991576555159844
Energy: 0.6385042040275946
Energy: 0.540409872388235
Energy: 0.5009248191735016
Energy: 0.6557030490025889
Energy: 0.6130863869291898
Energy: 0.5010503330178929
Energy: 0.6209988642294226
Energy: 0.5424648784915476
Energy: 0.748458164746221
Energy: 0.608703411500691
Energy: 0.6153102119034539
Energy: 0.7006531677917711
Energy: 0.6030860242769627
Energy: 0.6314583902696741
Energy: 0.5769993625435477
Energy: 0.5824461841759908
Energy: 0.5776223070715111
Energy: 0.579199228688108
Energy: 0.5719546856737527
Energy: 0.6047860384913049
Energy: 0.6435704624732402
Energy: 0.6330854509010365
Energy: 0.6385810671725086
Energy: 0.6443631362140514
Energy: 0.5095653191697773
Energy: 0.5670882614175061
Energy: 0.632474709634328
Energy: 0.7276416785101838
Energy: 0.6642247585234227
Energy: 0.6332393316723826
Energy: 0.7242663547655606
Energy: 0.6223138327553808
Energy: 0.6575088087116139
Energy: 0.5935604602698099
Energy: 0.6241870198693532
Energy: 0.6562525494246451
Energy: 0.5971301996757001
Energy: 0.6269832098450616
Energy: 0.838125238210419
Energy: 0.6525953700040982
Energy: 0.7350766022827115
Energy: 0.8379130024025067
Energy: 0.640933676342737
Energy: 0.7306488581336976
Energy: 0.5758715604148169
Energy: 0.6196136235788595
Energy: 0.6259481055009375
Energy: 0.5757419236384289
Energy: 0.6235880807608893
Energy: 0.6274391151223017
Energy: 0.6374981296808155
Energy: 0.6687028192615451
Energy: 0.6647866500665768
Energy: 0.6384053249081479
Energy: 0.5783353334874807
Energy: 0.6425828303251006
Energy: 0.6016787130070518
Energy: 0.732437682906863
Energy: 0.7146627904020799
Energy: 0.601504235083326
Energy: 0.6976883673315062
Energy: 0.6860406654995463
Energy: 0.5799149128402942
Energy: 0.6326667011418752
Energy: 0.6577220608771142
Energy: 0.5429228017499523
Energy: 0.6327183313942983
Energy: 0.6389711404976747
Energy: 0.7739791849062675
Energy: 0.6896053005793079
Energy: 0.6897443214955511
Energy: 0.7743543998620374
Energy: 0.6492609290664434
Energy: 0.6864291355559661
Energy: 0.5429934130981636
Energy: 0.6412079053476704
Energy: 0.6862169164603663
Energy: 0.5430373396409787
Energy: 0.6135088396949927
Energy: 0.5865936758326015
Energy: 0.5421820477354019
Energy: 0.633765423219217
Energy: 0.6052905055861418
Energy: 0.543123646922948
Energy: 0.6756955218221208
Energy: 0.5643080982100986
Energy: 0.625925839951985
Energy: 0.5999998082007967
Energy: 0.6031396651059907
Energy: 0.6265622270856486
Energy: 0.5493320387652999
Energy: 0.6034893869888187
Energy: 0.6433372665367967
Energy: 0.5009350496650623
Energy: 0.5031453320471869
Energy: 0.6483812231388998
Energy: 0.4976054347646133
Energy: 0.5585954573363855
Energy: 0.7455813989639904
Energy: 0.5503154033234566
Energy: 0.5895674057249934
Energy: 0.6725443873432843
Energy: 0.4980475367933705
Energy: 0.6081904674946675
Energy: 0.5038026499763829
Energy: 0.6537253547648161
Energy: 0.6265875420328346
Energy: 0.5005987019387034
Energy: 0.6645717304906194
Energy: 0.5390799996263891
Energy: 0.49829139470862727
Energy: 0.633064368435648
Energy: 0.5400475800721829
Energy: 0.4992368891611314
Energy: 0.6231990892651615
Energy: 0.5396231292438348
Energy: 0.7489787651627448
Energy: 0.6052289269318764
Energy: 0.6151405556351627
Energy: 0.6105983886820266
Energy: 0.6045344022736134
Energy: 0.6236905607115562
Energy: 0.653576433388341
Energy: 0.5742437605500944
Energy: 0.5424565242897769
Energy: 0.6123216692694905
Energy: 0.5711173784846023
Energy: 0.6420155214533887
Energy: 0.6424618925754982
Energy: 0.6157644457556739
Energy: 0.5651234549269876
Energy: 0.6369837746617558
Energy: 0.5088012235347035
Energy: 0.5754412692566426
Energy: 0.6339071486664603
Energy: 0.7275603588640968
Energy: 0.7333010407131273
Energy: 0.6347058131347059
Energy: 0.7116550492066955
Energy: 0.652327571023757
Energy: 0.6920830744150581
Energy: 0.5939408668672176
Energy: 0.622536066355207
Energy: 0.6612426130907743
Energy: 0.5448677069633415
Energy: 0.6531390717153173
Energy: 0.8691627945565903
Energy: 0.6528640352083271
Energy: 0.7061729196340667
Energy: 0.7880934446340759
Energy: 0.6505795537140266
Energy: 0.7304350450061111

minimum gb energy = 0.49694259673183955 eV
minimum distance =  2.67538181149534 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.7803770696411019
Energy: 0.8201373409562968
Energy: 0.8369853736508788
Energy: 0.7811833058201583
Energy: 0.9240836256833828
Energy: 0.8805558252873411
Energy: 0.598875334295825
Energy: 0.6700174351686758
Energy: 0.6575923762399274
Energy: 0.6993922695051861
Energy: 0.668012719519391
Energy: 0.6845962267069065
Energy: 0.7291764655043658
Energy: 0.785621524398724
Energy: 0.7829588068922253
Energy: 0.7300042945251836
Energy: 0.8194484139957146
Energy: 0.6821940624026926
Energy: 0.7467526623981031
Energy: 0.740157862999425
Energy: 0.7382241991274783
Energy: 0.693238507083225
Energy: 0.7500642301538986
Energy: 0.6936037153128459
Energy: 0.6665782403397723
Energy: 0.7519523506915529
Energy: 0.7434303942120528
Energy: 0.5707374100037675
Energy: 0.7145480173936725
Energy: 0.6956254340714176
Energy: 0.7302177210103551
Energy: 0.7418580639422373
Energy: 0.7440689031445669
Energy: 0.7309888790875883
Energy: 0.7382916718900249
Energy: 0.7723950879620438
Energy: 0.5754981784324288
Energy: 0.6840073199671415
Energy: 0.633664875512754
Energy: 0.576373539183863
Energy: 0.7031871907281144
Energy: 0.6272357448374143
Energy: 0.5658755222879716
Energy: 0.6994798246621977
Energy: 0.6635369757007646
Energy: 0.5667086039655926
Energy: 0.7025090497861882
Energy: 0.5992753132811792
Energy: 0.7187060318269769
Energy: 0.6696913221481988
Energy: 0.6691519059301555
Energy: 0.717504276406513
Energy: 0.6080846046892026
Energy: 0.6700026130126554
Energy: 0.7038372611863535
Energy: 0.5825048537068348
Energy: 0.6276583121213125
Energy: 0.7023318857363313
Energy: 0.5795144857703414
Energy: 0.6309239933013765
Energy: 0.6950026407241497
Energy: 0.6431119265018405
Energy: 0.5825336315726588
Energy: 0.6959449896677732
Energy: 0.6084034748398685
Energy: 0.6012336797944691
Energy: 0.6727428242556754
Energy: 0.7668181628214354
Energy: 0.7321885703650305
Energy: 0.6826543530305136
Energy: 0.7853047309874922
Energy: 0.685248278395116
Energy: 0.6652473311885073
Energy: 0.6333361722219215
Energy: 0.6567427895466252
Energy: 0.672993512064099
Energy: 0.66805650742809
Energy: 0.6837039925696224
Energy: 0.8477881883328748
Energy: 0.7016709331322853
Energy: 0.7996834949372584
Energy: 0.8487069457829665
Energy: 0.697645664969507
Energy: 0.8041172404555241

minimum gb energy = 0.5658755222879716 eV
minimum distance =  2.65311742184492 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.9548292196958436
Energy: 0.9828071942537487
Energy: 0.921571319402502
Energy: 0.9321143018430754
Energy: 1.0722806634373065
Energy: 0.8698326069723112
Energy: 0.7182169373274468
Energy: 0.6451292844716141
Energy: 0.6735964251039691
Energy: 0.7548803327239878
Energy: 0.6717456631264686
Energy: 0.6969964344028518
Energy: 0.8328895919934485
Energy: 0.8365777116139573
Energy: 0.7905905126324712
Energy: 0.8258937956799118
Energy: 0.8334119709918031
Energy: 0.79357762703556
Energy: 0.8067698309539886
Energy: 0.7520819459148024
Energy: 0.7283795153267365
Energy: 0.8081401209848355
Energy: 0.6646728860878013
Energy: 0.7058703642382557
Energy: 0.7573379427530443
Energy: 0.6707026260656253
Energy: 0.6600819132363427
Energy: 0.748759313251457
Energy: 0.668646243141556
Energy: 0.7154778933459564
Energy: 0.75976826525094
Energy: 0.6360191479383678
Energy: 0.7010343372706468
Energy: 0.7480292597674678
Energy: 0.6351024229354466
Energy: 0.7123370054137703
Energy: 0.6268034815594493
Energy: 0.75737220929848
Energy: 0.7295907075063721
Energy: 0.6271611163124975
Energy: 0.7205273916453925
Energy: 0.6969485334686559
Energy: 0.631455357607934
Energy: 0.725480035027447
Energy: 0.7079668254217526
Energy: 0.6325404632004619
Energy: 0.7102866225585464
Energy: 0.6817206892172278
Energy: 0.7538645823306094
Energy: 0.7990637049764803
Energy: 0.7881025480937159
Energy: 0.7255965728574697
Energy: 0.7859691409892637
Energy: 0.8235567072452321
Energy: 0.8890912217588788
Energy: 0.8499496515732908
Energy: 0.7946458299551841
Energy: 0.7506547773572203
Energy: 0.8411066890216039
Energy: 0.7935035008804031
Energy: 0.741696506353012
Energy: 0.6858827301744018
Energy: 0.6541652760157872
Energy: 0.7423435689416696
Energy: 0.7016003887756807
Energy: 0.6566589917598437
Energy: 0.7578355301097957
Energy: 0.9314766622874875
Energy: 0.9112369353715378
Energy: 0.7567989739696857
Energy: 0.8903183407960724
Energy: 0.8746157260684767
Energy: 0.6181283359679778
Energy: 0.7939365267334941
Energy: 0.7170938807248235
Energy: 0.6182989036768392
Energy: 0.788228481665404
Energy: 0.7638450397592911
Energy: 0.8255185404453503
Energy: 0.7881287085302655
Energy: 0.774554575401576
Energy: 0.8116967911518422
Energy: 0.7866458279646608
Energy: 0.7741213004721074
Energy: 0.6079511490744104
Energy: 0.7971977622637699
Energy: 0.7454564511406269
Energy: 0.6079396328220654
Energy: 0.8111602322968762
Energy: 0.7021277134642552
Energy: 0.6227102833408643
Energy: 0.716852802138245
Energy: 0.7009632218414973
Energy: 0.6237275584787034
Energy: 0.7318368934642362
Energy: 0.6540453051898053
Energy: 0.6011510652727411
Energy: 0.702668669124115
Energy: 0.701760476714831
Energy: 0.6013679158837385
Energy: 0.7322552005919655
Energy: 0.681509577808267
Energy: 0.7847917070373781
Energy: 0.699181347081859
Energy: 0.699170489032104
Energy: 0.7730372609297339
Energy: 0.7010083510789648
Energy: 0.7309244493213164
Energy: 0.6468578039303279
Energy: 0.6913197841593153
Energy: 0.6778040783721312
Energy: 0.6470338640721859
Energy: 0.6892101992396421
Energy: 0.6853001528951658
Energy: 0.7542981840574702
Energy: 0.8408827364839929
Energy: 0.8313198384835875
Energy: 0.755249904474593
Energy: 0.8559270416567715
Energy: 0.9096383576748717
Energy: 0.7892477735682021
Energy: 0.8040559090403422
Energy: 0.7492462625016781
Energy: 0.7718671587346249
Energy: 0.6700881244105887
Energy: 0.6886256994266682
Energy: 0.636679590941352
Energy: 0.6994814884172518
Energy: 0.6730231929298779
Energy: 0.6367952669956806
Energy: 0.7407358043915276
Energy: 0.6830373596248371
Energy: 0.9683088247000411
Energy: 0.7744866965757057
Energy: 0.8566679728236278
Energy: 0.8797131201937693
Energy: 0.8284637619890355
Energy: 0.8734269258215482
Energy: 0.7074846568830713
Energy: 0.6487627812619705
Energy: 0.6662623970177916
Energy: 0.7084403354270891
Energy: 0.6345304156304546
Energy: 0.7108802667703378
Energy: 0.6876041979282557
Energy: 0.7924443287503637
Energy: 0.7485748369590224
Energy: 0.6916885979717612
Energy: 0.7618967804131624
Energy: 0.7217461228709641
Energy: 0.8290329642207577
Energy: 0.6523428536197974
Energy: 0.6827121365790809
Energy: 0.7918395074108858
Energy: 0.6094699702056438
Energy: 0.6996029239994054
Energy: 0.7639246636873754
Energy: 0.628270519422433
Energy: 0.6281985138340641
Energy: 0.7554187905711554
Energy: 0.6296435921672814
Energy: 0.6729470282445689
Energy: 0.8116137704123761
Energy: 0.6696543425434188
Energy: 0.6877344443033757
Energy: 0.7889069036107166
Energy: 0.6248978001565594
Energy: 0.7136558465298313
Energy: 0.7665152250014049
Energy: 0.7857613314546652
Energy: 0.785204158876879
Energy: 0.7697321306663832
Energy: 0.8051294444087181
Energy: 0.7402824465600222
Energy: 0.7794768141395084
Energy: 0.6301040547155218
Energy: 0.6972069959509228
Energy: 0.7804786940487571
Energy: 0.6296977617025191
Energy: 0.7340357082699817
Energy: 0.9564463274424757
Energy: 0.8279620041802477
Energy: 0.9043217597400527
Energy: 0.9261520002063188
Energy: 0.8224433407756696
Energy: 0.9335318977999802

minimum gb energy = 0.6011510652727411 eV
minimum distance =  2.62797929203249 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.8571902681198791
Energy: 0.7757149387607367
Energy: 0.7771804096515522
Energy: 0.8623050231716197
Energy: 0.9725897923505691
Energy: 0.7648678515794795
Energy: 0.5794493328886928
Energy: 0.7401454968991812
Energy: 0.7477937673199737
Energy: 0.7858689359007941
Energy: 0.7836955699871252
Energy: 0.686124569288326
Energy: 0.795409377539039
Energy: 0.7707215306318279
Energy: 0.7595322123131137
Energy: 0.8023652059912673
Energy: 0.7686008341461416
Energy: 0.7824266252467519
Energy: 0.7745013376599923
Energy: 0.7167065562860295
Energy: 0.713092362255809
Energy: 0.7755391640663581
Energy: 0.844140155311446
Energy: 0.711176078710332
Energy: 0.7483613823371248
Energy: 0.7744216307408495
Energy: 0.7619401246218118
Energy: 0.6151091423249281
Energy: 0.7148021677224128
Energy: 0.7388515419212858
Energy: 0.753009401579752
Energy: 0.7392680151814282
Energy: 0.7270242516762161
Energy: 0.7558201363712109
Energy: 0.7182130172528098
Energy: 0.7291968154189675
Energy: 0.6766278775229692
Energy: 0.6416598209167379
Energy: 0.6682972378692297
Energy: 0.6779143368763779
Energy: 0.6400761730717478
Energy: 0.719503051838027
Energy: 0.7066110039839529
Energy: 0.700705456585496
Energy: 0.7111598603850893
Energy: 0.7077180910306814
Energy: 0.7382872422047404
Energy: 0.6698288220423139
Energy: 0.7327946374675031
Energy: 0.7321384693036772
Energy: 0.7778824659991966
Energy: 0.7559716396781787
Energy: 0.7308020462638927
Energy: 0.754022487290502
Energy: 0.5791587951839663
Energy: 0.739625897718903
Energy: 0.7781301121587882
Energy: 0.5789055558582925
Energy: 0.7374441775914483
Energy: 0.7533307367615624
Energy: 0.7070694555481746
Energy: 0.730292005255167
Energy: 0.7111326837280783
Energy: 0.7077665558315264
Energy: 0.7974569148546854
Energy: 0.7482517122414349
Energy: 0.9574536372481862
Energy: 0.7520678490167325
Energy: 0.7227884999050816
Energy: 0.9589245976604982
Energy: 0.7492051240072375
Energy: 0.9760748572882123
Energy: 0.6739649483640326
Energy: 0.7648102353502414
Energy: 0.7377041508529876
Energy: 0.6150591341263012
Energy: 0.7443693330165393
Energy: 0.7238529523511794
Energy: 0.8211074034096244
Energy: 0.7501674691919082
Energy: 0.749094543691192
Energy: 0.7562029746642404
Energy: 0.6817390207560178
Energy: 0.7388970929090567
Energy: 0.7729399858028364
Energy: 0.7517101325626543
Energy: 0.6846806053246373
Energy: 0.7740482162182658
Energy: 0.7502854126348082
Energy: 0.7134993056421078
Energy: 0.7280860138707451
Energy: 0.6831226218221282
Energy: 0.6975188501898978
Energy: 0.7290491527431034
Energy: 0.6613779297553837
Energy: 0.6902312241768402
Energy: 0.5791828781671456
Energy: 0.6922652900833686
Energy: 0.708842752123013
Energy: 0.5789653255240326
Energy: 0.6946094649125844
Energy: 0.6871873901700157

minimum gb energy = 0.5789055558582925 eV
minimum distance =  2.65672483774936 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.9952801191511137
Energy: 1.0731367997350576
Energy: 0.8825308351797041
Energy: 0.9568106781216857
Energy: 1.1659299746716614
Energy: 0.874264190419753
Energy: 0.7403458643242
Energy: 0.7915763604591388
Energy: 0.7518025128253427
Energy: 0.7506595808724723
Energy: 0.8109607958991485
Energy: 0.762302971180856
Energy: 0.7991911969904618
Energy: 0.7269544524466718
Energy: 0.8199626403233315
Energy: 0.7994892098320338
Energy: 0.7507032416708687
Energy: 0.8272107728507238
Energy: 0.783394805727289
Energy: 0.7691404436364687
Energy: 0.7321945368243883
Energy: 0.7640562734345941
Energy: 0.746220173867275
Energy: 0.7246233069089064
Energy: 0.7059470359854872
Energy: 0.6976238702637765
Energy: 0.6908363786722164
Energy: 0.7067756973727248
Energy: 0.7068431361906868
Energy: 0.6767564179741536
Energy: 0.6824422333922804
Energy: 0.6819169752906793
Energy: 0.6790957366092658
Energy: 0.6664574303831345
Energy: 0.6777359107814512
Energy: 0.6788479263593293
Energy: 0.8750341468865137
Energy: 0.7725229895042773
Energy: 0.8944363540924982
Energy: 0.8745474877121541
Energy: 0.7931078327153878
Energy: 0.8987066705882442
Energy: 0.7505081328277086
Energy: 0.7227884353177836
Energy: 0.7472536864549113
Energy: 0.7505952107933345
Energy: 0.7517159631771942
Energy: 0.7441673180274753
Energy: 0.9212326637584486
Energy: 0.8222513646621724
Energy: 0.8191514275281337
Energy: 0.8692289155310974
Energy: 0.8123702166818555
Energy: 0.7501483066721786
Energy: 0.893743825790267
Energy: 0.7882909671245627
Energy: 0.794252126525702
Energy: 0.7941058525026178
Energy: 0.8051546960996286
Energy: 0.8054730233359086
Energy: 0.6858188134224817
Energy: 0.6933429441167169
Energy: 0.6931188788628132
Energy: 0.6864330326086736
Energy: 0.7093951362738825
Energy: 0.6896311615203173
Energy: 0.6646108874584744
Energy: 0.712281636670991
Energy: 0.6948210766577594
Energy: 0.6653959777334524
Energy: 0.7117484445197121
Energy: 0.6826340595274737
Energy: 0.8097129658116997
Energy: 0.7467995577657663
Energy: 0.7581656412333645
Energy: 0.7665359560569167
Energy: 0.80880297219805
Energy: 0.739039743086884
Energy: 0.802019730719036
Energy: 0.7586245906281124
Energy: 0.7509188402759481
Energy: 0.803064736455559
Energy: 0.7856492817554231
Energy: 0.7633990515524142
Energy: 0.86304758864017
Energy: 0.8322283900618807
Energy: 0.8294256715959025
Energy: 0.863359491258382
Energy: 0.8376191166514928
Energy: 0.8014381523781396
Energy: 0.8675924419382891
Energy: 0.8619915404634464
Energy: 0.9088749361828299
Energy: 0.9100670673057366
Energy: 0.8975229587498946
Energy: 0.9480196815339343
Energy: 0.7869270578738881
Energy: 0.741095874588347
Energy: 0.7481067709287542
Energy: 0.7530836074150185
Energy: 0.7478122344259752
Energy: 0.7370054327023305
Energy: 0.7568098555460966
Energy: 0.7293247324261349
Energy: 0.7184709566322617
Energy: 0.7574678352195552
Energy: 0.7047239320647445
Energy: 0.7271918497562712
Energy: 0.7178769773855022
Energy: 0.734404083711864
Energy: 0.7342711367901762
Energy: 0.7188906284532326
Energy: 0.700355207123541
Energy: 0.7429780664891992
Energy: 0.7631738307981408
Energy: 0.7240858951592493
Energy: 0.7243758191760833
Energy: 0.7178538129808963
Energy: 0.7422896438721098
Energy: 0.7301050434937149
Energy: 0.8676257588599114
Energy: 0.7740308890463546
Energy: 0.7499129551484774
Energy: 0.767653163426644
Energy: 0.8623021204169539
Energy: 0.7581126482603388

minimum gb energy = 0.6646108874584744 eV
minimum distance =  2.6292314249949 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.8780177386004728
Energy: 0.8093092288991909
Energy: 0.7656151440937561
Energy: 0.8184237240314228
Energy: 0.9104889604482149
Energy: 0.8073951241758047
Energy: 0.8982364439427121
Energy: 0.8488867120436067
Energy: 0.7766931711776978
Energy: 0.8271227016132984
Energy: 0.8334958760486288
Energy: 0.8275021928715163
Energy: 1.0799627051639118
Energy: 0.7771339111570009
Energy: 0.7773303891673639
Energy: 1.0208282627750376
Energy: 0.6819852527438489
Energy: 0.7903595322709005
Energy: 0.8197282038148711
Energy: 0.8052859706063872
Energy: 0.8212255528547094
Energy: 0.8065128833747037
Energy: 0.782044943126271
Energy: 0.8374068182586711
Energy: 0.6923352888362171
Energy: 0.8161621321795584
Energy: 0.8037461666102134
Energy: 0.6927398830411406
Energy: 0.8233032080145947
Energy: 0.8183041590311672
Energy: 0.8550520458121232
Energy: 0.7384702676301117
Energy: 0.7561546852192983
Energy: 0.7949225694096799
Energy: 0.7675772440987373
Energy: 0.7583641939412628
Energy: 0.7960799080910371
Energy: 0.7885104526400525
Energy: 0.735294800761943
Energy: 0.7773103458050853
Energy: 0.7878290523644697
Energy: 0.7348008280065672
Energy: 0.8259197106767189
Energy: 0.8221475561092922
Energy: 0.8261704782477469
Energy: 0.8150386423937983
Energy: 0.8418709883182008
Energy: 0.8019830367244034
Energy: 0.8568690714755194
Energy: 0.8182059964696977
Energy: 0.8144576094693663
Energy: 0.7876752594308343
Energy: 0.819888463499616
Energy: 0.7635799134074263
Energy: 0.8611599414574636
Energy: 0.7971753007207656
Energy: 0.7469631207414396
Energy: 0.804675198546792
Energy: 0.7136889263532733
Energy: 0.768005297556772
Energy: 0.8191272977925905
Energy: 0.8245503480856977
Energy: 0.8216295321741138
Energy: 0.8109133018753516
Energy: 0.6824001895400242
Energy: 0.7843105944725256
Energy: 0.7725866381837853
Energy: 0.7186967362008968
Energy: 0.6937449196202232
Energy: 0.7221280969318601
Energy: 0.718627909695386
Energy: 0.6932079504499395
Energy: 0.7592172668919985
Energy: 0.7201716872336085
Energy: 0.7076396234568335
Energy: 0.7601655220271847
Energy: 0.720319737235141
Energy: 0.705521984178002
Energy: 0.7828885229776185
Energy: 0.7335051030933584
Energy: 0.7305831717602942
Energy: 0.7836327478323029
Energy: 0.7523071742584815
Energy: 0.6983540612192695
Energy: 0.7993460057484938
Energy: 0.7389615500615516
Energy: 0.7294330458178945
Energy: 0.7121120243247093
Energy: 0.7411707749212505
Energy: 0.7385626595029462
Energy: 0.7574861374419527
Energy: 0.7757548828286002
Energy: 0.7681968711877715
Energy: 0.7290223920822411
Energy: 0.8139251722019519
Energy: 0.823416581758438
Energy: 0.6963823509132944
Energy: 0.8049301559258875
Energy: 0.7849038693286999
Energy: 0.6963418002458159
Energy: 0.8068678881133438
Energy: 0.7885011443186166
Energy: 0.7423780485831224
Energy: 0.7507064224619152
Energy: 0.767199360892756
Energy: 0.7327051343446458
Energy: 0.7532339866429784
Energy: 0.722565826094817
Energy: 0.8439017389148309
Energy: 0.7871474639706026
Energy: 0.725490154942535
Energy: 0.8226047739456411
Energy: 0.7852858754539902
Energy: 0.7232004326111975
Energy: 0.8354907357878675
Energy: 0.7838409620658888
Energy: 0.7257120708380772
Energy: 0.8135771027773314
Energy: 0.7822571024539808
Energy: 0.7239835548350865
Energy: 0.8887094386465617
Energy: 0.8460389392854656
Energy: 0.8174691636442372
Energy: 0.8130636400632897
Energy: 0.7500774619239272
Energy: 0.7775555678918229
Energy: 0.6847958350326744
Energy: 0.8312056812126867
Energy: 0.8609634588300593
Energy: 0.6857460435276685
Energy: 1.1191271047247258
Energy: 0.841462108950592
Energy: 0.8927549432158475
Energy: 0.7868384635931083
Energy: 0.7664993791356121
Energy: 0.7980865633716269
Energy: 0.7856080405255059
Energy: 0.784855175257778
Energy: 0.8126255527397446
Energy: 0.769338728542181
Energy: 0.7433629232469732
Energy: 0.7431774439023275
Energy: 0.7596732083537022
Energy: 0.7654994750341255
Energy: 0.9565160280785439
Energy: 0.8347604154272076
Energy: 0.8207612078806449
Energy: 0.892897449107612
Energy: 0.8311216908718944
Energy: 0.8086254245964597

minimum gb energy = 0.6819852527438489 eV
minimum distance =  2.65505917181744 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.9534389476195327
Energy: 1.1198664078980103
Energy: 0.9721194659426922
Energy: 0.9553458045795651
Energy: 1.1966754898870948
Energy: 0.9728474966330387
Energy: 0.7493011878787581
Energy: 0.7480189547152252
Energy: 0.7437010579876695
Energy: 0.7918321290576358
Energy: 0.7644119866639483
Energy: 0.6950630690929085
Energy: 0.7042313923214928
Energy: 0.7147923491477792
Energy: 0.709212514211672
Energy: 0.7094126947435195
Energy: 0.7217302848500537
Energy: 0.7124838577356203
Energy: 0.7529954495126335
Energy: 0.7254250141453179
Energy: 0.7081382480127398
Energy: 0.7280497731020547
Energy: 0.7446857168852954
Energy: 0.7106641484098071
Energy: 0.6629843363981612
Energy: 0.7202280748905325
Energy: 0.7233335463077256
Energy: 0.664680485406298
Energy: 0.7058093988424259
Energy: 0.6962757240129733
Energy: 0.7554906491036207
Energy: 0.7583672229197035
Energy: 0.6918779565043784
Energy: 0.7556795730173348
Energy: 0.7426984567632233
Energy: 0.6911986642842758
Energy: 0.7440149647341394
Energy: 0.9585454310857324
Energy: 0.9304568793810343
Energy: 0.757614278840158
Energy: 0.9655976635951834
Energy: 0.9147359237751416
Energy: 0.7399949532472214
Energy: 0.7060067792602764
Energy: 0.7500188433542418
Energy: 0.7399827361569173
Energy: 0.7754468965796911
Energy: 0.7602133876324004
Energy: 0.6545783376399242
Energy: 0.6638832609060048
Energy: 0.6667466858023289
Energy: 0.6552861750096298
Energy: 0.6641000292591147
Energy: 0.6375836523084084
Energy: 0.7103523754787262
Energy: 0.6982164625811605
Energy: 0.6961352360841586
Energy: 0.7275196829869351
Energy: 0.6970998839987818
Energy: 0.6744808781526894
Energy: 0.7793036498287124
Energy: 0.7775526644062523
Energy: 0.7634483967069358
Energy: 0.7803690985050901
Energy: 0.772885060816368
Energy: 0.7477895505444772
Energy: 0.7248535765103102
Energy: 0.7237314181219346
Energy: 0.712582486333685
Energy: 0.7242501015575263
Energy: 0.709710736790385
Energy: 0.6932476735768736
Energy: 0.8813074382364935
Energy: 0.6739030133583693
Energy: 0.7451155325724349
Energy: 0.8775474150301855
Energy: 0.7570425570865744
Energy: 0.7577998191520656
Energy: 0.8402250602042559
Energy: 0.7253745328400405
Energy: 0.7097353781778553
Energy: 0.8346767232086236
Energy: 0.7107879924516044
Energy: 0.7200078754326542
Energy: 0.6321011472011218
Energy: 0.6364612455825487
Energy: 0.6307085322102405
Energy: 0.6337981350299396
Energy: 0.6301089203369773
Energy: 0.6375144249295239
Energy: 0.6864926508003014
Energy: 0.6649871493332787
Energy: 0.6431423556073388
Energy: 0.6703966862528707
Energy: 0.6493976554660764
Energy: 0.6470216147610794
Energy: 0.8020723340024476
Energy: 0.7898119304125669
Energy: 0.8469092735630471
Energy: 0.8029781578973528
Energy: 0.8252215142865906
Energy: 0.8563709096702463
Energy: 0.7734279962360039
Energy: 0.7027688553986825
Energy: 0.7126759778756483
Energy: 0.7387163704193414
Energy: 0.7703849387623746
Energy: 0.7275784021794242
Energy: 0.683258261326261
Energy: 0.7606862696463558
Energy: 0.738628692008579
Energy: 0.6841558894515304
Energy: 0.7877006869863429
Energy: 0.6893018446716692
Energy: 0.7134113096519338
Energy: 0.7680868671338816
Energy: 0.7267881692787926
Energy: 0.714544209478502
Energy: 0.8032495617709902
Energy: 0.7002539640229037
Energy: 0.6358706604994968
Energy: 0.6430613593872823
Energy: 0.6411209941398566
Energy: 0.6367858295934139
Energy: 0.6412875362259972
Energy: 0.6335384695494749
Energy: 0.6701885792310254
Energy: 0.6560884532324819
Energy: 0.6528252548557043
Energy: 0.6704675306668559
Energy: 0.6557431659778281
Energy: 0.6510528687304977
Energy: 0.681868397816474
Energy: 0.9044278481990335
Energy: 0.7032990694620722
Energy: 0.6821890756935395
Energy: 0.931536646175076
Energy: 0.6935735240843046
Energy: 0.755956059366206
Energy: 0.7455799921168578
Energy: 0.80514422391951
Energy: 0.6865367513695808
Energy: 0.7845322554513745
Energy: 0.7025184062157103
Energy: 0.7675439393737995
Energy: 0.7054093321006298
Energy: 0.6886666112719592
Energy: 0.6980666591642604
Energy: 0.7068916698503537
Energy: 0.6916453962326988
Energy: 0.730796440029834
Energy: 0.7369597264187017
Energy: 0.7320795890135858
Energy: 0.7313193922203604
Energy: 0.7396218308690413
Energy: 0.7248250674631078
Energy: 0.6686248345494118
Energy: 0.6585556839693322
Energy: 0.6510840751850152
Energy: 0.6648998436702188
Energy: 0.6539097156955479
Energy: 0.6587089777283135
Energy: 0.6609233974553603
Energy: 0.6548782038588891
Energy: 0.6492298382959627
Energy: 0.6635009465015343
Energy: 0.65772010877708
Energy: 0.6680461430025075
Energy: 0.7775529137769607
Energy: 0.6874184990258015
Energy: 0.7214724162592889
Energy: 0.8173110250740991
Energy: 0.681949081377043
Energy: 0.8300832129124226

minimum gb energy = 0.6301089203369773 eV
minimum distance =  2.61217432704473 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.8693155689622918
Energy: 1.014171054419983
Energy: 1.015034070805336
Energy: 0.8706871528667925
Energy: 1.1440668181921014
Energy: 0.7862267739962852
Energy: 0.715310981552928
Energy: 0.8048505007506226
Energy: 0.6697124886168773
Energy: 0.794987447667269
Energy: 0.7770751541160076
Energy: 0.6725962937981974
Energy: 0.7187709196706371
Energy: 0.7355085583280944
Energy: 0.7208250928932183
Energy: 0.7195384443697953
Energy: 0.7476524772312049
Energy: 0.7088329899529066
Energy: 0.7582493350784855
Energy: 0.6856971927805271
Energy: 0.6923558492241455
Energy: 0.7594030802812191
Energy: 0.6961337960728695
Energy: 0.6828409219119601
Energy: 0.6163052028955007
Energy: 0.7514313010497423
Energy: 0.7529197077382698
Energy: 0.6178522290521964
Energy: 0.7506693516113775
Energy: 0.6638468924485653
Energy: 0.6736483871383783
Energy: 0.7475114923291866
Energy: 0.6763126790904492
Energy: 0.6737770129771186
Energy: 0.7607188438842258
Energy: 0.6770095694816513
Energy: 0.8184560939748509
Energy: 0.9315346775366992
Energy: 0.9144067304426243
Energy: 0.6737281515688716
Energy: 0.9386083470142063
Energy: 0.87917582596755
Energy: 0.727772217620072
Energy: 0.7022443677638832
Energy: 0.6803244452508797
Energy: 0.7306733241332913
Energy: 0.7834544540717454
Energy: 0.702221761668542
Energy: 0.6102371081241968
Energy: 0.6563945309895999
Energy: 0.6530594691868181
Energy: 0.6111162402740292
Energy: 0.650388226387692
Energy: 0.6297284220429106
Energy: 0.6457760068041152
Energy: 0.703337624129456
Energy: 0.683343312087629
Energy: 0.6453305928475942
Energy: 0.7197737990773747
Energy: 0.6683581673169312
Energy: 0.8809658025962979
Energy: 0.8365320045664814
Energy: 0.8068218526736133
Energy: 0.8620704853353448
Energy: 0.840070486038243
Energy: 0.7857010552833642
Energy: 0.74120989352096
Energy: 0.6610109949196705
Energy: 0.6834847967371801
Energy: 0.7290403225640522
Energy: 0.6984930164685978
Energy: 0.6795835940243935
Energy: 0.7471927906432909
Energy: 0.8817524113235934
Energy: 0.9115796674496902
Energy: 0.7474066616056771
Energy: 0.8796774233587904
Energy: 0.904941185507782
Energy: 0.8202262626938529
Energy: 0.7478498513554165
Energy: 0.6943741065976602
Energy: 0.8208175277793771
Energy: 0.7788493495598807
Energy: 0.6833519202240185
Energy: 0.6432160819212389
Energy: 0.6167129091475603
Energy: 0.6268225747734503
Energy: 0.644186490690264
Energy: 0.6293673257329362
Energy: 0.6562489894047621
Energy: 0.697036511765213
Energy: 0.6293351926154647
Energy: 0.6401894924516631
Energy: 0.6975527190339178
Energy: 0.7049017649059158
Energy: 0.6504877860796068
Energy: 0.872703497206426
Energy: 0.8817159651996319
Energy: 0.9694232063393795
Energy: 0.8738268705915856
Energy: 0.8806798424515221
Energy: 0.7966233569211111
Energy: 0.8876938572180803
Energy: 0.7162453610198607
Energy: 0.7043045912963687
Energy: 0.7264504220279974
Energy: 0.7509353963052757
Energy: 0.6858750703117061
Energy: 0.7260871300366508
Energy: 0.7563429551545054
Energy: 0.7341711164506287
Energy: 0.7287864113884054
Energy: 0.7505953782352839
Energy: 0.7158355991881077
Energy: 0.737665775428508
Energy: 0.7521040998802727
Energy: 0.726657335236249
Energy: 0.738719201173453
Energy: 0.753769787067075
Energy: 0.7245388978189822
Energy: 0.6185557190270429
Energy: 0.7498271725772119
Energy: 0.753923080565836
Energy: 0.6197162073575531
Energy: 0.7390994636608598
Energy: 0.660593351105322
Energy: 0.6749904649868739
Energy: 0.7135643416571336
Energy: 0.6654954959023454
Energy: 0.6742558774311179
Energy: 0.714593091151578
Energy: 0.6571389104573508
Energy: 0.6727271006959004
Energy: 0.9871699632072979
Energy: 0.9307723932791181
Energy: 0.7074564988486886
Energy: 0.9859900399807829
Energy: 0.894304552089466
Energy: 0.7275782338236071
Energy: 0.862770444114451
Energy: 0.8179372494745887
Energy: 0.7280700006321618
Energy: 0.8482746408701665
Energy: 0.6928899208400151
Energy: 0.6076779750611465
Energy: 0.6530670511101437
Energy: 0.651213169464312
Energy: 0.6082115505938874
Energy: 0.6856597346671185
Energy: 0.628800709978148
Energy: 0.6077043776623697
Energy: 0.686393764123286
Energy: 0.656278322741047
Energy: 0.6080110408764201
Energy: 0.6891245750403877
Energy: 0.644128391595106
Energy: 0.7700894285086145
Energy: 0.8427071682714624
Energy: 0.8159023537519142
Energy: 0.7689606951296414
Energy: 0.844282206586846
Energy: 0.8041198629664451
Energy: 0.7237381017885378
Energy: 0.8385018839674707
Energy: 0.8126153288551746
Energy: 0.7407106159432505
Energy: 0.819640493724687
Energy: 0.7456611097208193
Energy: 0.7737673840822634
Energy: 0.7199953970695131
Energy: 0.7195475291575384
Energy: 0.7643624447164848
Energy: 0.7203583387575024
Energy: 0.6942199053915087
Energy: 0.7430909833730227
Energy: 0.7444265187395736
Energy: 0.6929077169571701
Energy: 0.7436859626785461
Energy: 0.7642192773210431
Energy: 0.6945296221268163
Energy: 0.6574639426564695
Energy: 0.6154247962680957
Energy: 0.6269042740301296
Energy: 0.6575187533706379
Energy: 0.6087577866861599
Energy: 0.6536244354673003
Energy: 0.6553884803369259
Energy: 0.6295030033521458
Energy: 0.6406108446355484
Energy: 0.6558423924721329
Energy: 0.6295171294173062
Energy: 0.6504809707485736
Energy: 0.8976873545895555
Energy: 0.7352032737156782
Energy: 0.7043550273915407
Energy: 0.8915718896100817
Energy: 0.6974788521176053
Energy: 0.7082043213005257

minimum gb energy = 0.6076779750611465 eV
minimum distance =  2.64515005381914 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.013510763262097249
Energy: 0.014220072898326115
Energy: 0.01395934044935216
Energy: 0.014883608025014452
Energy: 0.45341663599285753
Energy: 0.013974314872781907
Energy: 0.014519953998233104
Energy: 0.07581155588884192
Energy: 0.07450296623643066
Energy: 0.07593863324803127
Energy: 0.07562012785047857
Energy: 0.0743119954743069
Energy: 0.7607154629561479
Energy: 0.4524624223718003
Energy: 0.4516299342009909
Energy: 0.45392570996380005
Energy: 0.4554998347614432
Energy: 0.4511017833858631
Energy: 0.014519953998233104
Energy: 0.07581155588849253
Energy: 0.07450296623678004
Energy: 0.07593863324735191
Energy: 0.07562012785014859
Energy: 0.07431199547463688

minimum gb energy = 0.013510763262097249 eV
minimum distance =  2.84493083976848 Angstroms
sigma value = 1