Model name: model_name=EAM_Dynamo_FoilesHoyt_2006_Ni__MO_776437554506_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000628829002
cohesive_energy=4.4503500197622685
mass=58.6934
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=[1.8683782817391e-19, 2.7765240414229795e-19, 3.4593557010674395e-19, 4.0089984171274793e-19, 4.46683641205932e-19, 4.85598909469158e-19, 5.1910362723936595e-19, 5.48191144029636e-19, 5.73574428442098e-19, 5.957886074725079e-19, 6.15255053575608e-19, 6.32284589018394e-19, 6.47162401241718e-19, 6.601015797379019e-19, 6.71286374819856e-19, 6.808737997977119e-19, 6.889968353320919e-19, 6.957692359640099e-19, 7.012951431746759e-19, 7.056594723256919e-19, 7.08943934425392e-19, 7.112158208924039e-19, 7.1253921879208805e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.11028366226226e-19, 7.083543334240799e-19, 7.04281600420452e-19, 6.98568238543608e-19, 6.90924253822794e-19, 6.81003576105066e-19, 6.683944459954859e-19, 6.525921778543439e-19, 6.32989546737354e-19, 6.088383361564379e-19, 5.7921889672368e-19, 5.4299368302894e-19, 4.98730349161422e-19, 4.4462804858451e-19, 3.783828512985119e-19, 2.9701791311745597e-19, 1.9665436441042797e-19, 7.213656098687939e-20, -8.337871399233059e-20, -2.7846791204900397e-19, -5.26335852565242e-19, -8.460309737603339e-19, -1.2569940869112359e-18, -1.8008946019150197e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01810389350124153
Energy: 0.5768264696480474
Energy: 0.018644821517699268
Energy: 0.018425290719542693
Energy: 0.5757370993758457
Energy: 0.018492731320629445
Energy: 0.5768264696522739
Energy: 0.1463735658223988
Energy: 0.14841593074011145
Energy: 0.14673616663631373
Energy: 0.14636496449512462
Energy: 0.14788758572816504
Energy: 0.018644821517699268
Energy: 0.14841593074011145
Energy: 0.14777521362117838
Energy: 0.01864606348645214
Energy: 0.14638405796455184
Energy: 0.14707750026554342
Energy: 0.0184252907185504
Energy: 0.14673616663631373
Energy: 0.01864606348645214
Energy: 0.01847254023465485
Energy: 0.1464711029681593
Energy: 0.018531171523085095
Energy: 0.5757370993793738
Energy: 0.14636496449416905
Energy: 0.14638405796484588
Energy: 0.14647110296621146
Energy: 0.14655609034067588
Energy: 0.1463481255220575
Energy: 0.018492731321915753
Energy: 0.14788758572845906
Energy: 0.1470775002658742
Energy: 0.018531171522754335
Energy: 0.1463481255220575
Energy: 0.01855752700297526

minimum gb energy = 0.01810389350124153 eV
minimum distance =  2.48596373910841 Angstroms
sigma value = 1


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

Energy: 1.615855014472031
Energy: 1.0638798739262938
Energy: 1.103872569847645
Energy: 1.0725389759615704
Energy: 1.0803259388314073
Energy: 1.104120330551103
Energy: 1.493692862432026
Energy: 1.0376229647161974
Energy: 1.0235222862007494
Energy: 1.0734133013176537
Energy: 1.05611459530549
Energy: 1.0706399155572186
Energy: 1.4386782320804685
Energy: 1.0361891861567154
Energy: 1.023667708310707
Energy: 1.0675502271964505
Energy: 1.0614736249440015
Energy: 1.0440544684408162
Energy: 1.6388422476516509
Energy: 1.043845627328383
Energy: 1.0428955338213106
Energy: 1.043784929111189
Energy: 1.0437370555765488
Energy: 1.0430932269788695
Energy: 1.4986820415104025
Energy: 1.0709045590685857
Energy: 1.0715869886616136
Energy: 1.0882398901788437
Energy: 1.0710351227707853
Energy: 1.0738755435908418
Energy: 1.478211239253883
Energy: 1.0727350915615785
Energy: 1.0725055751916133
Energy: 1.0716957094728579
Energy: 1.074466337358936
Energy: 1.0740814752864072
Energy: 1.4795214981674893
Energy: 1.072442229587529
Energy: 1.0725688391866304
Energy: 1.0715369666876906
Energy: 1.0717799806808663
Energy: 1.0710891692148123
Energy: 1.457974612639852
Energy: 1.0790525043423436
Energy: 1.084387106342626
Energy: 1.0660435400664041
Energy: 1.0788289762055794
Energy: 1.0714781484653315
Energy: 1.2046063518620354
Energy: 1.0723628212192182
Energy: 1.0739731013628808
Energy: 1.0832721614154126
Energy: 1.0654725420861104
Energy: 1.0708800963586829
Energy: 1.195977440796807
Energy: 1.0913619463893653
Energy: 1.089685003846985
Energy: 1.0718025703658562
Energy: 1.0883744341384127
Energy: 1.0766349797501833
Energy: 1.2147785790271328
Energy: 1.053059179435163
Energy: 1.036109356664631
Energy: 1.0999716912023416
Energy: 1.053271141423838
Energy: 1.0275251005001858
Energy: 1.0937942391959823
Energy: 1.0436210429761914
Energy: 1.0437726749844363
Energy: 1.0576050023743415
Energy: 1.082464435862148
Energy: 1.0236878074841995
Energy: 1.0939673736696345
Energy: 1.0578952228762535
Energy: 1.0731308392279337
Energy: 1.07681377097104
Energy: 1.0773387216791812
Energy: 1.0478338125686726
Energy: 1.2159275127066103
Energy: 1.0432873007488188
Energy: 1.0430103583624903
Energy: 1.0883288683204095
Energy: 1.0433989083576727
Energy: 1.0284759590520722
Energy: 1.120204401243367
Energy: 1.0907961829856578
Energy: 1.0882489151174415
Energy: 1.0557782737392196
Energy: 1.0726961413237432
Energy: 1.051676144868007
Energy: 1.1208121270889264
Energy: 1.0438862325716558
Energy: 1.0435550811780692
Energy: 1.0720186329122674
Energy: 1.0382740370321346
Energy: 1.0438240447437253
Energy: 1.3288248793346722
Energy: 1.0692931837970723
Energy: 1.0694716382724447
Energy: 1.0438499275280757
Energy: 1.0697204029008833
Energy: 1.0438598297939288
Energy: 1.330696841210875
Energy: 1.0857629347852398
Energy: 1.0837899676525107
Energy: 1.0834783814753102
Energy: 1.0835928041697125
Energy: 1.0835327711653528
Energy: 1.3310772107156041
Energy: 1.0852619983091707
Energy: 1.0828117311113599
Energy: 1.0835303446821007
Energy: 1.0837156696815247
Energy: 1.0827243589986737
Energy: 1.4335605908643423
Energy: 1.0846567849457616
Energy: 1.0831787310645689
Energy: 1.082826659451693
Energy: 1.0833359579533575
Energy: 1.082618879293901
Energy: 1.546873360297959
Energy: 1.043957593549218
Energy: 1.0532564967769509
Energy: 1.0533726084009383
Energy: 1.0254224078147405
Energy: 1.053495717106169
Energy: 1.5514014855445688
Energy: 1.0590412708253782
Energy: 1.0438435189291462
Energy: 1.063336809395226
Energy: 1.0555009810716656
Energy: 1.0435530299843787
Energy: 1.5694801971894439
Energy: 1.0351603402584317
Energy: 1.0280252246302117
Energy: 1.088449690781169
Energy: 1.0444040479847745
Energy: 1.0641049726509038

minimum gb energy = 1.0235222862007494 eV
minimum distance =  2.30356504553458 Angstroms
sigma value = 33


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

Energy: 1.7624265755451582
Energy: 1.0722481771249721
Energy: 1.0860366435257829
Energy: 1.0858527972669079
Energy: 1.058244775810958
Energy: 1.08655310291406
Energy: 1.3897422658738352
Energy: 1.0568331205920318
Energy: 1.0554973905668783
Energy: 1.104630074093454
Energy: 1.0558882735190787
Energy: 1.0727737113597284
Energy: 1.3784710617590679
Energy: 1.086728254593328
Energy: 1.0871896638196823
Energy: 1.0749655835779652
Energy: 1.0866764269132514
Energy: 1.072526933255443
Energy: 1.4794408405646615
Energy: 1.0551239688436154
Energy: 1.056349984609234
Energy: 1.0685664266937194
Energy: 1.0564081547832151
Energy: 1.0682694765689214
Energy: 1.3820007227495592
Energy: 1.1044678521194236
Energy: 1.105381677161348
Energy: 1.1045583809396593
Energy: 1.1055070810879264
Energy: 1.074066648142459
Energy: 1.4835096043802147
Energy: 1.0724745883067368
Energy: 1.0745911084296274
Energy: 1.071713200050882
Energy: 1.0708152099375758
Energy: 1.0722118146247581
Energy: 1.4818396962031255
Energy: 1.0744961159440916
Energy: 1.0730126514825415
Energy: 1.071356963287126
Energy: 1.0734950728117105
Energy: 1.071970392410259
Energy: 1.3806946700678377
Energy: 1.100831688227352
Energy: 1.1023280323290094
Energy: 1.0742177843525482
Energy: 1.0998489872397725
Energy: 1.100957862865726
Energy: 1.1776819269280958
Energy: 1.0988882056881093
Energy: 1.072120440585245
Energy: 1.1041500210631527
Energy: 1.0988424722433112
Energy: 1.0722405585526888
Energy: 1.1754074646634924
Energy: 1.1050406822359113
Energy: 1.1049450953926168
Energy: 1.1040604207053355
Energy: 1.1044998435722218
Energy: 1.1034515949335446
Energy: 1.2201573158586707
Energy: 1.0097721358542653
Energy: 1.0095797196008682
Energy: 1.191628930308545
Energy: 1.009955724959032
Energy: 1.009833132764117
Energy: 1.0866169129045105
Energy: 1.0667669285697137
Energy: 1.072389273437833
Energy: 1.086171823409016
Energy: 1.0695539129236744
Energy: 1.026764526577136
Energy: 1.0870655362973844
Energy: 1.1068992466761238
Energy: 1.0759532654437294
Energy: 1.0871987667311866
Energy: 1.1046433244039493
Energy: 1.056175707079703
Energy: 1.1015846288731097
Energy: 1.0694807687381092
Energy: 1.069462477339801
Energy: 1.0574273968598362
Energy: 1.0693016786847256
Energy: 1.0694927884448986
Energy: 1.1758095908618282
Energy: 1.1043122906086449
Energy: 1.0741261150197632
Energy: 1.105572480156718
Energy: 1.1049417039863991
Energy: 1.1033059790480229
Energy: 1.178819304302148
Energy: 1.071690297499925
Energy: 1.0715043066318588
Energy: 1.104199259888135
Energy: 1.0715870545806834
Energy: 1.0726464632482096
Energy: 1.4224394628475987
Energy: 1.0708718974083091
Energy: 1.0710231362230997
Energy: 1.0719952823516183
Energy: 1.0713090358559578
Energy: 1.072601418904786
Energy: 1.2864857338087028
Energy: 1.0738841533988157
Energy: 1.0724018246537963
Energy: 1.099242719904567
Energy: 1.0742093020318446
Energy: 1.1000074385686052
Energy: 1.2749193305298832
Energy: 1.1028594386139667
Energy: 1.074831134040355
Energy: 1.0991405164417838
Energy: 1.1035669470391514
Energy: 1.0720877172483827
Energy: 1.381132583373268
Energy: 1.1061908068638433
Energy: 1.1073108452418776
Energy: 1.1044112434294546
Energy: 1.1061980161901732
Energy: 1.1048326226166727
Energy: 1.6738070320468528
Energy: 1.0727652075965677
Energy: 1.0098799836892272
Energy: 1.0097993690347138
Energy: 1.0724123183663226
Energy: 1.0094254887607774
Energy: 1.2754033582351403
Energy: 1.0556166959923057
Energy: 1.024693732902611
Energy: 1.0688897127344865
Energy: 1.0558525713658227
Energy: 1.071562483382215
Energy: 1.3883579409342275
Energy: 1.0867982718704856
Energy: 1.0868237888210512
Energy: 1.1052658029466707
Energy: 1.0867475674082983
Energy: 1.0277079269208735
Energy: 1.5172766597369496
Energy: 1.071702943720316
Energy: 1.0561009806474682
Energy: 1.0691970417183707
Energy: 1.0724978166862336
Energy: 1.1039012686108798
Energy: 1.3857650210513357
Energy: 1.060610538055235
Energy: 1.1039609281875
Energy: 1.1058239596074868
Energy: 1.0614254597385453
Energy: 1.0739474269383729
Energy: 1.3813916575030947
Energy: 1.069976747996155
Energy: 1.0726311231467318
Energy: 1.0717159938767988
Energy: 1.0726432623812816
Energy: 1.0733412928454429
Energy: 1.4816653731911822
Energy: 1.071856210522687
Energy: 1.0718725766014772
Energy: 1.0715812202576576
Energy: 1.0717767640528215
Energy: 1.0712082070474807
Energy: 1.3826091176617956
Energy: 1.0993506520822394
Energy: 1.1004591419095937
Energy: 1.0727340952141056
Energy: 1.0992015597624734
Energy: 1.0727245080874033
Energy: 1.1795502383999372
Energy: 1.0997133922800881
Energy: 1.1003486543535683
Energy: 1.1051368146215512
Energy: 1.0995249390598776
Energy: 1.0740706639663538
Energy: 1.1790521945635517
Energy: 1.1036803062028264
Energy: 1.1027125251396785
Energy: 1.1052854749147987
Energy: 1.1041408859410495
Energy: 1.1068578418156552
Energy: 1.2200434405829559
Energy: 1.0095004559984657
Energy: 1.0092974573179876
Energy: 1.0563648262183278
Energy: 1.0096556189341062
Energy: 1.0096387322744764
Energy: 1.086686651074924
Energy: 1.0155182864155632
Energy: 1.0156798072322792
Energy: 1.0868040642134322
Energy: 1.0160278679494708
Energy: 1.073317316616726
Energy: 1.0889720178261977
Energy: 1.1050342540154896
Energy: 1.0279647112279804
Energy: 1.0880014316322166
Energy: 1.1051387902824092
Energy: 1.086394095444896
Energy: 1.086333662545354
Energy: 1.069401685921778
Energy: 1.0677373877606526
Energy: 1.0862315556047724
Energy: 1.069241294697923
Energy: 1.104894425403115
Energy: 1.1754188030013772
Energy: 1.1064418014548154
Energy: 1.1055169537289102
Energy: 1.060731389935107
Energy: 1.1059152212189267
Energy: 1.1021756460471885
Energy: 1.1752750633185132
Energy: 1.0714747805011686
Energy: 1.0713840695898125
Energy: 1.1046655903445637
Energy: 1.063802776100841
Energy: 1.0741285519414343
Energy: 1.1763197225322024
Energy: 1.0719031395857745
Energy: 1.0718074123263281
Energy: 1.0266161302882348
Energy: 1.0714155983242555
Energy: 1.072082499501916
Energy: 1.27455524755695
Energy: 1.071486463158736
Energy: 1.0833669069624394
Energy: 1.098775849251802
Energy: 1.0710115285787052
Energy: 1.0812259962469923
Energy: 1.2835550699030776
Energy: 1.1055916571075821
Energy: 1.0730565644220351
Energy: 1.0998007191175656
Energy: 1.1057690632181756
Energy: 1.100825194312426
Energy: 1.3814937801775808
Energy: 1.1022309791209943
Energy: 1.1044822941579293
Energy: 1.104073244947808
Energy: 1.103316950472696
Energy: 1.0767158971377961
Energy: 1.6779176994372065
Energy: 1.0255521413093438
Energy: 1.0097400237126293
Energy: 1.0099166872385361
Energy: 1.0563953082024264
Energy: 1.0094342656061093

minimum gb energy = 1.0092974573179876 eV
minimum distance =  2.35091749463469 Angstroms
sigma value = 51


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

Energy: 1.6754942976681146
Energy: 1.063511671436645
Energy: 1.0806101804472485
Energy: 1.1139800443248171
Energy: 1.0633636275945866
Energy: 1.119343079096787
Energy: 1.297147025717783
Energy: 1.0986489745677752
Energy: 1.0690160292578486
Energy: 1.107518448865944
Energy: 1.098566809276994
Energy: 1.0683823078916426
Energy: 1.5187451279734565
Energy: 1.0988274928898687
Energy: 1.068027141756211
Energy: 1.0817203333352352
Energy: 1.1187730684705917
Energy: 1.0634661488794528
Energy: 1.516839388963664
Energy: 1.062560981222216
Energy: 1.062719092797514
Energy: 1.0745168690811713
Energy: 1.068574199845749
Energy: 1.0731231573339524
Energy: 1.2981000751873841
Energy: 1.130191484704861
Energy: 1.1288183689906615
Energy: 1.1077911065770845
Energy: 1.1281124392550699
Energy: 1.106835345968551
Energy: 1.2994082291065918
Energy: 1.1075305355946703
Energy: 1.1061397036589484
Energy: 1.1281431893964602
Energy: 1.1285140798438205
Energy: 1.1253289187371365
Energy: 1.296686836778322
Energy: 1.107885284730853
Energy: 1.127710328524069
Energy: 1.1281477169886427
Energy: 1.1076128906781983
Energy: 1.1279172070604317
Energy: 1.3054255856293029
Energy: 1.0484294508154144
Energy: 1.0485523060531903
Energy: 1.0922407142053279
Energy: 1.0490375188942282
Energy: 1.0481628322565102
Energy: 1.1202859167004138
Energy: 1.0484397759026496
Energy: 1.0481173683697118
Energy: 1.0987285910550757
Energy: 1.0489206004525768
Energy: 1.062576914763815
Energy: 1.118729931058842
Energy: 1.086523823328932
Energy: 1.0929095589585953
Energy: 1.0993114506637605
Energy: 1.1207905336467072
Energy: 1.0985473043447813
Energy: 1.1794433711629786
Energy: 1.0607369079592706
Energy: 1.0604470914303088
Energy: 1.0935161884096525
Energy: 1.0608371527351619
Energy: 1.0602355454961248
Energy: 1.1552081203515105
Energy: 1.1198715717492105
Energy: 1.0480977778273983
Energy: 1.0718299517031733
Energy: 1.1011765701858613
Energy: 1.0729029230742047
Energy: 1.1547618698126123
Energy: 1.0763445699498246
Energy: 1.0755232787668578
Energy: 1.1063331727982681
Energy: 1.076814870281009
Energy: 1.106613563866752
Energy: 1.1558157854214024
Energy: 1.078344043709903
Energy: 1.0780277208389253
Energy: 1.1064084542654251
Energy: 1.078938239335256
Energy: 1.0772802906872962
Energy: 1.3838605638472774
Energy: 1.085538109358776
Energy: 1.0840440295795335
Energy: 1.0932740193645198
Energy: 1.0852447363828588
Energy: 1.0877176822026782
Energy: 1.387102174341279
Energy: 1.0859167877235045
Energy: 1.0840282597673243
Energy: 1.095959204944273
Energy: 1.1071297941449947
Energy: 1.0941945311693162
Energy: 1.411418036576338
Energy: 1.1062811562583112
Energy: 1.106513305703639
Energy: 1.1250715601673016
Energy: 1.1287852024843865
Energy: 1.0838633932536608
Energy: 1.6441155947527926
Energy: 1.0678487764570401
Energy: 1.0633314708824566
Energy: 1.0465280753843893
Energy: 1.068012373336405
Energy: 1.0641547745141762

minimum gb energy = 1.0465280753843893 eV
minimum distance =  2.32296795977981 Angstroms
sigma value = 19


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

Energy: 1.420718806898655
Energy: 1.0429550203446392
Energy: 1.0344994044830103
Energy: 1.191826536131595
Energy: 1.042652519546752
Energy: 1.0341285737591852
Energy: 1.2270439776289621
Energy: 1.0427021611847047
Energy: 1.042598162929644
Energy: 1.0653236793989513
Energy: 1.0428587627389299
Energy: 1.0430381617353686
Energy: 1.5147458526435784
Energy: 1.0425938566546822
Energy: 1.042554343799844
Energy: 1.0315849988929855
Energy: 1.0426019579141672
Energy: 1.042611327630661
Energy: 1.2166686448011426
Energy: 1.042686044989326
Energy: 1.042723716621792
Energy: 1.054713885630345
Energy: 1.0426089911328131
Energy: 1.042682265663917
Energy: 1.2270095206567344
Energy: 1.042584807938284
Energy: 1.080419443044296
Energy: 1.0730830649847944
Energy: 1.0425489234249548
Energy: 1.0821284656477537
Energy: 1.2272473017599135
Energy: 1.010591901187168
Energy: 1.0817888641263673
Energy: 1.0699060448132645
Energy: 1.0105884384260477
Energy: 1.0700005280859606
Energy: 1.2257966004557628
Energy: 1.0821114333641046
Energy: 1.0875398385105002
Energy: 1.0690567963517528
Energy: 1.0224846238130678
Energy: 1.0665024599615947
Energy: 1.185011163622658
Energy: 0.9734829058418025
Energy: 0.9739542658083313
Energy: 1.0433765502344021
Energy: 0.9735303204078223
Energy: 0.9737076939722706
Energy: 1.0420897553530495
Energy: 0.974147096225317
Energy: 0.9734592497710163
Energy: 1.0420611945564973
Energy: 0.9737509456397587
Energy: 0.9955580643279663
Energy: 1.0425212736089455
Energy: 1.0308274252329073
Energy: 1.0428176986882323
Energy: 1.0425464688870867
Energy: 1.0710018754681165
Energy: 1.0425466626563935
Energy: 1.0427047178197733
Energy: 1.0548377428072362
Energy: 1.0554571235567087
Energy: 1.0427517191219329
Energy: 1.055303095881861
Energy: 1.0425603282768765
Energy: 1.2249120173424537
Energy: 1.0693691499826217
Energy: 1.0807797956510283
Energy: 1.0423150872220006
Energy: 1.0820492838937528
Energy: 1.042704431856384
Energy: 1.0102053119677912
Energy: 1.064919904006076
Energy: 1.0820724066741791
Energy: 1.0135045013566109
Energy: 1.0656302502151085
Energy: 1.068370237396744
Energy: 1.225704305168777
Energy: 1.0713699037827316
Energy: 1.0705972205236585
Energy: 1.0427251089432263
Energy: 1.0734268663091033
Energy: 1.0694445347096309
Energy: 1.4255733854133876
Energy: 1.0439839273992817
Energy: 1.0443811286706377
Energy: 0.9738852699910011
Energy: 1.0424681782115701
Energy: 0.9734377424535356
Energy: 1.4221514778970439
Energy: 1.0429789777368237
Energy: 0.9737698024097825
Energy: 0.9740139286449417
Energy: 1.0424107636523356
Energy: 0.9741211229154515
Energy: 1.2278420189307797
Energy: 1.0427931542041518
Energy: 1.0428811615063323
Energy: 1.0671179768064856
Energy: 1.0431834940716544
Energy: 1.0427519483982906
Energy: 1.2190340371292452
Energy: 1.0423594885244754
Energy: 1.0428100124158926
Energy: 1.0544286249630386
Energy: 1.0425342348447162
Energy: 1.0427520626296107
Energy: 1.2147873953144852
Energy: 1.0425937363706173
Energy: 1.042701348776934
Energy: 1.0543052179120744
Energy: 1.0425293845426427
Energy: 1.0423393198737252
Energy: 1.2261420457996097
Energy: 1.0104233931971036
Energy: 1.0821297965707914
Energy: 1.0665484863352517
Energy: 1.0102614542619388
Energy: 1.081572124311756
Energy: 1.2213894143478452
Energy: 1.0805196335162617
Energy: 1.0840834111123479
Energy: 1.0752240703339249
Energy: 1.0827788971472596
Energy: 1.0704233693214034
Energy: 1.2256380419938941
Energy: 1.0817105056674556
Energy: 1.0820582890091033
Energy: 1.0652500340198525
Energy: 1.0237869955074828
Energy: 1.0824691985799455
Energy: 1.0227068221835514
Energy: 0.9743240189440208
Energy: 0.9734757867008224
Energy: 1.0228361208387553
Energy: 0.9741576400521874
Energy: 0.9739353170943492
Energy: 1.0427534992495038
Energy: 1.0305218679207033
Energy: 1.0440380668629488
Energy: 1.0428296127265053
Energy: 0.9896286444116449
Energy: 1.042907057337457
Energy: 1.0427325047896066
Energy: 1.0442168306155475
Energy: 1.0425848927469845
Energy: 1.0427226293526544
Energy: 1.075915598502006
Energy: 1.04261926330291
Energy: 1.188965115299868
Energy: 1.0544547829260744
Energy: 1.054975251675685
Energy: 1.0453818885826414
Energy: 1.0545299951620135
Energy: 1.0427399659644248
Energy: 1.2260332104827323
Energy: 1.0780566173216
Energy: 1.0807579260193672
Energy: 1.0766004414652584
Energy: 1.0729012637023059
Energy: 1.0812368881400714
Energy: 1.0104840174438556
Energy: 1.0687347426032072
Energy: 1.0650438254979795
Energy: 1.0103959720372198
Energy: 1.0695491166416755
Energy: 1.0814095641040293
Energy: 1.1872950412568366
Energy: 1.069622883334476
Energy: 1.0658891932753722
Energy: 1.0231430113659397
Energy: 1.0692289885870543
Energy: 1.0684554232536558
Energy: 1.4238607561678023
Energy: 1.044150107883209
Energy: 0.9921929346544504
Energy: 0.9737543410492668
Energy: 1.0422057405039238
Energy: 0.973971518250985

minimum gb energy = 0.9734377424535356 eV
minimum distance =  2.36441861825492 Angstroms
sigma value = 27


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

Energy: 1.2190230768408512
Energy: 1.0242858611220698
Energy: 1.2454814568601522
Energy: 0.9475932388704205
Energy: 1.0243705230739726
Energy: 1.2432198826838794
Energy: 1.2137257853407386
Energy: 1.0505564117721846
Energy: 1.0278559544309933
Energy: 0.9729673435232233
Energy: 1.0503410244585567
Energy: 0.9690821121199705
Energy: 1.1019747561628876
Energy: 1.0521683337003926
Energy: 1.0526000031440195
Energy: 0.971113304912175
Energy: 1.0517295655361525
Energy: 0.9977484519386592
Energy: 1.1046696077500968
Energy: 1.0515870627182258
Energy: 0.9672545661643923
Energy: 0.9705072578920814
Energy: 1.0511670912497175
Energy: 0.9713774749488165
Energy: 1.2143119585096698
Energy: 0.919404551963672
Energy: 0.9699387594772153
Energy: 1.0265627393232957
Energy: 0.9187957907385542
Energy: 0.9696306003469519
Energy: 1.0505180668226672
Energy: 0.9199590543084645
Energy: 0.9189436202714324
Energy: 1.0507134129992683
Energy: 0.9194376539097415
Energy: 0.9191637701098715
Energy: 1.0515781173644638
Energy: 0.9698222601605568
Energy: 0.9698009579838354
Energy: 1.0520784172639221
Energy: 0.9698619327767021
Energy: 1.0522509007526286
Energy: 1.0508856991429825
Energy: 0.9664650844353465
Energy: 0.9859588000674532
Energy: 1.051133885036086
Energy: 0.9659358890332554
Energy: 0.9585402884398921
Energy: 1.1016801601640154
Energy: 0.9655954991968534
Energy: 0.9728721675610993
Energy: 1.0503542169945213
Energy: 0.9646735437147688
Energy: 0.9709796643749974
Energy: 1.10409642579168
Energy: 0.9924909922023382
Energy: 0.9623260858072638
Energy: 0.9963136714531874
Energy: 0.9964241564188767
Energy: 0.9644586763230244
Energy: 1.1017696445898961
Energy: 0.996805557821114
Energy: 0.9978961720333691
Energy: 0.9961555179021991
Energy: 1.035238587149537
Energy: 0.9979576585053979
Energy: 1.1025012080276733
Energy: 0.997609615878598
Energy: 0.9692567173550957
Energy: 0.9729750962654548
Energy: 0.997665798564478
Energy: 0.9696075451067464

minimum gb energy = 0.9187957907385542 eV
minimum distance =  2.30607183402151 Angstroms
sigma value = 9


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

Energy: 2.0638204516109764
Energy: 1.0069024151558672
Energy: 0.858905155659044
Energy: 0.9275948326568466
Energy: 1.0073224511590064
Energy: 1.0388023890529412
Energy: 0.9421703264812924
Energy: 0.8967862912097964
Energy: 0.9068135198995592
Energy: 0.8961851259749328
Energy: 0.9148755688784168
Energy: 0.889496689240148
Energy: 0.9442912028771118
Energy: 0.914960408494245
Energy: 0.9024620265732091
Energy: 0.9174271023378225
Energy: 0.915300226331847
Energy: 0.8838426902898334
Energy: 0.944549293144678
Energy: 0.8811698501439332
Energy: 0.8668662681928342
Energy: 0.9018192962117435
Energy: 0.915901483676418
Energy: 0.9075397584415044
Energy: 1.0156129800401295
Energy: 0.9168777794781875
Energy: 0.9146695428610564
Energy: 0.9397515450574944
Energy: 0.9162212806332373
Energy: 0.9139789181614849
Energy: 0.9398924828086059
Energy: 0.8913198484357392
Energy: 0.9239609161079048
Energy: 0.9397690937264043
Energy: 0.8841008596396813
Energy: 0.8726332186165577
Energy: 0.940633356448107
Energy: 0.8812445337423712
Energy: 0.880205870952915
Energy: 0.9410136972812483
Energy: 0.8851576603660408
Energy: 0.9403895084591191
Energy: 0.9589305957708004
Energy: 0.9068318162532986
Energy: 0.8828960106676228
Energy: 0.939225336900541
Energy: 0.8986946399534255
Energy: 0.9188409609662492
Energy: 1.0996745386777536
Energy: 0.9279942524689399
Energy: 0.8922592068819486
Energy: 0.9545405999702475
Energy: 0.9278698143040881
Energy: 0.9493934973772655
Energy: 0.8725828619798154
Energy: 0.9183993204694889
Energy: 0.879378599848967
Energy: 0.8833182285323807
Energy: 0.9529108746709581
Energy: 0.9143041600424973
Energy: 0.8725326610665372
Energy: 0.9398753169148227
Energy: 0.9522768352468854
Energy: 0.9131152883713379
Energy: 0.9396784436618879
Energy: 0.8961201034333433
Energy: 1.1164346615324279
Energy: 0.9400504043159371
Energy: 0.9400668987926887
Energy: 0.895245603809339
Energy: 0.940084299808552
Energy: 0.9137478819810302
Energy: 0.9346008822837909
Energy: 1.1169948673813903
Energy: 0.8912079614393964
Energy: 0.8738328885629515
Energy: 0.9301522110010129
Energy: 0.8785446346341319
Energy: 1.1151591648184174
Energy: 0.9396081749955223
Energy: 0.8999774527500901
Energy: 0.8958629529904696
Energy: 0.9397249774623929
Energy: 0.914599969955148
Energy: 0.9149455596036179
Energy: 0.9093916579186259
Energy: 0.9127064469032536
Energy: 0.9151028698834999
Energy: 0.9119146103210916
Energy: 0.974272641107778
Energy: 0.9145384940397618
Energy: 0.8762242785220472
Energy: 0.8856638018224176
Energy: 0.9138367629686772
Energy: 0.9239801932453118
Energy: 0.9025199136543216
Energy: 0.9127404289905935
Energy: 0.8930136869624719
Energy: 0.9071689180134406
Energy: 0.9128027092923505
Energy: 0.8932004509897484
Energy: 0.8981495620871743
Energy: 0.9469390483056997
Energy: 0.9017682493536706
Energy: 0.880320047763311
Energy: 0.9127692375959515
Energy: 0.9132367248043708
Energy: 0.9244692937596332
Energy: 0.9444627930389512
Energy: 0.892731529721096
Energy: 0.8942910542782542
Energy: 0.9134396176433198
Energy: 0.8926405922606928
Energy: 0.8810201126766251
Energy: 0.9435550208887795
Energy: 0.8779021732994418
Energy: 0.8827133064697938
Energy: 0.8978051801906186
Energy: 0.897665346152635
Energy: 0.8667117331275233
Energy: 0.943740161334639
Energy: 0.8768673018718782
Energy: 0.879242965831115
Energy: 0.9422868335384423
Energy: 0.8985954293526076
Energy: 0.8894138427496887
Energy: 0.9959534068362859
Energy: 0.8949115499600975
Energy: 0.9475907084210766
Energy: 0.917419348040797
Energy: 0.9137694830705716
Energy: 0.8492188206312207
Energy: 0.9919749382085896
Energy: 0.8965593423896555
Energy: 0.8988347696579972
Energy: 0.9170638365515991
Energy: 0.9142713680488631
Energy: 0.858442381340571
Energy: 0.9438201407847532
Energy: 0.9147005403313758
Energy: 0.89515778163221
Energy: 0.939907615293238
Energy: 0.915005362190047
Energy: 0.8869766353601608
Energy: 1.2636985135413152
Energy: 0.8975406426219554
Energy: 0.896606997010415
Energy: 0.9147585151448536
Energy: 0.9163383539796716
Energy: 0.9269781135696169
Energy: 0.9427305926718317
Energy: 0.895975944238521
Energy: 0.9160686837775988
Energy: 0.9399925719000007
Energy: 0.8962347234977942
Energy: 0.9151450508015464
Energy: 0.8966119466083535
Energy: 0.8936369455572012
Energy: 0.8936431316282882
Energy: 0.8971234105348392
Energy: 0.9121868431102649
Energy: 0.9015592074297678
Energy: 0.9406341705298286
Energy: 0.880242613163113
Energy: 0.8825621672707716
Energy: 0.9402681451229161
Energy: 0.8959013302209887
Energy: 0.9521465273965021
Energy: 0.9401754032336336
Energy: 0.9172744230108931
Energy: 0.8950751092032891
Energy: 0.9403090521404178
Energy: 0.9182253480157223
Energy: 0.9514936014514652
Energy: 0.9287565537846488
Energy: 0.9056407481469436
Energy: 0.9511523597613529
Energy: 0.9005956911772918
Energy: 0.8989617718682849
Energy: 0.8795980131315077
Energy: 0.8725587235647175
Energy: 0.9219348563904293
Energy: 0.9369562587456088
Energy: 0.9130797380934589
Energy: 0.9277961328141594
Energy: 0.8919746312786445
Energy: 0.8801424440256769
Energy: 0.9391841031372602
Energy: 0.9511476704643237
Energy: 0.8827434532449806
Energy: 0.9390767626687728
Energy: 0.8942377584298155
Energy: 1.1139385391737537
Energy: 0.9400228174233807
Energy: 0.9399924323271462
Energy: 0.9433952617337751
Energy: 0.9420601219830217
Energy: 0.9076682964391194
Energy: 0.9388556268390869
Energy: 0.9398915343474994
Energy: 0.9404783825102109
Energy: 0.9120158909312311
Energy: 0.9399598268017257
Energy: 0.8886574227151609
Energy: 0.9339778579415066
Energy: 0.9398415381304948
Energy: 0.9140118806332448
Energy: 0.9105463628506474
Energy: 0.9397234434151138
Energy: 0.9140761522140082
Energy: 0.9361802905227611
Energy: 0.9107117759207843
Energy: 0.8854729629596162
Energy: 0.9404610429800292
Energy: 0.9137758342002907
Energy: 0.8664210344961024
Energy: 0.913423096564024
Energy: 0.9212535035682188
Energy: 0.8850782152431057
Energy: 0.9147078549826432
Energy: 0.9180933519849083
Energy: 0.9016048552302123
Energy: 0.9133205847063717
Energy: 0.8936475262652875
Energy: 0.8962767722831129
Energy: 0.9130906640320183
Energy: 0.8929355330492443
Energy: 0.9051438825927977
Energy: 0.9704754599495435
Energy: 0.878613326554545
Energy: 0.8778449870092015
Energy: 0.8991928952886322
Energy: 0.8790524759466942
Energy: 1.0897479624532453
Energy: 0.9429284211867122
Energy: 0.8907666530479762
Energy: 0.8976931365117637
Energy: 0.91308682014206
Energy: 0.8937458180531531
Energy: 0.900708446365985
Energy: 0.94285831244038
Energy: 0.879427034993072
Energy: 0.882860559654359
Energy: 0.8955653037696185
Energy: 0.899852496683139
Energy: 0.8813742956172753
Energy: 0.944632707652164
Energy: 0.8993591249004383
Energy: 0.9019483839566951
Energy: 0.8771633650748136
Energy: 0.8988120038950648
Energy: 0.8663523481053138
Energy: 0.9926079583322475
Energy: 0.8963154216148358
Energy: 0.8950734041327997
Energy: 0.9170073923136763
Energy: 0.9145516045254842
Energy: 0.8582201279117566

minimum gb energy = 0.8492188206312207 eV
minimum distance =  2.29913423359102 Angstroms
sigma value = 57


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

Energy: 0.44712236807477673
Energy: 0.5058101767843305
Energy: 0.4620548043937293
Energy: 0.4493135719517179
Energy: 0.5055260801915352
Energy: 0.4492013009318145
Energy: 0.5622827415460931
Energy: 0.474545027807166
Energy: 0.4747812814415527
Energy: 0.5035141496973975
Energy: 0.47596288400960884
Energy: 0.48429036685465165
Energy: 0.5653395145494059
Energy: 0.5090793085359709
Energy: 0.4741490011844181
Energy: 0.5062396754767778
Energy: 0.5072752850809337
Energy: 0.4737729815783098
Energy: 0.5656445135808119
Energy: 0.5090597868492562
Energy: 0.4734895004793731
Energy: 0.5066744953978696
Energy: 0.5080448212934707
Energy: 0.4736807923469899
Energy: 0.5610682442466917
Energy: 0.4516957659631944
Energy: 0.4782656462812317
Energy: 0.5079113976078838
Energy: 0.44938004524617076
Energy: 0.47462938733356275
Energy: 0.5067413630830481
Energy: 0.4501033158222557
Energy: 0.4516001278708268
Energy: 0.471015349350877
Energy: 0.44881658192690627
Energy: 0.4765687286547312
Energy: 0.5007048140671341
Energy: 0.47322829058016896
Energy: 0.47486046235502755
Energy: 0.5023442192926366
Energy: 0.4700889152673559
Energy: 0.48594991223159395
Energy: 0.5069344196044784
Energy: 0.4729050382849594
Energy: 0.5102356742950812
Energy: 0.507287694587842
Energy: 0.47333003513852245
Energy: 0.4736925963779925
Energy: 0.5602446357852746
Energy: 0.47419367813692126
Energy: 0.4881290553277267
Energy: 0.5066243871393122
Energy: 0.5058339644478946
Energy: 0.4737162004514947
Energy: 0.4478110127036175
Energy: 0.5113556964822763
Energy: 0.45109076302953166
Energy: 0.44827822820202284
Energy: 0.5052632831580852
Energy: 0.47659774479670264
Energy: 0.4478117794168588
Energy: 0.47291946528113804
Energy: 0.4745975207282028
Energy: 0.44850590013517205
Energy: 0.47117181492623933
Energy: 0.48177087726846507
Energy: 0.5629415096435538
Energy: 0.5091676391261056
Energy: 0.4853648607753362
Energy: 0.5062889429870379
Energy: 0.5058878566224994
Energy: 0.4850534475934233
Energy: 0.565819422622307
Energy: 0.5703094884056489
Energy: 0.5601963132456866
Energy: 0.47446614050558017
Energy: 0.5663838952774236
Energy: 0.510357813674728
Energy: 0.5614510014117094
Energy: 0.5089229186127403
Energy: 0.474009626198756
Energy: 0.5057212385973383
Energy: 0.5055966337255393
Energy: 0.47448545371337125
Energy: 0.5650919028449319
Energy: 0.45950759887705367
Energy: 0.4493006299726714
Energy: 0.5653230259832969
Energy: 0.45215386266721613
Energy: 0.45055796515748897
Energy: 0.5045607691231326
Energy: 0.47447290765046385
Energy: 0.4850793496174383
Energy: 0.506002568769072
Energy: 0.4500992678743981
Energy: 0.474922920909584
Energy: 0.5061844162506312
Energy: 0.48826938948740467
Energy: 0.4883730332223807
Energy: 0.506745443298221
Energy: 0.5073145127520148
Energy: 0.47422031943162773
Energy: 0.5646867172001447
Energy: 0.4733746398903221
Energy: 0.47894975160368214
Energy: 0.5653174618474809
Energy: 0.47520573837732855
Energy: 0.4734874537794207
Energy: 0.44791684936260384
Energy: 0.47343229942384435
Energy: 0.47405395134117784
Energy: 0.44876390192931914
Energy: 0.4739632309763119
Energy: 0.48980834547318847

minimum gb energy = 0.44712236807477673 eV
minimum distance =  2.3539444907898 Angstroms
sigma value = 11


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

Energy: 1.7288760314682377
Energy: 0.7923033721511649
Energy: 0.8723395693298489
Energy: 0.80928988097959
Energy: 0.7661118728633407
Energy: 0.8662111303877571
Energy: 0.7689475473515786
Energy: 0.7788835054906018
Energy: 0.7825817849377151
Energy: 0.7785092700297872
Energy: 0.768683160600488
Energy: 0.7884468552061643
Energy: 0.7671030613421215
Energy: 0.7743766985583792
Energy: 0.7766426076678402
Energy: 0.7681423874435142
Energy: 0.7729006269142215
Energy: 0.7778121720127101
Energy: 0.7671392574419197
Energy: 0.7812819143544357
Energy: 0.7837961623121872
Energy: 0.7690202688224094
Energy: 0.7719539216704199
Energy: 0.776961464652981
Energy: 0.7682019410430847
Energy: 0.8465314175251394
Energy: 0.8432598100525316
Energy: 0.7929063132199884
Energy: 0.7836379164422251
Energy: 0.7736302042104773
Energy: 0.8306286112034991
Energy: 0.8204823735447802
Energy: 0.8124302813329178
Energy: 0.7791166848217416
Energy: 0.7774164286365164
Energy: 0.843195786146142
Energy: 0.8264944248088453
Energy: 0.7786612835854103
Energy: 0.7735922726811052
Energy: 0.7683789309723358
Energy: 0.777080814475725
Energy: 0.7724225060214769
Energy: 0.8015490926725986
Energy: 0.7793311471430424
Energy: 0.7819148171144498
Energy: 0.7980032591019083
Energy: 0.7771933029533753
Energy: 0.7726008815605453
Energy: 0.8290553787294414
Energy: 0.7810393372588093
Energy: 0.8245000138053143
Energy: 0.7861955514201359
Energy: 0.7703968271134295
Energy: 0.8197569798652128
Energy: 0.8842705435722209
Energy: 0.810827963583305
Energy: 0.845966541815698
Energy: 0.7698732985431274
Energy: 0.8156623435059213
Energy: 0.8147459085962157
Energy: 1.1002169409543163
Energy: 0.8108431498556131
Energy: 0.8130855336166564
Energy: 0.7750008557492823
Energy: 0.8126558778855756
Energy: 0.8448607167942133
Energy: 0.8257888681160391
Energy: 0.751692349675326
Energy: 0.7654210634670203
Energy: 0.7785410090057953
Energy: 0.7467263830487716
Energy: 0.7841661539394159
Energy: 0.8845536931137435
Energy: 0.7536692652037179
Energy: 0.7940054071139687
Energy: 0.775043403709466
Energy: 0.747272446832566
Energy: 0.7847205630039424
Energy: 0.8845825390371345
Energy: 0.8473204405449264
Energy: 0.8465418636899752
Energy: 0.7807456934053753
Energy: 0.809419326396617
Energy: 0.8456645324893166
Energy: 0.884445529177824
Energy: 0.794961774781169
Energy: 0.8207164424582203
Energy: 0.8214302882403429
Energy: 0.7951795216330694
Energy: 0.815931035025693
Energy: 1.0976034752845416
Energy: 0.8476978822785759
Energy: 0.8451505432094661
Energy: 0.808360559307523
Energy: 0.8532388109918257
Energy: 0.8460687359758174
Energy: 1.0574040417717692
Energy: 0.8117592490710802
Energy: 0.7768600349254154
Energy: 0.7515773849495946
Energy: 0.8065176449895433
Energy: 0.7593458750831525
Energy: 1.3581413229495696
Energy: 0.8085322580458499
Energy: 0.8480702709896073
Energy: 0.7914965005773816
Energy: 0.8086050718898978
Energy: 0.8455224419539633
Energy: 1.1108189669649113
Energy: 0.7781897657123038
Energy: 0.8257536858298901
Energy: 0.7695937499778857
Energy: 0.7747180122778793
Energy: 0.8160560579319943
Energy: 0.8359322170776952
Energy: 0.7802604028087939
Energy: 0.7812812387554726
Energy: 0.7742965023787466
Energy: 0.8636682969136114
Energy: 0.7840784198538865
Energy: 1.0972428318347558
Energy: 0.8495588719232076
Energy: 0.8053577951035483
Energy: 0.8226444885836869
Energy: 0.8462479590624583
Energy: 0.8104802448871392
Energy: 1.0777007192916457
Energy: 0.7813610054172265
Energy: 0.7602716856539169
Energy: 1.1024581700516698
Energy: 0.7937690552944032
Energy: 0.8526390504170657
Energy: 0.7687390573406812
Energy: 0.8029012539263619
Energy: 0.8049222143522372
Energy: 0.771371507969477
Energy: 0.779786434741514
Energy: 0.8128538685882782
Energy: 0.7711988558027788
Energy: 0.7727866326017305
Energy: 0.769173808023846
Energy: 0.7725803785616638
Energy: 0.7701455275717537
Energy: 0.7755479000863544
Energy: 0.7672277469962915
Energy: 0.7713654027643448
Energy: 0.7970063704969383
Energy: 0.7707903423898165
Energy: 0.769294419080315
Energy: 0.7868697453727496
Energy: 0.8687933622135997
Energy: 0.7825611877899262
Energy: 0.7731107047626149
Energy: 0.7630596670715968
Energy: 0.7927899083209183
Energy: 0.844005879544025

minimum gb energy = 0.7467263830487716 eV
minimum distance =  2.31012627711353 Angstroms
sigma value = 41


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

Energy: 1.6429654396354272
Energy: 0.842257301582654
Energy: 0.8657258014007911
Energy: 0.9356720406752166
Energy: 0.9449604941937285
Energy: 0.8287283461176972
Energy: 0.8351021810771584
Energy: 0.8540868627259788
Energy: 0.8543150275309171
Energy: 0.838758440614358
Energy: 0.8371448796754607
Energy: 0.8313827903853123
Energy: 0.8367040089144084
Energy: 0.8403407855875561
Energy: 0.8331020727084019
Energy: 0.8396174719163005
Energy: 0.8397348072815773
Energy: 0.831649772353949
Energy: 0.8358389870742222
Energy: 0.8536431938748105
Energy: 0.8447655976217169
Energy: 0.8375107558650303
Energy: 0.8378544667673998
Energy: 0.8342179642332533
Energy: 0.8358999461213066
Energy: 0.8566168130801055
Energy: 0.8570295799720019
Energy: 0.852891601092742
Energy: 0.8617046012640431
Energy: 0.8552359905544732
Energy: 0.9273587837421473
Energy: 0.8444473467194247
Energy: 0.8429704315819284
Energy: 0.8536248034953103
Energy: 0.8389421783309517
Energy: 0.8445299705856127
Energy: 0.9294081494409687
Energy: 0.8380802743080705
Energy: 0.8453298612711243
Energy: 0.8352848011799198
Energy: 0.8544390210164867
Energy: 0.8429131080052547
Energy: 0.8682022418063517
Energy: 0.8673384230913485
Energy: 0.867997309442436
Energy: 0.7993935597256919
Energy: 0.8671977556775166
Energy: 0.8122619849802978
Energy: 1.1848709241133246
Energy: 0.8440912307805127
Energy: 0.8441935283859168
Energy: 0.8553496172861847
Energy: 0.8457015073462814
Energy: 0.8443763136076962
Energy: 0.9293988640086666
Energy: 0.8462561015259823
Energy: 0.8540314261648148
Energy: 0.8379124963056648
Energy: 0.8560194516322865
Energy: 0.8438199707648391
Energy: 0.9302730960663054
Energy: 0.8547434740806014
Energy: 0.8452383701576756
Energy: 0.8386736483091628
Energy: 0.8554007606874181
Energy: 0.8434277023195648
Energy: 0.928305489433182
Energy: 0.799300096128119
Energy: 0.7998777808479025
Energy: 0.8508376867847209
Energy: 0.8046815891184731
Energy: 0.8431573910884376
Energy: 0.8396350083512206
Energy: 0.7993949146053441
Energy: 0.7996766121953205
Energy: 0.8562960956144211
Energy: 0.799440518040896
Energy: 0.7999887647437273
Energy: 0.8408007420465494
Energy: 0.8541929239757718
Energy: 0.8437520954330897
Energy: 0.8387041744076636
Energy: 0.853828284426578
Energy: 0.8435510053606134
Energy: 0.8680034869065604
Energy: 0.8318462202327302
Energy: 0.8620635220435955
Energy: 0.8682129493260851
Energy: 0.8428989286631343
Energy: 0.8633051904158764
Energy: 0.8344853275983524
Energy: 0.857116486073577
Energy: 0.8430189111490729
Energy: 0.8548970424013244
Energy: 0.8369957002658109
Energy: 0.8423934335081622
Energy: 0.9881436605282243
Energy: 0.8554979084032437
Energy: 0.8411225449016595
Energy: 0.8010758162119938
Energy: 0.8573888929661034
Energy: 0.8004277304789149
Energy: 0.8671525990593734
Energy: 0.8564527118318186
Energy: 0.8571787833825436
Energy: 0.9036809255667136
Energy: 0.8628970644818573
Energy: 0.8354546447444572
Energy: 0.8349999097203132
Energy: 0.8379929562430223
Energy: 0.8382838726367886
Energy: 0.8372899848963339
Energy: 0.8390781441232382
Energy: 0.8319315776245004
Energy: 0.836591799503637
Energy: 0.8342424290203571
Energy: 0.8309697949319571
Energy: 0.8402356338047212
Energy: 0.8387045728978794
Energy: 0.8332222170179643
Energy: 0.8348277412092177
Energy: 0.8334834031873324
Energy: 0.8316876277315789
Energy: 0.8363484813280546
Energy: 0.8380350635581382
Energy: 0.845812422369868
Energy: 1.2931584175823276
Energy: 0.8559939554907632
Energy: 0.8973202419881539
Energy: 1.293389280622799
Energy: 0.8309292053011043
Energy: 0.8933137024151425
Energy: 0.9284472691259386
Energy: 0.84387145220323
Energy: 0.8422662504038558
Energy: 0.8520571386620371
Energy: 0.8387136377744111
Energy: 0.842903478060778
Energy: 0.867634613211027
Energy: 0.87079178320683
Energy: 0.8427675526727045
Energy: 0.8564925758901917
Energy: 0.8707094534226968
Energy: 0.8123918910385871
Energy: 0.929340982138832
Energy: 0.8380671222850515
Energy: 0.8430159269090831
Energy: 0.8522732810176227
Energy: 0.8383750420094835
Energy: 0.8441482414976241
Energy: 0.9299725790559289
Energy: 0.8549035256215424
Energy: 0.8450785022607329
Energy: 0.8399951674155957
Energy: 0.8581678223609039
Energy: 0.8460884221118894
Energy: 0.9297908681167757
Energy: 0.8535466805510966
Energy: 0.8438739497842823
Energy: 0.8376041115782764
Energy: 0.8589423116576461
Energy: 0.8432188745127422
Energy: 1.1851881177547832
Energy: 0.8337897605971154
Energy: 0.8569663522175796
Energy: 0.8554702674762392
Energy: 0.819051720536428
Energy: 0.8582169535777444
Energy: 0.8402501376798799
Energy: 0.7994030621917406
Energy: 0.800994518986519
Energy: 0.8562044254449965
Energy: 0.7986245526314444
Energy: 0.8014028915262337
Energy: 0.9306867045938935
Energy: 0.8562248648926656
Energy: 0.9155782466376343
Energy: 0.8433475334388482
Energy: 0.85578359625081
Energy: 0.9105174177835408
Energy: 0.8370319609188026
Energy: 0.8323303436444339
Energy: 0.831420727833749
Energy: 0.8370204845077693
Energy: 0.8390767431488082
Energy: 0.833761853165275
Energy: 0.8339307278559368
Energy: 0.8607718966255891
Energy: 0.8441065328995072
Energy: 0.8398230658616969
Energy: 0.8374049899229246
Energy: 0.8339615766479778
Energy: 0.9878315892318298
Energy: 0.9188604802362637
Energy: 0.8343608549867233
Energy: 0.8050553514008936
Energy: 0.8570180765408554
Energy: 0.8329932217050156

minimum gb energy = 0.7986245526314444 eV
minimum distance =  2.32083630899945 Angstroms
sigma value = 33


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

Energy: 1.1986346501910594
Energy: 0.9408091213204859
Energy: 0.9076115709402292
Energy: 0.9156691358234403
Energy: 0.9252232796110731
Energy: 0.9076567277836638
Energy: 0.9400789094870882
Energy: 0.9471708805675617
Energy: 0.9421359920750497
Energy: 0.9433997325338344
Energy: 0.940379066295474
Energy: 0.913731833319461
Energy: 0.9362652075691997
Energy: 0.9146222310987605
Energy: 0.9233541487428046
Energy: 0.9175792533644981
Energy: 0.9125412315391077
Energy: 0.9225025343551146
Energy: 0.9431610817368459
Energy: 0.9438018905445746
Energy: 0.9148615434356249
Energy: 0.9442463845291413
Energy: 0.9157002326919037
Energy: 0.9214432055924493
Energy: 0.9370732148425809
Energy: 0.930533627461591
Energy: 0.9119658208813124
Energy: 0.9835133076831997
Energy: 0.9114389758758447
Energy: 0.9158032936672629
Energy: 0.9749589216886042
Energy: 0.9099021936297522
Energy: 0.9169831011989436
Energy: 0.9998737040937853
Energy: 0.9164213701464129
Energy: 0.9196335101613948
Energy: 1.0740152573307007
Energy: 0.9358850870552918
Energy: 0.9354709224118758
Energy: 0.9771542225031116
Energy: 0.9617257026151654
Energy: 0.9321820353036037
Energy: 0.9783872945647831
Energy: 0.9448746137743222
Energy: 0.9060283220249118
Energy: 0.8780981078570395
Energy: 0.9542336990600195
Energy: 0.9000189922137964
Energy: 0.9733533428890243
Energy: 0.9133829892316566
Energy: 0.9051055583133812
Energy: 0.9169131954452395
Energy: 0.9060170442892691
Energy: 0.9131471959268782
Energy: 1.0556749072697842
Energy: 0.9055219119751843
Energy: 0.906092846444436
Energy: 0.9088741736196199
Energy: 0.9074403106543601
Energy: 0.9065993724255198
Energy: 0.9739923997855957
Energy: 0.9049680205647694
Energy: 0.9051100203133414
Energy: 0.8995901429344568
Energy: 0.9212102078603422
Energy: 0.9067306104417904
Energy: 1.0653648354995473
Energy: 0.8609390742556832
Energy: 0.8606010012787999
Energy: 0.904067124871551
Energy: 0.8675928630836597
Energy: 0.8609646160848138
Energy: 1.0772623769321084
Energy: 0.8605084100776202
Energy: 0.8607210664243843
Energy: 0.9034794966460004
Energy: 0.8704112833057472
Energy: 0.8607416141974145
Energy: 0.9282201516756613
Energy: 0.9052723664700055
Energy: 0.904028343447102
Energy: 0.8970520605372155
Energy: 0.909522931610118
Energy: 0.906045033481631
Energy: 0.8798852494535108
Energy: 0.9028378981564644
Energy: 0.901982629631212
Energy: 0.9023366190619116
Energy: 0.9029126644007278
Energy: 0.9015723548917164
Energy: 0.927778639429924
Energy: 0.9452608760603881
Energy: 0.912672444663253
Energy: 0.9383665399084166
Energy: 0.944700778982783
Energy: 0.9149796095781002
Energy: 0.9840995446071905
Energy: 0.9085080404457488
Energy: 0.9051519217702998
Energy: 0.916255986288321
Energy: 0.9898360624370388
Energy: 0.9096940048911116
Energy: 0.9847795857709588
Energy: 0.9782593099958451
Energy: 0.9463081106631277
Energy: 0.9103131926759286
Energy: 1.0031019136762376
Energy: 0.946431795118348
Energy: 0.9267087589762196
Energy: 0.8782268606564477
Energy: 0.8875665773271233
Energy: 0.9443555063220069
Energy: 0.8797856137616085
Energy: 0.9454287363906992
Energy: 0.9276714147580274
Energy: 0.8840708390795783
Energy: 0.8855486041297541
Energy: 0.9371368587930776
Energy: 0.8798228932661198
Energy: 0.9456512925344149
Energy: 0.9013106908016543
Energy: 1.0175336794388248
Energy: 0.9183666682254021
Energy: 0.9017675837787773
Energy: 0.9376151894824009
Energy: 0.940812021307613
Energy: 1.004872256831553
Energy: 0.9022923416815468
Energy: 0.9069092607960811
Energy: 0.9127558821433851
Energy: 0.902180470169388
Energy: 0.936854826779075
Energy: 0.9407883924669781
Energy: 0.9332190750731234
Energy: 0.9127943966299265
Energy: 0.9296575027304791
Energy: 0.9283223015934142
Energy: 0.909367070489313
Energy: 0.9600068270194105
Energy: 0.9853515307807581
Energy: 0.8624647981610153
Energy: 0.8609703430381439
Energy: 0.9704956876430938
Energy: 0.8611199777065822
Energy: 0.9591492445067415
Energy: 0.9385855828477488
Energy: 0.9381685169217377
Energy: 0.8991527541541225
Energy: 0.9097246804353899
Energy: 0.9174652969277197
Energy: 1.0193581288110836
Energy: 0.9127508207836473
Energy: 0.9036847462956127
Energy: 1.0171508015980442
Energy: 0.9103693396291198
Energy: 0.9138282398160725
Energy: 0.943571468743347
Energy: 0.9107490463292959
Energy: 0.9140152286827832
Energy: 0.9447216290336425
Energy: 0.9074917955478917
Energy: 0.9150536502341514
Energy: 0.9986582204651326
Energy: 0.940814118737921
Energy: 0.9393398255599936
Energy: 0.9785116534883389
Energy: 0.9060120631322465
Energy: 0.9458729666982625
Energy: 1.0286768240837099
Energy: 0.912935596799036
Energy: 0.9046018834864626
Energy: 1.0674458589181408
Energy: 0.9123149960132633
Energy: 0.9777838560645187
Energy: 0.9693090587379692
Energy: 0.9380032505994484
Energy: 0.9436430124865415
Energy: 0.9775226979031325
Energy: 0.9325514088499404
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Energy: 0.9872523623360113
Energy: 0.9375233023254965
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Energy: 0.9801417545707246
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Energy: 0.9379376160485337
Energy: 0.9401803134422266
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Energy: 0.9431202677873175
Energy: 0.9379793184371672
Energy: 1.0552265286750944
Energy: 0.9029922786156376
Energy: 0.9049186785600988
Energy: 0.9042276074816588
Energy: 0.9103225603213382
Energy: 0.9031469321409947
Energy: 1.0551270015384333
Energy: 0.9052179673321579
Energy: 0.9052293140204245
Energy: 0.9035744098173178
Energy: 0.9144286555858164
Energy: 0.9041584150485518
Energy: 0.9746260051602397
Energy: 0.8846349306676561
Energy: 0.8606346843880083
Energy: 0.9126640283528481
Energy: 0.8881333205401959
Energy: 0.90293676343953
Energy: 0.9878288843509818
Energy: 0.8607386328989568
Energy: 0.861009529062072
Energy: 0.9023994379868003
Energy: 0.8610205251906942
Energy: 0.8615200675866623
Energy: 0.9272661590204211
Energy: 0.9394806692955638
Energy: 0.9080824017718436
Energy: 0.896538707935155
Energy: 0.9377735065413255
Energy: 0.9059556741423964
Energy: 0.9202444387049022
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Energy: 0.9301540924610455
Energy: 0.9202190178546616
Energy: 0.9071616314215663
Energy: 0.939548473493117
Energy: 0.9276196524670103
Energy: 0.9401107612817017
Energy: 0.9115941200189577
Energy: 0.9098060962429784
Energy: 0.9455550425745017
Energy: 0.9088337789316429
Energy: 1.0619789648586324
Energy: 0.9675210818165848
Energy: 0.9053189426467659
Energy: 0.9168496381321983
Energy: 0.9677571118916674
Energy: 0.9089981777227033
Energy: 1.062030597299321
Energy: 0.9468642708135403
Energy: 0.9021839961204791
Energy: 0.9127404978184099
Energy: 0.968475944484364
Energy: 0.9262260421816254
Energy: 0.9300837545909648
Energy: 0.8887661677512046
Energy: 0.8854993306005543
Energy: 0.9114901560884691
Energy: 0.9456430534111868
Energy: 0.9094022808248786
Energy: 0.9862447321140136
Energy: 0.8782005023181925
Energy: 0.8858986002262687
Energy: 0.9160746746808475
Energy: 0.8790275799386611
Energy: 0.8863081583367776
Energy: 0.8895699772048599
Energy: 0.8930121654510439
Energy: 0.8937565824723851
Energy: 0.8908795266214241
Energy: 0.8901750022069235
Energy: 0.920524336140853
Energy: 0.9777597391066909
Energy: 0.9186378270079107
Energy: 0.9331070478843917
Energy: 0.9777709565898846
Energy: 0.9176669966874877
Energy: 0.9357936462527002
Energy: 0.9356217585576871
Energy: 0.9378990177373112
Energy: 0.9118346215262122
Energy: 0.9315653236690248
Energy: 0.9638746375659407
Energy: 0.9129110037671345
Energy: 1.152676452663376
Energy: 0.9069888621940968
Energy: 0.8780314679692883
Energy: 0.8799804076994757
Energy: 0.9318706898669181
Energy: 0.878291124904699

minimum gb energy = 0.8605084100776202 eV
minimum distance =  2.29986946582073 Angstroms
sigma value = 67


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

Energy: 1.2527735104846478
Energy: 0.992938803980764
Energy: 0.9369897491682635
Energy: 0.9451273459321085
Energy: 0.9914392047814061
Energy: 0.9330160370468686
Energy: 0.9805166319974987
Energy: 0.9401722585398906
Energy: 0.9385253361893793
Energy: 0.9396374503176814
Energy: 0.9439146309106646
Energy: 0.9377739732409995
Energy: 0.9852448367075753
Energy: 0.906349513584576
Energy: 0.9435253242708146
Energy: 0.9410677813639597
Energy: 0.9054099382125267
Energy: 0.9436049298753337
Energy: 0.982760264656127
Energy: 0.9394275770510276
Energy: 0.9397643873051976
Energy: 0.9490147713232113
Energy: 0.9396017897123453
Energy: 0.9395259938053185
Energy: 0.9769086588881968
Energy: 0.943153947472815
Energy: 0.9436077749335801
Energy: 0.9781113497169713
Energy: 0.9425535335377715
Energy: 0.9448249225131568
Energy: 0.980247226066662
Energy: 0.9435829837775245
Energy: 0.949264334086679
Energy: 0.9812579582037521
Energy: 0.9432207234785744
Energy: 0.9492465741304689
Energy: 1.0447209683873773
Energy: 0.9405841253265937
Energy: 0.940479311214541
Energy: 0.9022826905285407
Energy: 0.9448496848778688
Energy: 0.940685224636188

minimum gb energy = 0.9022826905285407 eV
minimum distance =  2.3514370188686 Angstroms
sigma value = 3


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

Energy: 1.6811334972104812
Energy: 1.660550086840085
Energy: 1.0840861981550296
Energy: 1.0559760267873741
Energy: 1.178237663853222
Energy: 1.13570121005296
Energy: 1.0918893129349312
Energy: 1.0863657623924927
Energy: 1.0408003314776793
Energy: 1.0705169076057535
Energy: 1.0754556432236937
Energy: 1.040770253219344
Energy: 1.1000971863321292
Energy: 1.0731387160457098
Energy: 1.071459802788926
Energy: 1.0338467262900217
Energy: 1.0726778427501897
Energy: 1.1393808356169988
Energy: 1.1011416930489601
Energy: 1.0404401787434725
Energy: 1.0323554193455347
Energy: 1.0411362439371754
Energy: 1.0666521709208492
Energy: 1.0333490845757654
Energy: 1.1026618380751514
Energy: 1.0339325233775662
Energy: 1.0948669918279463
Energy: 1.1059990590013293
Energy: 1.0916357825700782
Energy: 1.0320658868277428
Energy: 1.0897763945118897
Energy: 1.0914966014058598
Energy: 1.0906839549298686
Energy: 1.0949422627275855
Energy: 1.090446586010124
Energy: 1.0921151425768885
Energy: 1.09596637070714
Energy: 1.0763248290142986
Energy: 1.0744740397050967
Energy: 1.1270769156902136
Energy: 1.1020262491951853
Energy: 1.1309280031727422
Energy: 1.408069576567579
Energy: 1.1459612196660625
Energy: 1.1114415458990679
Energy: 1.0681062704221416
Energy: 1.130178972451254
Energy: 1.10128895203582
Energy: 1.0963515435627598
Energy: 1.0983024276787139
Energy: 1.1320821467269004
Energy: 1.1346649462644323
Energy: 1.1091918953594424
Energy: 1.1222970695185028
Energy: 1.0931331754826454
Energy: 1.0657128913382778
Energy: 1.066387201750724
Energy: 1.152181499949198
Energy: 1.0752751819929367
Energy: 1.079298704659943
Energy: 1.1697583530612747
Energy: 1.1093520712427896
Energy: 1.1029611315426586
Energy: 1.1705970163696997
Energy: 1.0645692251544767
Energy: 1.1621020166786056
Energy: 1.1844202506972297
Energy: 1.0975753782720952
Energy: 1.0966924581974469
Energy: 1.1368848760122239
Energy: 1.093838032493177
Energy: 1.096985562142256
Energy: 1.1128745787250773
Energy: 1.0941083848487496
Energy: 1.0938107377835773
Energy: 1.0500248938597139
Energy: 1.0944270679824133
Energy: 1.0939904553671986
Energy: 1.1585465286376984
Energy: 1.0986470689605228
Energy: 1.0944988285137063
Energy: 1.1238379774927323
Energy: 1.0955511067556742
Energy: 1.0930778918401136
Energy: 1.159577655370013
Energy: 1.1078107570501081
Energy: 1.1397589358222273
Energy: 1.057121333305741
Energy: 1.1044448447315185
Energy: 1.0995858959788913
Energy: 1.1882281434645743
Energy: 1.1347845004241093
Energy: 1.0981876940665523
Energy: 1.1386807970742023
Energy: 1.1519680438059892
Energy: 1.1014802341855254
Energy: 1.280100458305579
Energy: 1.0691365904344012
Energy: 1.0693164212632351
Energy: 1.280522179493891
Energy: 1.0690388435083762
Energy: 1.0819910324716437
Energy: 1.1626495417921756
Energy: 1.1119701347399955
Energy: 1.1222775530292983
Energy: 1.1082107177245029
Energy: 1.116671881525183
Energy: 1.114882434224089
Energy: 1.252480812924545
Energy: 1.1096365883488717
Energy: 1.1087924539399632
Energy: 1.070119901005653
Energy: 1.1357862152567242
Energy: 1.0642952021027983
Energy: 1.2069448981080682
Energy: 1.0953447882618206
Energy: 1.0966798669006617
Energy: 1.0538956750231234
Energy: 1.0956458851684399
Energy: 1.0653389989177728
Energy: 1.1228890112447893
Energy: 1.114544457575123
Energy: 1.1146409000259572
Energy: 1.1309441880549127
Energy: 1.1148144420417698
Energy: 1.1265043488032174
Energy: 1.1099596650616177
Energy: 1.1170063175201383
Energy: 1.1136850266168736
Energy: 1.1130299106301194
Energy: 1.1110790331160578
Energy: 1.11230726781245
Energy: 1.1111901405643936
Energy: 1.112333862760104
Energy: 1.1249384606708968
Energy: 1.1135885765476468
Energy: 1.124806542100013
Energy: 1.1249638023279065
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Energy: 1.0691564822548436
Energy: 1.0669916153989403
Energy: 1.117461302186249
Energy: 1.0691308032471614
Energy: 1.1269395403001559
Energy: 1.0859196458459184
Energy: 1.122975041507237
Energy: 1.1310355967505825
Energy: 1.1623889265070613
Energy: 1.1334286732154983
Energy: 1.1251440023962302
Energy: 1.2491000662925946
Energy: 1.1925380773980638
Energy: 1.0628645314967782
Energy: 1.032165473750685
Energy: 1.1465650596835364
Energy: 1.0334540361497888
Energy: 1.0256650524727948
Energy: 1.1310169251466384
Energy: 1.06183646981576
Energy: 1.0313091527041958
Energy: 1.1521616317453616
Energy: 1.0325271525080888
Energy: 1.0864029101906951
Energy: 1.136609091754534
Energy: 1.1257894975858094
Energy: 1.1539408346798212
Energy: 1.132974420541401
Energy: 1.1253426564464766
Energy: 1.0998413297887404
Energy: 1.0725861911383214
Energy: 1.0704284404558417
Energy: 1.1003718498938888
Energy: 1.0735394169016141
Energy: 1.1053072016714716
Energy: 1.092821708951668
Energy: 1.1139530250393044
Energy: 1.1125593193515784
Energy: 1.094919071034407
Energy: 1.1121155095549167
Energy: 1.1046742935725973
Energy: 1.0931488165090049
Energy: 1.1035287750816967
Energy: 1.1172131026333099
Energy: 1.109369294426042
Energy: 1.1502557966883502
Energy: 1.1167198286544813
Energy: 1.1039968109363112
Energy: 1.1202329138347142
Energy: 1.11653379560957
Energy: 1.1124988583931468
Energy: 1.1219788213128505
Energy: 1.1254245472419808
Energy: 1.257370097914436
Energy: 1.1478386239657017
Energy: 1.145602832336761
Energy: 1.0670434968394318
Energy: 1.1677226549950128
Energy: 1.0677331638145762
Energy: 1.1545232588637881
Energy: 1.1029983772410266
Energy: 1.1293195349665097
Energy: 1.0682183500379678
Energy: 1.1093301386695475
Energy: 1.0967968145130205
Energy: 1.0939800490731142
Energy: 1.0676545817834073
Energy: 1.0654147695935268
Energy: 1.105271113546595
Energy: 1.0893990723974545
Energy: 1.1200518378256752
Energy: 1.1855006425395416
Energy: 1.065587427999988
Energy: 1.0660087425464695
Energy: 1.18588061278515
Energy: 1.0776907993071214
Energy: 1.106368151876498
Energy: 1.1951405376501352
Energy: 1.0986902665850604
Energy: 1.1281542757552383
Energy: 1.161930071895287
Energy: 1.1172452712264915
Energy: 1.1366652067372245
Energy: 1.113821023241059
Energy: 1.0967619096548196
Energy: 1.0935751064387338
Energy: 1.0511119432588314
Energy: 1.099256280460888
Energy: 1.1465907387738035
Energy: 1.1437500825253402
Energy: 1.092413459591245
Energy: 1.0926258625301926
Energy: 1.1497163229910266
Energy: 1.0966384134134544
Energy: 1.091577981247277
Energy: 1.1609074823622874
Energy: 1.0989219326302258
Energy: 1.0989634730485058
Energy: 1.0566091010970067
Energy: 1.098552065160075
Energy: 1.0997034536527834
Energy: 1.2808045487306237
Energy: 1.0968866327864455
Energy: 1.0971891762922488
Energy: 1.1366151397670068
Energy: 1.1479593803896548
Energy: 1.0983185682512702
Energy: 1.273768092860622
Energy: 1.1131868385060795
Energy: 1.0608095022862227
Energy: 1.1838456070815127
Energy: 1.0741953188181947
Energy: 1.1420814568613356
Energy: 1.2927902950948609
Energy: 1.067948193825022
Energy: 1.0675804829959927
Energy: 1.2626612086830848
Energy: 1.0785374658052758
Energy: 1.1029205771405879
Energy: 1.164701052473179
Energy: 1.0998259680823874
Energy: 1.0964218212346692
Energy: 1.121718546068625
Energy: 1.1411198192101581
Energy: 1.0967961101426542
Energy: 1.4639988851600574
Energy: 1.047624271055781
Energy: 1.1131093542114516
Energy: 1.1042966290897376
Energy: 1.044764575907046
Energy: 1.1138205518014348
Energy: 1.1079534449046393
Energy: 1.042412118140997
Energy: 1.1132355252025965
Energy: 1.1165211551289618
Energy: 1.038188908531582
Energy: 1.1158193023099399
Energy: 1.1079276601480237
Energy: 1.1192689710391297
Energy: 1.1159831752175802
Energy: 1.1131743313973586
Energy: 1.114784117548355
Energy: 1.110912139052373
Energy: 1.1162733692652074
Energy: 1.0592325021330729
Energy: 1.1304548324189225
Energy: 1.1213211976096567
Energy: 1.1180895262798676
Energy: 1.05969507908527
Energy: 1.1098166237503964
Energy: 1.0659145376927066
Energy: 1.0391997402833228
Energy: 1.0504516775665866
Energy: 1.0661052907192528
Energy: 1.0329346624923361
Energy: 1.096855056704851
Energy: 1.0675815830421023
Energy: 1.067204177157035
Energy: 1.0417966868601678
Energy: 1.0666055377165726
Energy: 1.033613981311867
Energy: 1.0745698290782426
Energy: 1.0713297690816952
Energy: 1.0593011489702948
Energy: 1.0588787448220167
Energy: 1.0708679849394833
Energy: 1.0585960039760516

minimum gb energy = 1.0256650524727948 eV
minimum distance =  2.28561441549486 Angstroms
sigma value = 81


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

Energy: 1.8132383585345215
Energy: 1.0811249002364096
Energy: 1.0348496758385888
Energy: 1.0351257244935583
Energy: 1.0811152919227436
Energy: 1.0350537528848265
Energy: 1.030303492088578
Energy: 1.0486331182554385
Energy: 1.0522099180937798
Energy: 1.0369766483168577
Energy: 1.0065358490441894
Energy: 1.0517651487981614
Energy: 1.0410673685695215
Energy: 1.047289006744292
Energy: 1.0469953100774918
Energy: 1.066471837475219
Energy: 1.032570808958443
Energy: 1.0748214821551707
Energy: 1.0340732450505334
Energy: 1.0455322037791006
Energy: 1.0658909393888363
Energy: 1.0325232865101466
Energy: 1.0329993089400882
Energy: 1.0670019856796047
Energy: 1.0353504132809364
Energy: 1.0523374878792882
Energy: 1.0516239211812417
Energy: 1.0351600714407205
Energy: 1.0510179582543222
Energy: 1.052391543187085
Energy: 1.0310019798407057
Energy: 1.0522727071189315
Energy: 1.0534131857369395
Energy: 1.05534450352264
Energy: 1.0498727435039505
Energy: 1.0540843507356625
Energy: 1.0174136247430121
Energy: 1.0609449366632124
Energy: 1.0601331766633226
Energy: 1.0793320113694067
Energy: 1.0678510569442214
Energy: 1.05011643604947
Energy: 1.1666578752705428
Energy: 1.1927489322599312
Energy: 1.0941724310814
Energy: 0.9936932680008493
Energy: 1.1309945124694174
Energy: 1.0629004531314177
Energy: 1.019251146524255
Energy: 1.0515555507209537
Energy: 1.0331277127959235
Energy: 1.0371708058324036
Energy: 1.0055728888196618
Energy: 1.0012839444419346
Energy: 1.0718973097641606
Energy: 0.9768129583823704
Energy: 0.9751624594111571
Energy: 1.0726260498217808
Energy: 0.9755340681296062
Energy: 0.9760864132644989
Energy: 1.0253925171063443
Energy: 0.9692321301187766
Energy: 0.9703145133543076
Energy: 1.0298280585924524
Energy: 1.0024886402266955
Energy: 1.0309899486168017
Energy: 1.021164743596287
Energy: 1.0371836376534358
Energy: 1.036145969772699
Energy: 1.0298014335731682
Energy: 1.0478371833254945
Energy: 1.0068191574695184
Energy: 1.020788611450832
Energy: 1.0775134390173087
Energy: 1.036088561492796
Energy: 1.0493710013572377
Energy: 1.0479759533172746
Energy: 1.0450691766194458
Energy: 1.052247221648239
Energy: 1.0532119697945928
Energy: 1.0555221471421505
Energy: 1.0610621865514258
Energy: 1.0517661393627464
Energy: 1.053028341475155
Energy: 1.1870041063799812
Energy: 1.1032847945157072
Energy: 1.0876841758687175
Energy: 1.060060085335893
Energy: 1.062371504087035
Energy: 1.0626412736647972
Energy: 1.0512006089455428
Energy: 1.053227308493684
Energy: 1.0541375348975877
Energy: 1.05221442956154
Energy: 1.0538141011213704
Energy: 1.0565741151325014
Energy: 1.1750232625110617
Energy: 1.0174928239449939
Energy: 1.0127266702308741
Energy: 1.1750887902216476
Energy: 0.9936418136770534
Energy: 1.055313661807347
Energy: 1.0205066897221509
Energy: 1.0542535779944875
Energy: 1.0539435195261917
Energy: 1.0081835618591661
Energy: 1.0269556326914495
Energy: 1.0535235006609618
Energy: 1.1378673229490501
Energy: 1.0183687564632038
Energy: 0.9716326488259533
Energy: 0.9691992279549189
Energy: 1.0447723022642597
Energy: 0.9730626537984038
Energy: 1.226054064127053
Energy: 1.018842509565482
Energy: 0.9727687882337699
Energy: 0.9746509846291458
Energy: 1.049661132073788
Energy: 0.9728330871044136
Energy: 1.0207968362154183
Energy: 1.0234344819772214
Energy: 1.0538420163458788
Energy: 1.0080516051180404
Energy: 1.0258918954319747
Energy: 1.05582495873655
Energy: 1.0485998087887671
Energy: 1.0248471144627982
Energy: 1.072649491369933
Energy: 1.051247860568512
Energy: 1.0247314025763363
Energy: 1.0745880749847074
Energy: 1.0447124049360337
Energy: 1.0703208720624935
Energy: 1.068242199820683
Energy: 1.0467755660590552
Energy: 1.0146667980920965
Energy: 1.0534179553659961
Energy: 1.0591547858314245
Energy: 1.0613995271602048
Energy: 1.0616058176631364
Energy: 1.0608184336722233
Energy: 1.0614113090945703
Energy: 1.0617578954616784
Energy: 1.0520216033055556
Energy: 1.0542310598048743
Energy: 1.0549456463245923
Energy: 1.0543824574774947
Energy: 1.0730982068306745
Energy: 1.054235585120036
Energy: 1.1670010645609334
Energy: 1.104038995501853
Energy: 1.0867701135096555
Energy: 0.9939425877159681
Energy: 1.1251622734326707
Energy: 1.0861983941039233
Energy: 1.1660371363282231
Energy: 1.085450295922619
Energy: 1.0969092004390784
Energy: 0.9945211017657808
Energy: 1.0885406948691554
Energy: 1.086373221826011
Energy: 1.0231835803725697
Energy: 0.970028356292107
Energy: 1.0304894396277438
Energy: 1.0389538750691945
Energy: 1.0045449876987174
Energy: 1.0318520524381607
Energy: 1.025031483704509
Energy: 0.9780699148780646
Energy: 0.9779605144962865
Energy: 1.0301648804433425
Energy: 0.9754373144602027
Energy: 0.9782378226995531
Energy: 1.0213402375799023
Energy: 1.0482900155486312
Energy: 1.0370403822721614
Energy: 1.033989673184441
Energy: 1.0057586909378
Energy: 1.0210839858722673
Energy: 1.0212668004716894
Energy: 1.0527910608687117
Energy: 1.0341129025553595
Energy: 1.045723241797789
Energy: 1.0628284215760764
Energy: 1.0458647969391361
Energy: 1.0217372924442756
Energy: 1.0025396788895673
Energy: 1.001761076224774
Energy: 1.0349506064817124
Energy: 1.037220042481106
Energy: 1.0374324909427786
Energy: 1.1699055560527825
Energy: 1.050013039442107
Energy: 1.0515673440629412
Energy: 1.0596619102016913
Energy: 1.0427356417206557
Energy: 1.053279752958091
Energy: 1.1699085158779967
Energy: 1.0562161908581362
Energy: 1.0562143733435327
Energy: 1.0633758163085874
Energy: 1.0532310784941836
Energy: 1.055975649482711
Energy: 1.0396277814253392
Energy: 1.0522198449536733
Energy: 1.0548546551604225
Energy: 1.0681513226237787
Energy: 0.9944895307658481
Energy: 1.06510330027735
Energy: 1.1638257690509273
Energy: 1.0102958571391294
Energy: 1.0103461852220823
Energy: 1.1637395086258702
Energy: 0.9942491857247557
Energy: 1.1287279047408016
Energy: 1.0307403164447484
Energy: 1.0477658804735321
Energy: 1.0495170190976746
Energy: 1.0368825109563538
Energy: 1.0074599180790142
Energy: 1.0584008033180032
Energy: 1.15882051997379
Energy: 1.0925438938696377
Energy: 1.0358888043543133
Energy: 0.9975614058194523
Energy: 1.092833395344249
Energy: 1.0383680289736694

minimum gb energy = 0.9691992279549189 eV
minimum distance =  2.30054783414882 Angstroms
sigma value = 43


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

Energy: 1.7596380221615777
Energy: 1.159613546023387
Energy: 1.1157070915694514
Energy: 1.057884303853481
Energy: 1.2443674049627949
Energy: 1.048972702130909
Energy: 1.0120622281530784
Energy: 1.0187129958375372
Energy: 1.0293208591312164
Energy: 1.0524278798928872
Energy: 1.0065412927745634
Energy: 1.0234567273723727
Energy: 1.024877137635985
Energy: 0.9955848269526992
Energy: 0.9944488420899618
Energy: 1.0524302555325136
Energy: 0.9974486516940361
Energy: 1.0137916594384415
Energy: 1.0125501104796975
Energy: 0.99576542637516
Energy: 1.0125694515253474
Energy: 1.0127969985493674
Energy: 0.9936529040453594
Energy: 1.013839732069169
Energy: 1.0127031335457368
Energy: 1.0448935496240053
Energy: 1.04832598752218
Energy: 1.0127678794701278
Energy: 1.0458980312463846
Energy: 1.0462210268745409
Energy: 1.0137657379613536
Energy: 1.0502525174978483
Energy: 1.0504378955911762
Energy: 1.0510826923573362
Energy: 1.0316103546745325
Energy: 1.045641876078582
Energy: 1.0127943165078392
Energy: 1.0126671188842977
Energy: 1.0125730009631644
Energy: 1.0130549686560903
Energy: 1.0137996618206022
Energy: 1.0235046771285408
Energy: 1.1452727042278437
Energy: 1.0158520860848599
Energy: 1.014420828392606
Energy: 1.000625295178835
Energy: 1.0163453583753976
Energy: 1.0624437967664733
Energy: 1.0068699240400587
Energy: 1.0136790656498291
Energy: 1.013672149719024
Energy: 1.0068944663327513
Energy: 1.0133133832722834
Energy: 1.0233168701364381
Energy: 1.233530270690486
Energy: 1.0147408361187331
Energy: 1.0146971726868408
Energy: 1.0996429621773547
Energy: 1.0149126725141953
Energy: 1.0147574755263347
Energy: 0.9997611184633617
Energy: 1.0347254093957259
Energy: 1.0379360545029979
Energy: 1.0069094522543554
Energy: 1.0244207107801737
Energy: 1.0121590817394481
Energy: 1.0206911303729058
Energy: 1.013297444823196
Energy: 1.013086397136633
Energy: 1.0354239470489073
Energy: 1.0135620080171674
Energy: 1.0129959462911724
Energy: 1.1818856625933245
Energy: 1.0151326757249142
Energy: 1.0318685511697072
Energy: 0.9969877126447042
Energy: 1.0159849406238508
Energy: 1.0323547540841134
Energy: 0.9999273176276818
Energy: 1.0176362322914225
Energy: 1.0164407299994842
Energy: 1.0068806341423242
Energy: 1.0127265578892801
Energy: 1.030984690991253
Energy: 1.0019776769179054
Energy: 1.027387414030691
Energy: 1.0137526842635032
Energy: 1.0118065255593698
Energy: 0.9937390320433642
Energy: 1.013730895033229
Energy: 1.0002557482229548
Energy: 1.0455806842516777
Energy: 1.0118506197289099
Energy: 0.9996386260434266
Energy: 1.047188116652379
Energy: 0.9998505865188463
Energy: 1.0013703425805258
Energy: 1.0022688392583274
Energy: 1.0020470367605872
Energy: 1.0017362478867697
Energy: 1.0016364485748595
Energy: 1.0011987861254623
Energy: 1.0004517137323132
Energy: 1.0123916398700645
Energy: 1.0205953884982664
Energy: 1.020691487681073
Energy: 1.0177541068951754
Energy: 1.020795906401757
Energy: 1.0083869721461658
Energy: 0.9998873778447486
Energy: 1.020891193357322
Energy: 1.0243877679342808
Energy: 1.0006840581166576
Energy: 1.0136409175421908
Energy: 1.1289205011410979
Energy: 0.9995073875746748
Energy: 1.0207847391705598
Energy: 1.0138911571825657
Energy: 1.0024547130669081
Energy: 1.0136181980204941
Energy: 1.000561122281483
Energy: 1.0168042794776018
Energy: 1.0028152215751187
Energy: 1.0166107539036087
Energy: 1.0263326806036384
Energy: 1.001606347380791
Energy: 1.1484246293906344
Energy: 1.031260718175454
Energy: 1.0824643973526749
Energy: 1.1484360600696881
Energy: 0.9944436792942821
Energy: 1.1464395955660598
Energy: 1.0366896793141662
Energy: 1.0148498019513552
Energy: 1.016542820525319
Energy: 1.0168734770256433
Energy: 1.0238851700866574
Energy: 1.0332877405994112
Energy: 1.1194431961463671
Energy: 1.0019537597875396
Energy: 1.0217783589893366
Energy: 1.0029358403092286
Energy: 1.1918397921021713
Energy: 1.0220555209563833
Energy: 1.036567124113568
Energy: 1.0005635929825483
Energy: 1.0016237741321286
Energy: 1.0166011553450989
Energy: 0.9995972739100135
Energy: 1.021118984026235
Energy: 1.076293942516588
Energy: 1.0165541017695907
Energy: 1.0135936443732705
Energy: 1.0123315922539784
Energy: 0.9993887226539533
Energy: 1.0201863477506787
Energy: 1.076308093191907
Energy: 1.0116396308506592
Energy: 1.011841669586081
Energy: 1.063295568665425
Energy: 1.0161051398128174
Energy: 1.0126831122965116
Energy: 1.0553492519348702
Energy: 1.0178829593877512
Energy: 1.018468489471954
Energy: 1.0129616954803697
Energy: 1.0242957784551088
Energy: 1.0231676770807774
Energy: 1.0456072665883065
Energy: 1.014898320058012
Energy: 1.0149006069483257
Energy: 1.04415131582971
Energy: 0.9995349208039264
Energy: 1.0140870788483012
Energy: 1.0125569304177133
Energy: 1.0051127306225505
Energy: 1.0193850370031425
Energy: 1.0534864943965445
Energy: 1.0125291870058943
Energy: 1.0240546473047176
Energy: 0.9958586916402143
Energy: 1.0794841106269226
Energy: 1.0552580873888673
Energy: 1.0301972323574708
Energy: 1.1096006015843731
Energy: 0.9965639736686542

minimum gb energy = 0.9936529040453594 eV
minimum distance =  2.30755960898392 Angstroms
sigma value = 57


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

Energy: 1.3497639658670577
Energy: 1.032839941645329
Energy: 1.0493484705205596
Energy: 0.9503044249498995
Energy: 1.1258095297995536
Energy: 1.0495024434158087
Energy: 1.0020893075761472
Energy: 1.0036606712189897
Energy: 1.0022778828564265
Energy: 1.0135303025364357
Energy: 1.0142551779264999
Energy: 1.0361225369565852
Energy: 1.0198950029363563
Energy: 0.9562618964275865
Energy: 0.9645651425971229
Energy: 1.0020804082399517
Energy: 0.9736750236545154
Energy: 0.960281682070292
Energy: 1.002159858132859
Energy: 0.9751843443408259
Energy: 0.9760267570264152
Energy: 1.0001616237375386
Energy: 0.9767104949120505
Energy: 1.0014699882082485
Energy: 1.000262964561685
Energy: 1.0034703861862007
Energy: 1.010210556638275
Energy: 1.0009504992979665
Energy: 1.0041372305780796
Energy: 0.9987625528035701
Energy: 0.9501625240161722
Energy: 1.0045779551032823
Energy: 1.0032872941468949
Energy: 1.0061512962174
Energy: 1.0052192126372477
Energy: 0.9863040115908253
Energy: 1.0146223149063247
Energy: 1.0006156090104943
Energy: 1.001136921175696
Energy: 1.0146460370897392
Energy: 1.0012464743879195
Energy: 1.0048706192636319
Energy: 0.9970618370174019
Energy: 1.000225154739558
Energy: 1.0026122168358846
Energy: 0.9793805728844336
Energy: 1.001736442236478
Energy: 1.001269863223233
Energy: 1.0129627828784573
Energy: 1.0030358931993781
Energy: 1.0185102034661615
Energy: 1.0135782426633562
Energy: 1.002360992214799
Energy: 1.0104680369565118
Energy: 1.1947277663603706
Energy: 0.9951867687527668
Energy: 0.9950414944317275
Energy: 1.1255280464275563
Energy: 0.9965333428768883
Energy: 0.9955178140280034
Energy: 1.010860391894409
Energy: 0.9938422954695818
Energy: 1.0189581587782075
Energy: 1.0158832933698472
Energy: 1.0014940314397853
Energy: 1.0163885363519518
Energy: 0.9441739389837324
Energy: 1.0032538819098757
Energy: 1.0035050365360447
Energy: 0.9432015399885844
Energy: 1.0149576117749368
Energy: 1.0457366816702334
Energy: 0.9430705524868337
Energy: 1.0016799739461986
Energy: 1.0495675652125374
Energy: 0.9775105457780224
Energy: 1.0046086380983217
Energy: 1.0462715941692196
Energy: 1.0051980920923125
Energy: 1.0083560054588072
Energy: 1.0342409437048203
Energy: 1.013118833159866
Energy: 1.0140577549746839
Energy: 1.0062441063911944
Energy: 1.0135007813124497
Energy: 0.9451053830239095
Energy: 0.9509346266840569
Energy: 1.010786845527908
Energy: 0.9459491443069196
Energy: 0.9510543412869367
Energy: 1.0011172790395737
Energy: 0.9965845607289362
Energy: 0.9994257777728082
Energy: 1.0017093345097814
Energy: 1.0182011650339478
Energy: 1.0024340193938854
Energy: 1.0031739056665012
Energy: 0.999057203414904
Energy: 1.0154298851782313
Energy: 1.0057124795120136
Energy: 1.0037863327844965
Energy: 0.9953141775982336
Energy: 1.0034915100138968
Energy: 1.0040890239915956
Energy: 1.0026970520385068
Energy: 1.0074206335217417
Energy: 1.0005730631792369
Energy: 0.9962313202726744
Energy: 1.014632189948497
Energy: 1.0020901311348578
Energy: 1.003195661052641
Energy: 1.0182626808364008
Energy: 1.000870343970695
Energy: 1.0168016005038527
Energy: 1.0137615858122015
Energy: 1.017437472895108
Energy: 1.0130861254853571
Energy: 1.0179270493871553
Energy: 1.0029518479206436
Energy: 1.015139963439645
Energy: 1.014266427968053
Energy: 1.0104165541289747
Energy: 1.0247836831808024
Energy: 1.014795843119485
Energy: 1.0292102680955335
Energy: 0.9976485789885415
Energy: 1.19400074173264
Energy: 0.9947958899389913
Energy: 0.998637973706151
Energy: 1.0281411980797184
Energy: 0.9944678844929974
Energy: 1.0030694331395513
Energy: 1.0048322745888822
Energy: 1.008202497897962
Energy: 1.0086828655501197
Energy: 1.0135414056870193
Energy: 1.0138236209941391
Energy: 1.002401549661647
Energy: 0.9430685132115713
Energy: 1.016364395005822
Energy: 1.0497214913755053
Energy: 1.0454587276732075
Energy: 1.0057317107876629
Energy: 1.0462074583870828

minimum gb energy = 0.9430685132115713 eV
minimum distance =  2.2867418825059 Angstroms
sigma value = 17


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

Energy: 1.2357062600651614
Energy: 1.0164456489783888
Energy: 1.0991258037701106
Energy: 0.9790809728908013
Energy: 1.0155225357104116
Energy: 1.0143944034829586
Energy: 0.9910202264405149
Energy: 1.0305757643017877
Energy: 1.0431602348182694
Energy: 1.057282399109428
Energy: 1.029673888062269
Energy: 0.9826498669096273
Energy: 1.2569240994600823
Energy: 0.9577863439458298
Energy: 0.9584439775834789
Energy: 1.0280876511102797
Energy: 0.9583273509953323
Energy: 0.9441475553583796
Energy: 1.0344850856703578
Energy: 0.944384512435894
Energy: 0.9441865548000177
Energy: 1.0275355355357643
Energy: 0.9441740654161264
Energy: 1.0289029434020538
Energy: 0.9145486939211485
Energy: 0.9430418460640748
Energy: 0.9565635848012977
Energy: 0.9150677882488074
Energy: 0.9422431342323223
Energy: 0.9558964540100912
Energy: 0.9291074588317872
Energy: 0.9423181654842141
Energy: 0.9551102680531371
Energy: 0.937757996029036
Energy: 0.9019645562456641
Energy: 0.9382111169894708
Energy: 0.9016969568985208
Energy: 0.9008021642183364
Energy: 0.900635760206014
Energy: 0.9018713667026635
Energy: 0.9018991918803523
Energy: 0.9226058983723397
Energy: 0.9022980992305654
Energy: 0.9451518075635403
Energy: 0.9458764999232955
Energy: 0.9436031082301187
Energy: 0.9440621642516822
Energy: 0.9638627966441944
Energy: 0.9043110833290254
Energy: 0.9441954836731415
Energy: 0.9427691732210763
Energy: 0.9021111763738818
Energy: 0.9428485168484274
Energy: 0.9016236378209134
Energy: 0.9007202489172482
Energy: 0.9547934672102765
Energy: 0.9549687456682263
Energy: 0.9012613258982395
Energy: 0.9598012375991066
Energy: 0.9425061978910946
Energy: 0.9021113959767368
Energy: 0.9684869002831616
Energy: 0.9561969582146265
Energy: 0.9419022686622804
Energy: 1.027751056247733
Energy: 0.9427115196369756
Energy: 1.025445184142466
Energy: 1.0274343146462808
Energy: 1.0273462120301975
Energy: 1.0263096463932888
Energy: 1.0291344411882202
Energy: 1.0280284681367498
Energy: 1.0260591301213322
Energy: 1.043830160576208
Energy: 1.0434229874729353
Energy: 0.9566857335802715
Energy: 1.0300540009957937
Energy: 1.043090929756835
Energy: 1.0437852233124922
Energy: 1.028789185263555
Energy: 1.0295578527661966
Energy: 1.0574201330408912
Energy: 1.0299933771423908
Energy: 0.9809480903854005
Energy: 1.03511178090566
Energy: 1.0396098040067145
Energy: 1.0439273834664118
Energy: 1.015698153719873
Energy: 1.0399128255378145
Energy: 1.0470562524586982
Energy: 1.159665214043618
Energy: 1.0576250194209074
Energy: 1.004262124047002
Energy: 1.0290830786858443
Energy: 1.057524920821791
Energy: 1.0280389430153696
Energy: 1.0122626946869537
Energy: 1.0437094812822965
Energy: 1.124741587423164
Energy: 0.9287721212682848
Energy: 1.030268449059771
Energy: 1.1243613924333906

minimum gb energy = 0.900635760206014 eV
minimum distance =  2.30624716892629 Angstroms
sigma value = 17


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

Energy: 1.6547154690216297
Energy: 1.0244129047292914
Energy: 0.979672269557034
Energy: 0.9211127892704805
Energy: 1.4038667406408496
Energy: 0.9735157344006226
Energy: 1.1016321585782753
Energy: 1.0123263503252533
Energy: 0.9091191016310861
Energy: 1.0088677249373552
Energy: 1.0118375514742655
Energy: 0.9582236166425523
Energy: 1.2010348209876298
Energy: 0.884776862201946
Energy: 0.9224020754522223
Energy: 1.009578001882063
Energy: 0.8854554948759521
Energy: 0.9258754520135685
Energy: 1.0150604149844813
Energy: 0.9220924008144169
Energy: 0.9251257987476762
Energy: 1.0164319925550422
Energy: 0.8946626265959308
Energy: 0.9193315662838447
Energy: 0.8886088339139815
Energy: 0.9061847013345127
Energy: 0.9121492506595934
Energy: 0.8895046785878712
Energy: 0.9078806804756333
Energy: 0.9062880926731387
Energy: 0.9379961345527652
Energy: 0.8757354024518467
Energy: 0.8834559831153549
Energy: 0.8859132809922738
Energy: 0.8762551502875209
Energy: 0.8844988572268065
Energy: 0.8156928627315135
Energy: 0.8756636693679033
Energy: 0.8756844036386893
Energy: 0.8471427391826123
Energy: 0.8790354691443164
Energy: 0.8756608894741436
Energy: 0.8192484269861751
Energy: 0.863362098667829
Energy: 0.8731370010912376
Energy: 0.8796488461585399
Energy: 0.8626932388109078
Energy: 0.8733409974362162
Energy: 0.8180207278878114
Energy: 0.8730298837960072
Energy: 0.8168842023965581
Energy: 0.8196177411804709
Energy: 0.8469712223225596
Energy: 0.8173406353208128
Energy: 0.817676354059103
Energy: 0.8668154278828495
Energy: 0.8679965776818082
Energy: 0.8173781188701663
Energy: 0.8661043784273836
Energy: 0.8675842884813212
Energy: 0.8370242858875465
Energy: 0.8168277211983989
Energy: 0.8659361962489286
Energy: 0.8657107439133829
Energy: 0.8175568127898543
Energy: 0.8660912826552771
Energy: 0.8199182557156771
Energy: 0.8175830872215417
Energy: 0.8175522221515662
Energy: 0.8224017051389454
Energy: 0.822951490697351
Energy: 0.854757654381643
Energy: 0.8762647548812367
Energy: 0.8747746253215872
Energy: 0.8736096861198067
Energy: 0.8725225825081316
Energy: 0.856874186623908
Energy: 0.8728563018087921
Energy: 0.8770200771959549
Energy: 0.8805522040330612
Energy: 0.8802924028550058
Energy: 0.876421279044438
Energy: 0.87501259351865
Energy: 0.8758240792034476
Energy: 0.8757202070873762
Energy: 0.8798934420211915
Energy: 0.8800896849378057
Energy: 0.875699172126986
Energy: 0.874472972927111
Energy: 0.9103096556028765
Energy: 1.0087981051335175
Energy: 0.9103550311398808
Energy: 0.9068377407649576
Energy: 0.9045649737125727
Energy: 0.8907062838673785
Energy: 0.90738315524875
Energy: 0.8175727327066203
Energy: 1.0107574074468266
Energy: 1.0107317670103435
Energy: 0.8173291165551478
Energy: 1.010480817943015
Energy: 0.8746043685844963
Energy: 0.8914487516136327
Energy: 1.0086910222140368
Energy: 1.0118077661177807
Energy: 0.8914483777519606
Energy: 1.0096118929464373
Energy: 0.9053185211199237
Energy: 1.1181497308144033
Energy: 1.009496441742323
Energy: 0.9593563360887505
Energy: 1.0108220821422236
Energy: 0.9181973116493004
Energy: 0.9128022814964222
Energy: 1.2075011598975487
Energy: 0.9215989386781798
Energy: 0.9101566850972209
Energy: 1.010676907632952
Energy: 0.8815286700339308
Energy: 1.0225162743815526
Energy: 1.1978603795773868
Energy: 1.0107001299678016
Energy: 1.0127823886908325
Energy: 1.0106982554506287
Energy: 1.0099649222453744
Energy: 1.0127835134293697
Energy: 0.8307010876197011
Energy: 1.0260584603435259
Energy: 1.097771990255935
Energy: 0.9231835761899537
Energy: 1.0171314999238645
Energy: 0.925259107386369
Energy: 0.8349766344492272
Energy: 1.01589404685785
Energy: 1.0146383242363286
Energy: 0.8371676541473951
Energy: 1.0107867272597202
Energy: 1.0970015315104582
Energy: 1.2031935363192436
Energy: 0.9229978736513789
Energy: 1.0112061531405714
Energy: 1.0126325331873611
Energy: 0.8296631958068067
Energy: 1.0086894776886928
Energy: 1.0101645001758859
Energy: 0.8863140491860079
Energy: 0.9302447336880111
Energy: 1.0101767234698937
Energy: 0.8867622372491583
Energy: 0.9262024860346267
Energy: 0.892995781894371
Energy: 0.907366627116849
Energy: 0.910651910143674
Energy: 0.8934985120819423
Energy: 0.9111795681878548
Energy: 0.9093272375351814
Energy: 0.9350313378388558
Energy: 0.9143758350139575
Energy: 0.9171534233704252
Energy: 0.8846518117352873
Energy: 0.913246041525577
Energy: 0.8848259245172064
Energy: 0.8030553854993183
Energy: 0.876221266056464
Energy: 0.8759755551245342
Energy: 0.8054740180797397
Energy: 0.8786693276828911
Energy: 0.8760316382798323
Energy: 0.8169044217055149
Energy: 0.8761358667595011
Energy: 0.8757574757068362
Energy: 0.8790754331895625
Energy: 0.8750392516421805
Energy: 0.8753486578906675
Energy: 0.8180596256276984
Energy: 0.8619300612606642
Energy: 0.8725696375090467
Energy: 0.8178778520413634
Energy: 0.8621411081867141
Energy: 0.8721494684718455
Energy: 0.8227005995750898
Energy: 0.8706788848529629
Energy: 0.8684347071167311
Energy: 0.8242892907651572
Energy: 0.8699727209209444
Energy: 0.8492047726184002
Energy: 0.8188589574842009
Energy: 0.8703583700192518
Energy: 0.8693569461505527
Energy: 0.8771376697029684
Energy: 0.8676533303788845
Energy: 0.8690786715942073
Energy: 0.8294808341799598
Energy: 0.8179662158290915
Energy: 0.8177716190702841
Energy: 0.8299293607450615
Energy: 0.8182970568269532
Energy: 0.8175546039926121
Energy: 0.898744789747749
Energy: 0.8831212576444757
Energy: 0.8783694608061362
Energy: 0.8793421123634388
Energy: 0.8526209792317936
Energy: 0.8781447076294812
Energy: 0.883767722274838
Energy: 0.8761173330006522
Energy: 0.8769179468836888
Energy: 0.8758925334702955
Energy: 0.8765145777747081
Energy: 0.8790644227753969
Energy: 0.8764315235521007
Energy: 0.8738607262088158
Energy: 0.9066390143316083
Energy: 0.8766028846518877
Energy: 0.8740293580842405
Energy: 0.9067389035381296
Energy: 1.1214214348600402
Energy: 0.9048789177591541
Energy: 0.9047706871629663
Energy: 0.9128149558328003
Energy: 0.9188529119415572
Energy: 0.9100379547812517
Energy: 0.815991215486066
Energy: 1.0096317684037346
Energy: 1.0098229215895176
Energy: 0.8898282138440644
Energy: 1.0122000850139252
Energy: 0.9071755588378874
Energy: 0.8827355453696624
Energy: 1.0257059123966379
Energy: 0.9139313895008029
Energy: 0.9071176141796014
Energy: 1.020226672355457
Energy: 0.9185006828863971
Energy: 0.8750632497860991
Energy: 1.0092814497567668
Energy: 1.009412632691544
Energy: 0.8916581225842191
Energy: 1.0141343289426958
Energy: 0.9497682329756605
Energy: 1.1276724917856087
Energy: 0.9115471396677037
Energy: 1.014048351085217
Energy: 1.0191080753640762
Energy: 0.9114803478882547
Energy: 1.0092674108052284
Energy: 1.2014663761148645
Energy: 0.9496338027213035
Energy: 0.9078709448004151
Energy: 1.0129385209979982
Energy: 0.8895449362548119
Energy: 1.0147608023537489
Energy: 0.8371656676434552
Energy: 1.0155950894870742
Energy: 1.0143454937721137
Energy: 0.8385008001022992
Energy: 1.0111049213428351
Energy: 0.9956044086725101

minimum gb energy = 0.8030553854993183 eV
minimum distance =  2.27878776356046 Angstroms
sigma value = 57


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

Energy: 0.9931787707732362
Energy: 1.3114791318267256
Energy: 0.931225212048617
Energy: 0.8454544150402489
Energy: 1.3104138630772477
Energy: 0.9340322094098387
Energy: 1.05598215278095
Energy: 0.8825938309834157
Energy: 0.8678278574500571
Energy: 0.9847313343900678
Energy: 0.9782447798793793
Energy: 0.9222668474383671
Energy: 1.13870992638176
Energy: 0.8413644822856337
Energy: 0.8422427050669173
Energy: 0.9860404453587239
Energy: 0.8398112280875781
Energy: 0.8933801373516486
Energy: 0.9800552067528245
Energy: 0.8407453948311978
Energy: 0.8921466387031874
Energy: 0.980286863868191
Energy: 0.8408714805571217
Energy: 0.8975042443065109
Energy: 0.8430924945205429
Energy: 0.8734806175246046
Energy: 0.8681922040568177
Energy: 0.8436813879668277
Energy: 0.8558009884201756
Energy: 0.8742172012042013
Energy: 0.8325480998479976
Energy: 0.8533635703526175
Energy: 0.8397047552328991
Energy: 0.8144034801224839
Energy: 0.8537558115187732
Energy: 0.8400682769314005
Energy: 0.7833590732271224
Energy: 0.8614657507421009
Energy: 0.8530731943467253
Energy: 0.835491079647803
Energy: 0.8603386715399157
Energy: 0.8270685278975227
Energy: 0.784770724623035
Energy: 0.8064786313976228
Energy: 0.8071644501305558
Energy: 0.819703511174858
Energy: 0.8062628930480752
Energy: 0.8235409367052612
Energy: 0.7881882690712104
Energy: 0.8127575141962506
Energy: 0.7842509651176895
Energy: 0.7903180007640733
Energy: 0.7914285811305967
Energy: 0.7844603640985726
Energy: 0.7842666150874897
Energy: 0.8110675410440182
Energy: 0.811218652096661
Energy: 0.7843430226445454
Energy: 0.8262149833051422
Energy: 0.8122481510771141
Energy: 0.760708806354651
Energy: 0.7526019441430145
Energy: 0.8156738212014032
Energy: 0.8042090937786639
Energy: 0.7537858712065143
Energy: 0.8018408062362338
Energy: 0.7889192812204163
Energy: 0.7625312431098478
Energy: 0.7527835109526789
Energy: 0.7958053335319685
Energy: 0.7595082371291946
Energy: 0.7888587407164444
Energy: 0.7518983505947194
Energy: 0.8251852476693831
Energy: 0.8256260332622158
Energy: 0.8077341913110629
Energy: 0.8073007365827637
Energy: 0.8068979145377106
Energy: 0.7536513383468164
Energy: 0.8044743895933231
Energy: 0.7527863794923007
Energy: 0.7557112870059809
Energy: 0.795181770373699
Energy: 0.753554130279994
Energy: 0.7532447461769999
Energy: 0.8078716283511129
Energy: 0.8026853959901074
Energy: 0.7530670321612042
Energy: 0.8310646488875278
Energy: 0.8023030221550529
Energy: 0.8036560129727862
Energy: 0.7842864157908906
Energy: 0.8105710801594459
Energy: 0.8088946818922225
Energy: 0.7962139590741099
Energy: 0.808521201147543
Energy: 0.8004650772680283
Energy: 0.784903840645291
Energy: 0.7844083568354205
Energy: 0.8074929951290862
Energy: 0.7934441582241936
Energy: 0.8136172607871437
Energy: 0.7574407577238395
Energy: 0.8302400686001394
Energy: 0.8319832260164597
Energy: 0.7994987408769166
Energy: 0.8173258552170822
Energy: 0.8353335607199774
Energy: 0.8535385997728065
Energy: 0.8401585820439383
Energy: 0.8406317621849165
Energy: 0.8556036784852485
Energy: 0.8365307502789904
Energy: 0.8534185828583601
Energy: 0.9650045963279105
Energy: 0.8347772205418581
Energy: 0.8376947039351038
Energy: 0.8926151716573388
Energy: 0.826862512198314
Energy: 0.8685755460022091
Energy: 1.062539463119273
Energy: 0.8777646568231043
Energy: 0.8740164781886239
Energy: 0.8720196969029658
Energy: 0.874447070486005
Energy: 0.8793243013105885
Energy: 0.7534032983251447
Energy: 0.9769900950953768
Energy: 0.853226405844927
Energy: 0.8255097082145613
Energy: 0.990719959754452
Energy: 0.8729624206036123
Energy: 0.7902036026141529
Energy: 0.9851757997736227
Energy: 0.946872331683569
Energy: 0.7939435915475186
Energy: 0.9839710054959688
Energy: 0.9474116119210706
Energy: 1.0605222433235826
Energy: 0.8770501604131664
Energy: 0.8630745718603795
Energy: 0.8726075358559777
Energy: 0.885534534321792
Energy: 0.8694981524524591
Energy: 1.143067551084058
Energy: 0.8652635361714763
Energy: 0.8736215702867935
Energy: 0.9863702761197954
Energy: 0.8647778628847251
Energy: 0.969867757964819
Energy: 1.1356667261881093
Energy: 0.967374316713272
Energy: 0.9597946709958028
Energy: 0.9812102334849091
Energy: 0.983136195142968
Energy: 0.9397567424882352
Energy: 0.7608524542488965
Energy: 0.9794543272825226
Energy: 0.8995355955414075
Energy: 0.8432696163728616
Energy: 0.9954966379570392
Energy: 0.9003442104011664

minimum gb energy = 0.7518983505947194 eV
minimum distance =  2.27972854917889 Angstroms
sigma value = 43


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

Energy: 0.6633083962012637
Energy: 0.8923698218748282
Energy: 0.8351781941736737
Energy: 0.7308612206282059
Energy: 0.8928105849243932
Energy: 0.7987983158184871
Energy: 0.9230413186120044
Energy: 0.7779048146142584
Energy: 0.7538672594295549
Energy: 0.8681237901526251
Energy: 0.7740337565510671
Energy: 0.7509124237581662
Energy: 0.9897281860841558
Energy: 0.712563756978624
Energy: 0.739985532984354
Energy: 0.8681852437284973
Energy: 0.7124298811008033
Energy: 0.73995968836252
Energy: 0.8650447421293818
Energy: 0.7400728875170287
Energy: 0.7395725035341943
Energy: 0.7751177578235169
Energy: 0.7378211591174012
Energy: 0.8084410878175087
Energy: 0.8103804252519845
Energy: 0.7770739924687714
Energy: 0.7601580373622562
Energy: 0.7596906571462222
Energy: 0.7756054628981
Energy: 0.7505992034474411
Energy: 0.6417727362589671
Energy: 0.7719608225076757
Energy: 0.7362674863795835
Energy: 0.6986713927289326
Energy: 0.7717579013988471
Energy: 0.7085006302119545
Energy: 0.9031302369106488
Energy: 0.771589795630074
Energy: 0.7714782258370523
Energy: 0.7196980710948574
Energy: 0.7719453268529726
Energy: 0.7179324640042334
Energy: 0.9000999184137232
Energy: 0.6899838499265996
Energy: 0.7039724699332199
Energy: 0.7133226530134135
Energy: 0.6897001523883136
Energy: 0.7038300234674946
Energy: 0.713880100006595
Energy: 0.7025059096385208
Energy: 0.710926630708728
Energy: 0.7160721552013355
Energy: 0.6567944986162335
Energy: 0.7104890536722589
Energy: 0.7299707318245063
Energy: 0.6940249566888658
Energy: 0.6943913640882177
Energy: 0.7109029192748164
Energy: 0.6937737330333292
Energy: 0.694631853096031
Energy: 0.63651931789749
Energy: 0.6720158513503707
Energy: 0.6959924223030541
Energy: 0.6793430082369031
Energy: 0.6721163021661853
Energy: 0.6862524470445995
Energy: 0.7160518658527109
Energy: 0.6721004665212295
Energy: 0.6718263703983381
Energy: 0.7165373815751105
Energy: 0.6725371199439679
Energy: 0.6996761727780392
Energy: 0.8577999991041788
Energy: 0.7083494111384129
Energy: 0.718700808447478
Energy: 0.7158029866403633
Energy: 0.7076552159824259
Energy: 0.7188910016360996
Energy: 0.6497911862650855
Energy: 0.6823443380762656
Energy: 0.6493240231005257
Energy: 0.6516649934204851
Energy: 0.6385811357140778
Energy: 0.6493783447538326
Energy: 0.6491198263386618
Energy: 0.6771887334192724
Energy: 0.6763471473075369
Energy: 0.6490251143653546
Energy: 0.6782766216105749
Energy: 0.6762503784780067
Energy: 0.6430348475416506
Energy: 0.6389634135706033
Energy: 0.639216009425529
Energy: 0.6913275934112498
Energy: 0.6390630869305297
Energy: 0.6793838433005074
Energy: 0.6538707792478515
Energy: 0.638994514138935
Energy: 0.6387249727265959
Energy: 0.6917939255330923
Energy: 0.6390859572964012
Energy: 0.68122495063241
Energy: 0.6388550167404329
Energy: 0.691286142297053
Energy: 0.6807299653683132
Energy: 0.6393840611452457
Energy: 0.7050169279911714
Energy: 0.6803721049992515
Energy: 0.6390020927473835
Energy: 0.6680579935461238
Energy: 0.6388182766646969
Energy: 0.6407111741156204
Energy: 0.7659625890706728
Energy: 0.6394161009438503
Energy: 0.6390548678850989
Energy: 0.70607341093802
Energy: 0.6879406092288006
Energy: 0.639166874318815
Energy: 0.7050855105398077
Energy: 0.6879062457004791
Energy: 0.67600291520641
Energy: 0.6494260543735171
Energy: 0.6494248963740674
Energy: 0.7057561462923932
Energy: 0.6499821423791141
Energy: 0.6885208219992964
Energy: 0.6442185677425382
Energy: 0.6494065225277087
Energy: 0.6497945705451571
Energy: 0.6823182345347608
Energy: 0.6497710555353177
Energy: 0.6799813567124166
Energy: 0.6717448348207569
Energy: 0.6823261428231335
Energy: 0.6820607082585274
Energy: 0.6716307992853003
Energy: 0.6831553487341157
Energy: 0.6824222317992071
Energy: 0.6724631089267488
Energy: 0.7013777474796369
Energy: 0.6721629310746371
Energy: 0.6746466339416416
Energy: 0.6492838877471699
Energy: 0.6721725122398036
Energy: 0.8752333778112928
Energy: 0.6997248526284664
Energy: 0.7147721987743989
Energy: 0.7131175366721108
Energy: 0.6994681494822911
Energy: 0.7154768605779905
Energy: 0.8132792500932987
Energy: 0.7107779684583262
Energy: 0.7104891142497411
Energy: 0.7146089455230137
Energy: 0.7112438896107225
Energy: 0.6935328521765779
Energy: 0.6397787800640885
Energy: 0.710708261569869
Energy: 0.7228807917985822
Energy: 0.6877421336423305
Energy: 0.7106268992717235
Energy: 0.6967065845888455
Energy: 0.7356599830175656
Energy: 0.7219818090689124
Energy: 0.7214664956055702
Energy: 0.7344109037561642
Energy: 0.7218715984489208
Energy: 0.7175585929664658
Energy: 0.7752715083317381
Energy: 0.722894568687586
Energy: 0.7717813267224256
Energy: 0.7772794696001922
Energy: 0.6857880534160912
Energy: 0.7718503365524939
Energy: 0.9342365960743996
Energy: 0.701888155154814
Energy: 0.7224040810854266
Energy: 0.773093584278962
Energy: 0.7017599232768511
Energy: 0.7222465301001516
Energy: 0.9328001360155416
Energy: 0.7738507711342012
Energy: 0.7740491212052921
Energy: 0.7739216110324894
Energy: 0.7736606062060406
Energy: 0.7779709810984295
Energy: 0.6512717153285706
Energy: 0.8681323921468173
Energy: 0.7620595131679838
Energy: 0.7083126582759551
Energy: 0.8678061458788366
Energy: 0.7284163434033749
Energy: 0.8609302905920134
Energy: 0.8256304589560387
Energy: 0.8271121330960552
Energy: 0.7756319892793105
Energy: 0.8727380441762432
Energy: 0.7997996963671877
Energy: 0.9340264946653714
Energy: 0.7623870389368756
Energy: 0.7587113320827897
Energy: 0.7751967994291561
Energy: 0.7802894318956674
Energy: 0.8368869427630989
Energy: 0.9908957101669451
Energy: 0.7333361984911846
Energy: 0.7789946897092848
Energy: 0.8683426136502507
Energy: 0.7338457821355491
Energy: 0.7791914142668109
Energy: 0.9492097847398447
Energy: 0.8418826119401397
Energy: 0.8012794260963426
Energy: 0.8683322463499921
Energy: 0.8728992817159775
Energy: 0.7513982619899819

minimum gb energy = 0.63651931789749 eV
minimum distance =  2.32991061396544 Angstroms
sigma value = 81


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

Energy: 0.08249681434200272
Energy: 0.08656415182140109
Energy: 0.08330581495740531
Energy: 0.08539545313395726
Energy: 0.08521011348884037
Energy: 0.08348998813967605
Energy: 0.13327149048321235
Energy: 0.08495761253695912
Energy: 0.08526262118340948
Energy: 0.13303321257225367
Energy: 0.08771968927035428
Energy: 0.08575114398718553
Energy: 0.132083256905258
Energy: 0.08337458623468172
Energy: 0.08343754757963909
Energy: 0.13099274559876814
Energy: 0.08318276567280929
Energy: 0.13047256676966315
Energy: 0.08718347742239835
Energy: 0.08342552652988082
Energy: 0.08423292828590319
Energy: 0.08648105483800982
Energy: 0.0832116379644983
Energy: 0.13082580819565043
Energy: 0.13007172006741272
Energy: 0.13211587601897362
Energy: 0.13267937702179577
Energy: 0.13121047725185742
Energy: 0.13172441266729012
Energy: 0.13254601256079657
Energy: 0.08396536449963209
Energy: 0.08556846932469736
Energy: 0.08343141068342783
Energy: 0.08575597952515741
Energy: 0.08573808388683124
Energy: 0.08327430801439875
Energy: 0.13241760034174285
Energy: 0.0853579959253082
Energy: 0.08528203351804241
Energy: 0.13192919480962126
Energy: 0.08527162071385605
Energy: 0.08545149409450359
Energy: 0.1323662335398949
Energy: 0.08320826159542012
Energy: 0.08381862235866831
Energy: 0.1320875400194318
Energy: 0.0833797798080446
Energy: 0.13065392489230007
Energy: 0.08649260228618412
Energy: 0.08322035472935975
Energy: 0.13110383167946682
Energy: 0.08634331355827712
Energy: 0.08353818643369323
Energy: 0.13278551925562257
Energy: 0.08295099253720115
Energy: 0.13114542488230052
Energy: 0.13156156905191926
Energy: 0.08374751918110684
Energy: 0.1311673571236824
Energy: 0.13171239352503633

minimum gb energy = 0.08249681434200272 eV
minimum distance =  2.4579666714812 Angstroms
sigma value = 3


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

Energy: 0.8461963726325304
Energy: 0.8268679146983177
Energy: 0.8334383479336459
Energy: 0.7490981808644726
Energy: 0.823844445109421
Energy: 0.7530835125693403
Energy: 0.8493751146710382
Energy: 0.8221997507644517
Energy: 0.7620067659024716
Energy: 0.8234129260644304
Energy: 0.8236742934141085
Energy: 0.762149050597078
Energy: 0.8390600041844883
Energy: 0.7693456736413516
Energy: 0.7682908568543328
Energy: 0.8356831710181315
Energy: 0.7701422043214954
Energy: 0.8196618586305783
Energy: 0.7778794677375653
Energy: 0.7682961753834322
Energy: 0.7688476799484772
Energy: 0.7778122283433443
Energy: 0.7014994431158059
Energy: 0.8210850088712586
Energy: 0.709708924590393
Energy: 0.7607805463694771
Energy: 0.7615666567822389
Energy: 0.7097563116760407
Energy: 0.838304622941775
Energy: 0.7614519399333762
Energy: 0.7911900867219263
Energy: 0.7614485514072739
Energy: 0.7821526963728669
Energy: 0.6593902401649903
Energy: 0.8309044013145918
Energy: 0.7034307032801759
Energy: 0.7786620924329014
Energy: 0.720464784881394
Energy: 0.7213921084305276
Energy: 0.7792456077594329
Energy: 0.7234118910402665
Energy: 0.786074645650486
Energy: 0.7782962921078811
Energy: 0.7126536324990393
Energy: 0.7115184665338521
Energy: 0.7783043706602464
Energy: 0.6982908618999522
Energy: 0.7107757763680752
Energy: 0.6694049649322538
Energy: 0.7091044101344215
Energy: 0.7866098868529072
Energy: 0.7195494530752148
Energy: 0.6634048699688745
Energy: 0.7883653093272872
Energy: 0.6696942283361079
Energy: 0.7176376420104195
Energy: 0.7171326596878368
Energy: 0.6709781268264641
Energy: 0.7221800817365776
Energy: 0.7202664921327394
Energy: 0.7745350549682588
Energy: 0.7226562469808017
Energy: 0.7209595690502446
Energy: 0.6370207976329911
Energy: 0.779699040893059
Energy: 0.6657974270764793
Energy: 0.6677324067209974
Energy: 0.7827126811833721
Energy: 0.7186391412954151
Energy: 0.6677063700805206
Energy: 0.7462181292199955
Energy: 0.668040090173931
Energy: 0.6700354844792381
Energy: 0.7290930654120366
Energy: 0.6708872952895574
Energy: 0.6701182529109428
Energy: 0.6176541912751838
Energy: 0.6710863381065643
Energy: 0.7634113726748487
Energy: 0.6674399713478836
Energy: 0.7500883385820213
Energy: 0.6725411448104154
Energy: 0.6362438485856613
Energy: 0.7524731705341211
Energy: 0.7610361014679502
Energy: 0.6355974241046759
Energy: 0.635420834075424
Energy: 0.7584615900620504
Energy: 0.641558102544882
Energy: 0.6360239098805902
Energy: 0.7591073483395949
Energy: 0.6373430967665742
Energy: 0.7334104985359401
Energy: 0.7336355327807089
Energy: 0.7516327295371373
Energy: 0.733742261458493
Energy: 0.6198875416013625
Energy: 0.730759118669944
Energy: 0.7320278526237416
Energy: 0.6198265674163933
Energy: 0.637056498876627
Energy: 0.6193552056300732
Energy: 0.620154258166704
Energy: 0.7253838825024661
Energy: 0.7253073635943547
Energy: 0.6202179635913064
Energy: 0.6217324760732225
Energy: 0.7269182586584251
Energy: 0.7482066311597076
Energy: 0.6875913609227512
Energy: 0.7336298873590401
Energy: 0.6222313227668737
Energy: 0.6203043140890776
Energy: 0.726534052216804
Energy: 0.750913466650989
Energy: 0.619717998814145
Energy: 0.6195948501244084
Energy: 0.752377363448457
Energy: 0.6251710259767769
Energy: 0.6201456833029747
Energy: 0.7507707030090316
Energy: 0.7324052951776263
Energy: 0.7336022325485587
Energy: 0.7741134087572282
Energy: 0.7355454670147084
Energy: 0.7321663804280059
Energy: 0.6387336816285911
Energy: 0.7330924956865782
Energy: 0.6368165355179883
Energy: 0.636311925756396
Energy: 0.7343691613863234
Energy: 0.6358608148507866
Energy: 0.6357000879621132
Energy: 0.7584418910694628
Energy: 0.7585200297326689
Energy: 0.6357449785249323
Energy: 0.6708002560139144
Energy: 0.6716342346608898
Energy: 0.7629036399075093
Energy: 0.6698359577098879
Energy: 0.6711382869411652
Energy: 0.6920465467649204
Energy: 0.6690543085783579
Energy: 0.6482240288400484
Energy: 0.7112713151850941
Energy: 0.6678471332787668
Energy: 0.6678058520771738
Energy: 0.7079808218950217
Energy: 0.6686004760470816
Energy: 0.6683594031755652
Energy: 0.7830701599501615
Energy: 0.6895748617514579
Energy: 0.6871087195053063
Energy: 0.7832297404057071
Energy: 0.7342469967057076
Energy: 0.7185691269641911
Energy: 0.7219259942204657
Energy: 0.7566576528558014
Energy: 0.686537497483383
Energy: 0.7211736307183955
Energy: 0.789735159972578
Energy: 0.7198680215541287
Energy: 0.6853116680730965
Energy: 0.8176962555896
Energy: 0.8115093714533428
Energy: 0.6853375900202198
Energy: 0.7170994276673995
Energy: 0.7883926222912303
Energy: 0.7818690937113586
Energy: 0.7792647096562112
Energy: 0.744592353066116
Energy: 0.6467183870844746
Energy: 0.7789391791998536
Energy: 0.680921211693108
Energy: 0.7179892416252263
Energy: 0.7862432865368604
Energy: 0.7872204211558631
Energy: 0.7182121503934211
Energy: 0.7797885229116372
Energy: 0.8115749439305463
Energy: 0.763140771915393
Energy: 0.7343427910447137
Energy: 0.7319897478823789
Energy: 0.7884486885119057
Energy: 0.639119498823961
Energy: 0.7341305840260001
Energy: 0.8661408055391908
Energy: 0.7325735152025594
Energy: 0.8232664647172006
Energy: 0.8401892645062029
Energy: 0.6805755821087274
Energy: 0.7608565939143794
Energy: 0.731223607342984
Energy: 0.7769909094036648
Energy: 0.7775757625127913
Energy: 0.73121847895518
Energy: 0.7841792424536489
Energy: 0.7835122375377889

minimum gb energy = 0.6176541912751838 eV
minimum distance =  2.27511164074194 Angstroms
sigma value = 67


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

Energy: 1.00655171088324
Energy: 1.1253346250779879
Energy: 0.9818041507162825
Energy: 0.7941528661450473
Energy: 1.1251465822291253
Energy: 0.9857766853044038
Energy: 1.0087095594886353
Energy: 0.9814698911291131
Energy: 0.9748588872108119
Energy: 0.9710933351617878
Energy: 0.9762670573554226
Energy: 0.9792642062457152
Energy: 0.9932419313476306
Energy: 0.8930946759252978
Energy: 0.9732842886139949
Energy: 0.9667307382107481
Energy: 0.8914435912997848
Energy: 0.9732023564498874
Energy: 0.9007957841342215
Energy: 0.9766025065756206
Energy: 0.9730213159491393
Energy: 0.902192236279528
Energy: 0.9315760435736209
Energy: 0.9741660004023271
Energy: 0.895711243677049
Energy: 0.9785893358915895
Energy: 0.9789608077765047
Energy: 0.8958713008678129
Energy: 0.9750942713687775
Energy: 0.9770178795678313
Energy: 0.9306187616199634
Energy: 0.8915510082270148
Energy: 0.8962543568008386
Energy: 0.8197956892747255
Energy: 0.8947624220380228
Energy: 0.898552246695524
Energy: 0.8967375350944355
Energy: 0.910091529375357
Energy: 0.9029201688353914
Energy: 0.897131948885882
Energy: 0.8220353746652675
Energy: 0.8997035428251589
Energy: 0.900338937921651
Energy: 0.7717730660813608
Energy: 0.8701960931492048
Energy: 0.9001843013295094
Energy: 0.7756079040718323
Energy: 0.8247205792279517
Energy: 0.932612462851797
Energy: 0.8206853300061742
Energy: 0.8230059701348643
Energy: 0.8250342060253637
Energy: 0.8171509877093578
Energy: 0.9398135853917269
Energy: 0.8636537478060587
Energy: 0.8229711943187107
Energy: 0.8195174159603327
Energy: 0.8632868273426755
Energy: 0.8211888409894241
Energy: 0.8185967951171063
Energy: 0.7782249047381387
Energy: 0.8183542066181371
Energy: 0.81905085320313
Energy: 0.776617093053313
Energy: 0.9138734674679089
Energy: 0.8727123253052893
Energy: 0.7756730189459478
Energy: 0.8180129836436274
Energy: 0.9018016921211118
Energy: 0.7754713011948756
Energy: 0.8218062537203706
Energy: 0.7739874661651525
Energy: 0.7746465941367273
Energy: 0.7736965877243283
Energy: 0.8906946135972417
Energy: 0.7744877007935024
Energy: 0.7787931950517603
Energy: 0.7736346262331658
Energy: 0.9101708850863944
Energy: 0.7780139563669025
Energy: 0.8467142473026703
Energy: 0.7765945256230713
Energy: 0.8487445709953988
Energy: 0.8907619849941911
Energy: 0.9113096056223934
Energy: 0.7799807487645083
Energy: 0.7763286754384668
Energy: 0.9102839336596286
Energy: 0.7786500359808749
Energy: 0.7748979906283731
Energy: 0.9099557713159049
Energy: 0.8287361543167595
Energy: 0.9035629653490842
Energy: 0.8208793072068589
Energy: 0.8565892836000529
Energy: 0.9009756193313965
Energy: 0.8245531676220654
Energy: 0.7741855243192698
Energy: 0.8876102738957594
Energy: 0.8250067035524044
Energy: 0.7660030048996458
Energy: 0.8176891499675235
Energy: 0.8190939786251075
Energy: 0.9367704894671743
Energy: 0.9405898634594717
Energy: 0.818915084382298
Energy: 0.9338514662402008
Energy: 0.8206259592199596
Energy: 0.9106937874082117
Energy: 0.7755473426739264
Energy: 0.8487673923855059
Energy: 0.7887648350016653
Energy: 0.933841681458155
Energy: 0.8468260189816542
Energy: 0.8184280828616924
Energy: 0.9015972980068183
Energy: 0.9006924944656192
Energy: 0.8214741382222455
Energy: 0.9021049965161004
Energy: 0.9002550519591288
Energy: 0.9051979897235816
Energy: 0.9481460512847492
Energy: 0.948186134007103
Energy: 0.906345191117151
Energy: 0.7820845650832254
Energy: 0.7945119227318638
Energy: 0.9921308319859911
Energy: 0.9170072097770693
Energy: 0.9481632814078579
Energy: 0.968196792866295
Energy: 0.7827039723967809
Energy: 0.792603448207787
Energy: 0.9383464489540702
Energy: 0.9058537179218638
Energy: 0.8970628414728731
Energy: 0.9397973976870816
Energy: 0.9013454233732472
Energy: 0.9015108429050301

minimum gb energy = 0.7660030048996458 eV
minimum distance =  2.27015977045626 Angstroms
sigma value = 33


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

Energy: 1.146933976925053
Energy: 1.1171940375577576
Energy: 1.1402159401994467
Energy: 0.9171476610375007
Energy: 1.0920065996343962
Energy: 1.057664751567779
Energy: 1.1014855769364384
Energy: 0.9683562145063039
Energy: 0.9671617141806756
Energy: 0.9661724015766443
Energy: 1.0649603634895786
Energy: 0.895058237900507
Energy: 1.1005935035356382
Energy: 1.0282822818208146
Energy: 1.0246553388907274
Energy: 0.9716786644224826
Energy: 1.0276491258332503
Energy: 1.0567025602363438
Energy: 1.0635293250436144
Energy: 1.0244561209608576
Energy: 1.0575974518518205
Energy: 1.064328342551498
Energy: 0.968137140553826
Energy: 1.0568574653077019
Energy: 0.9655973019626928
Energy: 0.9742328489217605
Energy: 0.8958558397870721
Energy: 0.9654994772934722
Energy: 0.9739745517454949
Energy: 0.894277192342677
Energy: 0.9754921633341745
Energy: 0.8844739579391938
Energy: 0.8883825505645409
Energy: 0.8891657608457372
Energy: 0.8877357216963881
Energy: 0.9664360526530293
Energy: 0.9669035829152005
Energy: 0.9771192814673219
Energy: 0.9803992593707036
Energy: 0.966730567956002
Energy: 0.9754884037023667
Energy: 0.9721397174152066
Energy: 0.966329945498782
Energy: 0.8839356701907722
Energy: 0.8854057943361288
Energy: 0.9661294729359364
Energy: 0.8910611272400142
Energy: 0.9683944113898347
Energy: 1.0172648573109935
Energy: 0.9749039866841228
Energy: 0.970856796837875
Energy: 0.8966798013857807
Energy: 0.8853527738551145
Energy: 1.0133692396913423
Energy: 1.0171283434283818
Energy: 0.8869800976778413
Energy: 0.885337993566341
Energy: 1.0186770950092514
Energy: 0.8869345253745197
Energy: 0.8855135217652007
Energy: 0.8878437368159106
Energy: 0.886639735280305
Energy: 0.8857367376387545
Energy: 0.8892341986508439
Energy: 0.9536587716744827
Energy: 0.9889159653265828
Energy: 0.8854830632600075
Energy: 0.8871688544294152
Energy: 0.8911614130748003
Energy: 0.8855079266872505
Energy: 0.9033388827094501
Energy: 0.8855262389572175
Energy: 0.8851406916033475
Energy: 1.013125643816425
Energy: 0.9378967464650011
Energy: 0.8850102511533631
Energy: 0.8940245642351364
Energy: 0.885212908219503
Energy: 1.0202384804029738
Energy: 0.8986237445321572
Energy: 0.8989993000455805
Energy: 0.8677437052811714
Energy: 1.0362117466231342
Energy: 0.9101820640704353
Energy: 0.8641021807306637
Energy: 0.9654766245323441
Energy: 0.9712100353484459
Energy: 0.8622167915877389
Energy: 0.9675123802148848
Energy: 0.9720928112663523
Energy: 0.895172680524642
Energy: 1.035905022245535
Energy: 1.0310342710807079
Energy: 0.8964110258683806
Energy: 0.9025542696966855
Energy: 0.9771840108843983
Energy: 1.0999400428183423
Energy: 0.9020604488961694
Energy: 0.9034368131001653
Energy: 0.9750117997723713
Energy: 0.9090450830864039
Energy: 1.026656767739117
Energy: 1.0992569389212523
Energy: 0.9701461150781595
Energy: 0.974012043963181
Energy: 1.0610568805840024
Energy: 0.9704870624863715
Energy: 1.0488668513560335
Energy: 1.085494234305016
Energy: 0.9747993789949005
Energy: 0.9088135133200215
Energy: 0.8997729644979834
Energy: 0.9744655640106081
Energy: 1.0241685284911561
Energy: 1.0176833078250815
Energy: 0.9747176828925035
Energy: 0.965241518384351
Energy: 1.0186017906474376
Energy: 0.9727722756457904
Energy: 0.8941538318173239
Energy: 1.1036933605223664
Energy: 1.0234857445967755
Energy: 1.023168240511283
Energy: 0.9727209556674759
Energy: 0.9838445886106535
Energy: 1.0562460803100533
Energy: 0.9713373055539763
Energy: 0.9609234998425857
Energy: 0.9402356314042496
Energy: 0.9724262352712031
Energy: 1.0294236187824188
Energy: 0.9664886706239976
Energy: 0.9658816361544377
Energy: 0.9685684708269481
Energy: 0.9715645778852201
Energy: 0.9656631998496747
Energy: 1.0646715998898117
Energy: 0.8987874599505964
Energy: 0.9752740461794411
Energy: 0.8879124250909488
Energy: 0.8889257850304683
Energy: 0.8824436148360854
Energy: 0.8884603460348581
Energy: 0.9606956784964389
Energy: 0.9663183187939112
Energy: 0.9741939569723601
Energy: 0.973822022088095
Energy: 0.966141799969876
Energy: 1.0683976218201907
Energy: 0.972415237189643
Energy: 0.972481149235017
Energy: 0.8838957526488744
Energy: 0.931822545348715
Energy: 0.9737308669252538
Energy: 0.8904421104775995
Energy: 0.9701041606479612
Energy: 1.0168766364701756
Energy: 0.9691614175952302
Energy: 0.9695299364210094
Energy: 0.8956329530235124
Energy: 0.9075650985902989
Energy: 1.0144229220334844
Energy: 1.0164523554405842
Energy: 0.8870175590857211
Energy: 0.8855690331315613
Energy: 1.0203700850915596
Energy: 0.8876472035511334
Energy: 0.8856138704222138
Energy: 0.8874243589992329
Energy: 0.9127038463770921
Energy: 0.8894773920545612
Energy: 0.8911174539640995
Energy: 0.8873207475744914
Energy: 0.9362089827229273
Energy: 0.8853527181752425
Energy: 0.8860579181817271
Energy: 0.8885688182735123
Energy: 0.885206057467086
Energy: 0.9065633472800265
Energy: 0.8849057547204794
Energy: 0.8886470045824898
Energy: 0.8942173862906003
Energy: 0.885822506777064
Energy: 0.8862502456925666
Energy: 0.8990094172689377
Energy: 0.8854958013039326
Energy: 0.8664371518123831
Energy: 0.8989549658081244
Energy: 0.8992874634266604
Energy: 0.8669796456444271
Energy: 0.9517457308164594
Energy: 0.9102710669569272
Energy: 0.8635685503482935
Energy: 0.9665482502143906
Energy: 0.9690621578451728
Energy: 0.8648584439171025
Energy: 0.9686438944638291
Energy: 0.971624950925842
Energy: 0.8967595161717526
Energy: 0.9885548281465368
Energy: 0.9781448594407155
Energy: 0.9671072526448296
Energy: 0.9028171475860471
Energy: 0.9707430225294694
Energy: 1.142640803403569
Energy: 0.9020813044128817
Energy: 0.9040383700537681
Energy: 0.973218526957159
Energy: 0.8679058315572974
Energy: 1.0251684064535416
Energy: 1.103591561970933
Energy: 0.9653206865590871
Energy: 1.0484606902807287
Energy: 1.0642073863122548
Energy: 0.9650648113436991
Energy: 1.048295533444437
Energy: 1.0859686297088216
Energy: 0.9770291697358537
Energy: 0.9038459758762025
Energy: 0.9069671865145698
Energy: 0.9771930477799464
Energy: 1.02517428750547

minimum gb energy = 0.8622167915877389 eV
minimum distance =  2.28612920205828 Angstroms
sigma value = 41


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

Energy: 1.2566225349763858
Energy: 1.07703430576707
Energy: 1.1836051846621325
Energy: 1.0252451806072214
Energy: 1.0772269850769793
Energy: 1.0279748515187848
Energy: 1.2302178004718038
Energy: 1.0834600525850715
Energy: 1.0823153263683398
Energy: 1.153376080686399
Energy: 1.1574989531325561
Energy: 1.0539607365828154
Energy: 1.2307099169984221
Energy: 1.031601230516736
Energy: 1.0279459763158216
Energy: 1.0771150348033307
Energy: 1.0709541539545708
Energy: 1.0755381858591775
Energy: 1.0775208737005515
Energy: 1.0312472386495604
Energy: 1.0287370481724873
Energy: 1.0773945644692398
Energy: 1.031254584785302
Energy: 1.0617605776994612
Energy: 1.0606751366544984
Energy: 1.0839990433530957
Energy: 1.0519267758797235
Energy: 1.0608481060129593
Energy: 1.0838289095389393
Energy: 1.0329483929976122
Energy: 1.0890288237133774
Energy: 1.0525659979337456
Energy: 1.0316867408624721
Energy: 1.0689873561078358
Energy: 1.1307887867343425
Energy: 1.0307937595285237
Energy: 1.0593276631364714
Energy: 1.1741958545964706
Energy: 1.034498040175214
Energy: 1.0593401030153073
Energy: 1.0341727062436274
Energy: 1.0353878413987458
Energy: 1.0628128262256402
Energy: 1.0322508305447045
Energy: 1.031994461206687
Energy: 1.0642077998928618
Energy: 1.0390549383248613
Energy: 1.0597306101018653
Energy: 1.1369337579052092
Energy: 1.0332708098906593
Energy: 1.030193537670486
Energy: 1.0095930271564515
Energy: 1.0528401550802151
Energy: 1.0301093400694097
Energy: 1.093926537990428
Energy: 1.0670739097298496
Energy: 1.0787639948523031
Energy: 1.0761635082317385
Energy: 1.0615209755212451
Energy: 1.0310233606449617
Energy: 1.1668636048911674
Energy: 1.0521144431558414
Energy: 1.0523632841489365
Energy: 1.1637103062855343
Energy: 1.0075249570721236
Energy: 1.126666721138191
Energy: 1.2299253509978223
Energy: 1.0074172662952028
Energy: 1.0075657892908363
Energy: 1.0776338162726933
Energy: 1.00721536430345
Energy: 1.08451686218979
Energy: 1.2364880082467955
Energy: 1.0615818041345975
Energy: 1.0545055982332325
Energy: 1.0812634718469278
Energy: 1.1604149820519538
Energy: 1.055557597458021
Energy: 1.102231887003414
Energy: 1.0780447982110635
Energy: 1.0081298317452692
Energy: 1.0135769079565247
Energy: 1.0816247483540378
Energy: 1.0089865051012603

minimum gb energy = 1.00721536430345 eV
minimum distance =  2.28254345514389 Angstroms
sigma value = 11


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

Energy: 1.7570512486033338
Energy: 1.2520185023488108
Energy: 1.2546496037134518
Energy: 1.241626404482868
Energy: 1.2453244271131456
Energy: 1.255737111019669
Energy: 1.389771405136216
Energy: 1.190302753308574
Energy: 1.1903484177209782
Energy: 1.2385063101645803
Energy: 1.190054502734742
Energy: 1.2177508205024612
Energy: 1.3854587393702225
Energy: 1.207758826998202
Energy: 1.218434772016175
Energy: 1.245060239206844
Energy: 1.177137384498389
Energy: 1.2231630673073282
Energy: 1.2366362385044185
Energy: 1.176353157890752
Energy: 1.1818539766775615
Energy: 1.2059261307820122
Energy: 1.176072448709431
Energy: 1.2265809152846792
Energy: 1.236853501071244
Energy: 1.1898011255976497
Energy: 1.1897930600963158
Energy: 1.2406559820795164
Energy: 1.1889429804948792
Energy: 1.2301194269548388
Energy: 1.256820011421636
Energy: 1.2200655030149818
Energy: 1.2152865982935719
Energy: 1.1918823095822582
Energy: 1.2074224531524183
Energy: 1.2115960972170179
Energy: 1.2077139795265441
Energy: 1.211509676379406
Energy: 1.2064907942539542
Energy: 1.2072392292257246
Energy: 1.200460529434376
Energy: 1.227944402422569
Energy: 1.2068727914025124
Energy: 1.1991695391796557
Energy: 1.2291077941477797
Energy: 1.1894793433307083
Energy: 1.248496835182963
Energy: 1.1999982074822702
Energy: 1.2089541898331584
Energy: 1.2183024302747079
Energy: 1.2247212965716672
Energy: 1.1715579207041626
Energy: 1.2097363947819246
Energy: 1.1917297408599667
Energy: 1.208425667633438
Energy: 1.2163564912808251
Energy: 1.2279530534172436
Energy: 1.1711376545298422
Energy: 1.2103183930901211
Energy: 1.1926223914331593
Energy: 1.2078279438838884
Energy: 1.1980317335448467
Energy: 1.2176599476076315
Energy: 1.1904150539765663
Energy: 1.2015558874137893
Energy: 1.19828399533232
Energy: 1.19276461209829
Energy: 1.188833407558381
Energy: 1.2201155871142781
Energy: 1.1932826310564086
Energy: 1.2078215190148893
Energy: 1.2237418104089706
Energy: 1.18921532655451
Energy: 1.2112199211085082
Energy: 1.212630931713849
Energy: 1.1892689471359918
Energy: 1.2282998553090756
Energy: 1.2369209741269647
Energy: 1.2030007366278668
Energy: 1.2024229432531313
Energy: 1.2212464681995616
Energy: 1.1763975113868506
Energy: 1.2820344198374178
Energy: 1.2200188854453546
Energy: 1.178896135814172
Energy: 1.2125106395325322
Energy: 1.219520783098351
Energy: 1.1810002540592308
Energy: 1.2097177775182104
Energy: 1.2241557641078435
Energy: 1.179152651082623
Energy: 1.2131780184794736
Energy: 1.2255050613883067
Energy: 1.1806828122864386
Energy: 1.2091832105813003
Energy: 1.1786339628618292
Energy: 1.1784637142311827
Energy: 1.2111677031809671
Energy: 1.2230719084421424
Energy: 1.1790861445478247
Energy: 1.2020109718518937
Energy: 1.2183545738363792
Energy: 1.4191392323451488
Energy: 1.2521294925250053
Energy: 1.2432947050787306
Energy: 1.2018885378578945
Energy: 1.274536100360557
Energy: 1.2093247728271759
Energy: 1.2027457258023153
Energy: 1.192892049336188
Energy: 1.2028740103477062
Energy: 1.2036443164618924
Energy: 1.1978163664823396
Energy: 1.222305875198322
Energy: 1.2205699843614228
Energy: 1.1797527269138328
Energy: 1.1868732992060835
Energy: 1.2015182346725122
Energy: 1.1791571814505797
Energy: 1.2131066202347112
Energy: 1.2873948479703206
Energy: 1.1791960283986003
Energy: 1.2143957671878391
Energy: 1.1969695485523304
Energy: 1.1799445444595744
Energy: 1.1951155524883674
Energy: 1.205161166466412
Energy: 1.1959208239783614
Energy: 1.194621547192933
Energy: 1.188129955553997
Energy: 1.2007784635728156
Energy: 1.21858275867917
Energy: 1.1838131550234434
Energy: 1.201612015290975
Energy: 1.2212812459987656
Energy: 1.176029372995083
Energy: 1.2015766557406835
Energy: 1.2225337052479934
Energy: 1.2786156178690011
Energy: 1.2029638837281023
Energy: 1.2222368593846185
Energy: 1.2051067753346039
Energy: 1.203754466079372
Energy: 1.2020266916782971
Energy: 1.2714684663216846
Energy: 1.210691479212008
Energy: 1.2115712499532911
Energy: 1.2729472377085462
Energy: 1.1863633019665052
Energy: 1.2008133522501927
Energy: 1.27681741667593
Energy: 1.2229190088579869
Energy: 1.1795510850102253
Energy: 1.1982413186724752
Energy: 1.1801153306764416
Energy: 1.2233461392729292
Energy: 1.2756713190353233
Energy: 1.1777960801704301
Energy: 1.1779579522781818
Energy: 1.2077944271347076
Energy: 1.1810696696250276
Energy: 1.1789805241546707
Energy: 1.2736774246634113
Energy: 1.1791575425476473
Energy: 1.1791777980879221
Energy: 1.2097953758150461
Energy: 1.1807384141883297
Energy: 1.2232983591257585
Energy: 1.2889496265405875
Energy: 1.2119714954902816
Energy: 1.2122933045572364
Energy: 1.2317565858008888
Energy: 1.1850359396122596
Energy: 1.208872169035526
Energy: 1.2695713874458145
Energy: 1.1906802225032183
Energy: 1.240423034134293
Energy: 1.2303664693254592
Energy: 1.1892081522314977
Energy: 1.2129867414837952
Energy: 1.1810153611161136
Energy: 1.1954310951283977
Energy: 1.20756127660493
Energy: 1.1796582389526928
Energy: 1.1938054251569366
Energy: 1.2167466915463128

minimum gb energy = 1.1711376545298422 eV
minimum distance =  2.27221991395257 Angstroms
sigma value = 57


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

Energy: 1.5891363500320463
Energy: 1.7371745164407715
Energy: 1.3329256937336338
Energy: 1.364884596994208
Energy: 1.7293488069239826
Energy: 1.3349398606193932
Energy: 1.2701974039196595
Energy: 1.2198185750519666
Energy: 1.2176519881108203
Energy: 1.2213972270791267
Energy: 1.2175109581730779
Energy: 1.21536276779743
Energy: 1.2744826986904263
Energy: 1.2292252346609207
Energy: 1.2265983419775897
Energy: 1.2767632789735632
Energy: 1.2071650507159482
Energy: 1.217730830413776
Energy: 1.2071449726677397
Energy: 1.2178272854591683
Energy: 1.2162927603028486
Energy: 1.2130424844397585
Energy: 1.205511990463225
Energy: 1.2159352456320023
Energy: 1.216932191548793
Energy: 1.2168615637143119
Energy: 1.2201663649585845
Energy: 1.2117880169512432
Energy: 1.2128640939990576
Energy: 1.2163706470948867
Energy: 1.2074198434002172
Energy: 1.2143747897577828
Energy: 1.2212910825576986
Energy: 1.218507936490121
Energy: 1.2802197785472196
Energy: 1.2154238763706782
Energy: 1.2730756917595156
Energy: 1.2256363878481287
Energy: 1.2289088717880186
Energy: 1.274803682113743
Energy: 1.2160116907048957
Energy: 1.2229128007601566
Energy: 1.2701918675473032
Energy: 1.216826516225289
Energy: 1.220466642606306
Energy: 1.2161164225851369
Energy: 1.2146646148033355
Energy: 1.2153811826072514
Energy: 1.1839426018367933
Energy: 1.2171352405229519
Energy: 1.2277247777793505
Energy: 1.1852286532541199
Energy: 1.2107985521596967
Energy: 1.2262286348016318
Energy: 1.2489697349660212
Energy: 1.2150336195060774
Energy: 1.2275801822237926
Energy: 1.1847944237952472
Energy: 1.2121145531270519
Energy: 1.1891539854135917
Energy: 1.2711038302762971
Energy: 1.2163899409578096
Energy: 1.218487429292003
Energy: 1.216877471021066
Energy: 1.2081079016707683
Energy: 1.2158875660979396
Energy: 1.2609798056734687
Energy: 1.231760784554412
Energy: 1.2253495433107386
Energy: 1.2617544692629097
Energy: 1.2329913885004091
Energy: 1.218308360355167
Energy: 1.221393327708293
Energy: 1.2202286065849886
Energy: 1.2194593968089802
Energy: 1.2201642554779064
Energy: 1.2177929583534906
Energy: 1.2156412374370207
Energy: 1.2071400837047181
Energy: 1.272370194650848
Energy: 1.2142127544298829
Energy: 1.2199470993003674
Energy: 1.2725313897623283
Energy: 1.2181790091282698
Energy: 1.2196120427107904
Energy: 1.2222855172926854
Energy: 1.2169894371579228
Energy: 1.2149037241105072
Energy: 1.2205941156537177
Energy: 1.21590047588074
Energy: 1.2753914685905963
Energy: 1.2235322021071826
Energy: 1.2243668390130913
Energy: 1.2728579492049328
Energy: 1.2210827713435142
Energy: 1.221171272312519
Energy: 1.1839237431734846
Energy: 1.2199731909142386
Energy: 1.2171938343820292
Energy: 1.1846319397959715
Energy: 1.2193529751908865
Energy: 1.2161118639376831

minimum gb energy = 1.1839237431734846 eV
minimum distance =  2.28537816258956 Angstroms
sigma value = 9


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

Energy: 1.94481058192254
Energy: 1.325524375472313
Energy: 1.2811552550872372
Energy: 1.2805009132847183
Energy: 1.324207030289055
Energy: 1.2825378132788121
Energy: 1.3488831018219034
Energy: 1.2782331393596353
Energy: 1.2783776180006605
Energy: 1.2772333379411605
Energy: 1.2538966285151574
Energy: 1.2801294615368826
Energy: 1.3560980823946482
Energy: 1.2825802449266226
Energy: 1.2801831657734366
Energy: 1.2712260923674537
Energy: 1.27510185506633
Energy: 1.2782052886106807
Energy: 1.2778557854716859
Energy: 1.2902036777398314
Energy: 1.2863339192930783
Energy: 1.2788937896957098
Energy: 1.2784786286532304
Energy: 1.2849561907814053
Energy: 1.3061759727396205
Energy: 1.2543427560104075
Energy: 1.2529835661561721
Energy: 1.2516684156990285
Energy: 1.2509611182093172
Energy: 1.252997757426004
Energy: 1.2792320071035346
Energy: 1.2726573650665352
Energy: 1.2697698519581389
Energy: 1.2827435865543209
Energy: 1.277993289959978
Energy: 1.269499394192399
Energy: 1.2727283639600384
Energy: 1.2664178665823933
Energy: 1.2885366356054189
Energy: 1.2513310836428224
Energy: 1.2713497413359824
Energy: 1.288423570032365
Energy: 1.3140366065707605
Energy: 1.2656258306615946
Energy: 1.2738426332546822
Energy: 1.2804147720634738
Energy: 1.265344650492088
Energy: 1.266930487282115
Energy: 1.4532483984935263
Energy: 1.2557170395249402
Energy: 1.2601762147564286
Energy: 1.2954038426063774
Energy: 1.2527206432706743
Energy: 1.2782037776415078
Energy: 1.4508471725947725
Energy: 1.2563296700264355
Energy: 1.2568321998029395
Energy: 1.2956759690773743
Energy: 1.271824232714443
Energy: 1.2529766237609086
Energy: 1.3138239670012941
Energy: 1.2626876475449627
Energy: 1.2661930994538877
Energy: 1.2772730623434758
Energy: 1.2684715572464822
Energy: 1.267231720085549
Energy: 1.3134788793839263
Energy: 1.2846486686546092
Energy: 1.2829361079856205
Energy: 1.2996763900981545
Energy: 1.2795545253041571
Energy: 1.2815982286600165
Energy: 1.4776443259880603
Energy: 1.277834758354916
Energy: 1.2777370337387748
Energy: 1.2786084417847534
Energy: 1.2803496616653718
Energy: 1.2670824860245444
Energy: 1.3321301063381907
Energy: 1.2839360818473593
Energy: 1.2842206581429512
Energy: 1.2900511931101613
Energy: 1.282583088152968
Energy: 1.28526614073488
Energy: 1.3131472673944677
Energy: 1.259956117781131
Energy: 1.2536506640603005
Energy: 1.295534411345558
Energy: 1.2591319226924957
Energy: 1.2487739450614013
Energy: 1.2954795967794246
Energy: 1.2832115367489751
Energy: 1.26397155070396
Energy: 1.2951098788818751
Energy: 1.2914455605907837
Energy: 1.259532160994198
Energy: 1.305032580552413
Energy: 1.2926413173859985
Energy: 1.2864338560586372
Energy: 1.2775588041278838
Energy: 1.2786605483064304
Energy: 1.2839885890321163
Energy: 1.3986096033261077
Energy: 1.2494846503674988
Energy: 1.249326946249338
Energy: 1.2993135478651199
Energy: 1.249666129528199
Energy: 1.249406667657191
Energy: 1.2961240897514728
Energy: 1.287494654033405
Energy: 1.282450150859421
Energy: 1.2964396709062176
Energy: 1.2823455441705527
Energy: 1.2798463541660863
Energy: 1.34956846372401
Energy: 1.2877238515362741
Energy: 1.282412473061075
Energy: 1.2509520536924454
Energy: 1.2782469910517957
Energy: 1.2796967522377327
Energy: 1.2951983503152795
Energy: 1.2528528193030615
Energy: 1.2499082085920405
Energy: 1.2642558755981033
Energy: 1.29907482711133
Energy: 1.2508616710783018

minimum gb energy = 1.2487739450614013 eV
minimum distance =  2.277483665631 Angstroms
sigma value = 27


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

Energy: 1.852123197765096
Energy: 1.7992102890037482
Energy: 1.2475429048262834
Energy: 1.2367069508429993
Energy: 1.2902878529912412
Energy: 1.2331153691694843
Energy: 1.352350665824272
Energy: 1.2429810256934892
Energy: 1.2438043260085745
Energy: 1.256065049474101
Energy: 1.2546184641559524
Energy: 1.249423754698885
Energy: 1.2676489638995954
Energy: 1.2543850289512415
Energy: 1.2548263651426597
Energy: 1.247435359760551
Energy: 1.2327067339732167
Energy: 1.251522142044689
Energy: 1.27120940929367
Energy: 1.2419907325319846
Energy: 1.2469195536920907
Energy: 1.2625089467891615
Energy: 1.2417778860079534
Energy: 1.2507480865725629
Energy: 1.2420637678201043
Energy: 1.2379463492274356
Energy: 1.2464446979754538
Energy: 1.2392902146175853
Energy: 1.256494118596059
Energy: 1.2462692648372842
Energy: 1.265961236781205
Energy: 1.2552766922180483
Energy: 1.2526256859250382
Energy: 1.258000468346029
Energy: 1.2625773505744593
Energy: 1.252118366504871
Energy: 1.268621948549238
Energy: 1.2493409597835659
Energy: 1.2434486297665182
Energy: 1.2538225376014167
Energy: 1.2541855000460747
Energy: 1.249401566332447
Energy: 1.3128347584380493
Energy: 1.2441963154699498
Energy: 1.2440688535435478
Energy: 1.245521116573508
Energy: 1.244656355422653
Energy: 1.2442423615391114
Energy: 1.2947530731822674
Energy: 1.249122778468584
Energy: 1.2377750452389729
Energy: 1.2528784490806515
Energy: 1.2530387932305223
Energy: 1.2474634836334455
Energy: 1.3137105910655542
Energy: 1.2669623548344546
Energy: 1.263185696765529
Energy: 1.253858204418079
Energy: 1.2806951985184694
Energy: 1.2605169027372818
Energy: 1.3137787358658968
Energy: 1.2472305342467067
Energy: 1.2480082197323041
Energy: 1.2475416371270152
Energy: 1.2362507555703175
Energy: 1.2693890640453966
Energy: 1.3023307433571232
Energy: 1.2679820111000952
Energy: 1.2658956249608706
Energy: 1.278499909267074
Energy: 1.2726717836485344
Energy: 1.265601624326409
Energy: 1.3594894727324869
Energy: 1.2736110692762133
Energy: 1.272033537862513
Energy: 1.2616306520394835
Energy: 1.2500855742800487
Energy: 1.2575818213029233
Energy: 1.3564649409618865
Energy: 1.2585799589280813
Energy: 1.2636623441975647
Energy: 1.2603533187493545
Energy: 1.2577284511335944
Energy: 1.2633579527581449
Energy: 1.3020565736825744
Energy: 1.2647480983936767
Energy: 1.2638336193112707
Energy: 1.2773213244417219
Energy: 1.267001872100235
Energy: 1.266548554672937
Energy: 1.2843096118577602
Energy: 1.2589953844218011
Energy: 1.2581197451996369
Energy: 1.2634009832880597
Energy: 1.2630567386289604
Energy: 1.2499788432246512
Energy: 1.2440432382172588
Energy: 1.2599660746095545
Energy: 1.2756270411707358
Energy: 1.2423121685756922
Energy: 1.2532680902776283
Energy: 1.2797778005902294
Energy: 1.2717959245981214
Energy: 1.2397922720021048
Energy: 1.2494943975067598
Energy: 1.2534340967288813
Energy: 1.266314186366077
Energy: 1.249936230132624
Energy: 1.2703729015397205
Energy: 1.2494283078914974
Energy: 1.2473828125339066
Energy: 1.272812309843748
Energy: 1.2513256609969072
Energy: 1.247632022576698
Energy: 1.2416641867292957
Energy: 1.2494608756476304
Energy: 1.2477030412680334
Energy: 1.2444942028031252
Energy: 1.2515814671544352
Energy: 1.2465065391300463
Energy: 1.4131851702684317
Energy: 1.2392933398966457
Energy: 1.2392995660506048
Energy: 1.2597130193579926
Energy: 1.2462977921489848
Energy: 1.2492792151214156
Energy: 1.2343990458889273
Energy: 1.247037576096871
Energy: 1.2431534949056593
Energy: 1.235368119021139
Energy: 1.246330823790034
Energy: 1.2505114550607088
Energy: 1.3062885481762287
Energy: 1.2373136257387323
Energy: 1.252977494289908
Energy: 1.2455838428866146
Energy: 1.255726724431958
Energy: 1.2536711192379413
Energy: 1.2668376217570883
Energy: 1.2502591522761441
Energy: 1.2508803775531816
Energy: 1.2599055916864865
Energy: 1.2494675685440395
Energy: 1.2497669969383471
Energy: 1.3650278452728832
Energy: 1.2705400979636874
Energy: 1.2834603700775737
Energy: 1.2337492352731807
Energy: 1.2775262261339146
Energy: 1.2368248656367915

minimum gb energy = 1.2327067339732167 eV
minimum distance =  2.24988342501655 Angstroms
sigma value = 19


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

Energy: 1.2941974446211866
Energy: 1.2578039808772874
Energy: 1.2662712628961623
Energy: 1.2286700099997228
Energy: 1.2580525755488956
Energy: 1.2663369950980998
Energy: 1.2891292859421641
Energy: 1.2249722154406775
Energy: 1.2184781308219883
Energy: 1.2168315350304293
Energy: 1.231081189588517
Energy: 1.2182626833081314
Energy: 1.2791398590074348
Energy: 1.2186211010795989
Energy: 1.2206154385776973
Energy: 1.2233292168663183
Energy: 1.2159246675046114
Energy: 1.223812982398886
Energy: 1.2753880840721805
Energy: 1.21920134183843
Energy: 1.2193432684716219
Energy: 1.225150220650657
Energy: 1.2184357984867653
Energy: 1.2180316118848102
Energy: 1.2263359916493883
Energy: 1.228099659780558
Energy: 1.2268890983504475
Energy: 1.2311830229086442
Energy: 1.2237834997070016
Energy: 1.2212119210140349
Energy: 1.2562078575144364
Energy: 1.220166028202683
Energy: 1.2195848471455515
Energy: 1.2433647929327396
Energy: 1.2211467880388753
Energy: 1.2183249773164044
Energy: 1.2281223283654203
Energy: 1.216045692699166
Energy: 1.2162154718163876
Energy: 1.2187823237490432
Energy: 1.217035123188346
Energy: 1.2201420587184526
Energy: 1.2610960683840051
Energy: 1.2199469882159428
Energy: 1.2181989167302354
Energy: 1.2382542367469982
Energy: 1.2140961989174281
Energy: 1.2207168920118072
Energy: 1.20761318354699
Energy: 1.2260174778053907
Energy: 1.2207244175681717
Energy: 1.2180565609348413
Energy: 1.2211723135416221
Energy: 1.2232798220237366
Energy: 1.2087190620091866
Energy: 1.227370225746045
Energy: 1.228217044995681
Energy: 1.214953335560878
Energy: 1.2216574689119668
Energy: 1.2266504187688705
Energy: 1.2749000298028421
Energy: 1.201354474931071
Energy: 1.203819822395965
Energy: 1.220425005987452
Energy: 1.1974219864311089
Energy: 1.205764405459189
Energy: 1.2730346617605708
Energy: 1.2030344893604519
Energy: 1.2027859700567942
Energy: 1.2054925908181178
Energy: 1.1956976911240729
Energy: 1.202513824886267
Energy: 1.2547099123667969
Energy: 1.2156466158497472
Energy: 1.2251635722327796
Energy: 1.2080932804072098
Energy: 1.2176760006241445
Energy: 1.2232235615781895
Energy: 1.3152967844345256
Energy: 1.2401539723366313
Energy: 1.2206738206019063
Energy: 1.1920560619079306
Energy: 1.2327123906146449
Energy: 1.220318479635479
Energy: 1.2711061980695737
Energy: 1.1966635346521435
Energy: 1.2060478955774436
Energy: 1.1981608032135598
Energy: 1.1930108859763573
Energy: 1.2054766108526922
Energy: 1.2718274130435843
Energy: 1.2001617050246547
Energy: 1.2007751395085289
Energy: 1.202816052721877
Energy: 1.1927326625412837
Energy: 1.2005938350379532
Energy: 1.2265848423304648
Energy: 1.227654053326217
Energy: 1.2369874947950514
Energy: 1.1855970112811025
Energy: 1.2348737051894527
Energy: 1.2360162884093244
Energy: 1.275409007519041
Energy: 1.2041741812241158
Energy: 1.2036137063760193
Energy: 1.1880342644969206
Energy: 1.2040521962240731
Energy: 1.2016819891479766
Energy: 1.2725171176877343
Energy: 1.1988367227788137
Energy: 1.2009138460863038
Energy: 1.2035411478423719
Energy: 1.1880438716516482
Energy: 1.23528614391864
Energy: 1.2459414169887422
Energy: 1.1991825501300397
Energy: 1.1988580630028125
Energy: 1.2100605207228783
Energy: 1.1889814923351032
Energy: 1.234294832289375
Energy: 1.1896706949617228
Energy: 1.2048936637985748
Energy: 1.2047793113018574
Energy: 1.1920708235117172
Energy: 1.2044915630389592
Energy: 1.203203479506821
Energy: 1.18366027943196
Energy: 1.205981532740661
Energy: 1.2050702625589997
Energy: 1.1865340766159755
Energy: 1.2063388085120188
Energy: 1.2034385312563047
Energy: 1.244360450507027
Energy: 1.192815349936295
Energy: 1.1999464907458837
Energy: 1.2222467089016866
Energy: 1.181616837107608
Energy: 1.2129340200146264
Energy: 1.2778364291906628
Energy: 1.1957091507079207
Energy: 1.2018366650800283
Energy: 1.2561629003411503
Energy: 1.182006666481839
Energy: 1.2030160742188267
Energy: 1.2709299549374895
Energy: 1.2060859806800694
Energy: 1.205648737059626
Energy: 1.194486715304965
Energy: 1.2034627402330138
Energy: 1.2036010307739873
Energy: 1.227286893150142
Energy: 1.2232623340194073
Energy: 1.2213893993153977
Energy: 1.211197431665273
Energy: 1.2285019878264207
Energy: 1.2224191039950805
Energy: 1.2790682448109143
Energy: 1.2178182893699656
Energy: 1.2205085376733014
Energy: 1.219307420674502
Energy: 1.2171877099570068
Energy: 1.222252660133317
Energy: 1.2774753102868506
Energy: 1.2174784698286751
Energy: 1.2185987659814943
Energy: 1.226962284158035
Energy: 1.2164657977223556
Energy: 1.2190651090862872
Energy: 1.280218945578851
Energy: 1.2697484863601642
Energy: 1.2802935290946535
Energy: 1.1734927023299735
Energy: 1.27154343178465
Energy: 1.2227254483868806

minimum gb energy = 1.1734927023299735 eV
minimum distance =  2.25093820785438 Angstroms
sigma value = 101


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

Energy: 1.7692900579606405
Energy: 1.1667994503227792
Energy: 1.1805590345848844
Energy: 1.113849375505121
Energy: 1.1791017424008785
Energy: 1.1772484132038998
Energy: 1.3646078120052725
Energy: 1.1517250310090459
Energy: 1.154008844161764
Energy: 1.149325881442021
Energy: 1.1542170433991894
Energy: 1.1544169795672454
Energy: 1.2641532672400086
Energy: 1.1569536251718262
Energy: 1.163594502655549
Energy: 1.1788935561846798
Energy: 1.1513414160846562
Energy: 1.179333934811344
Energy: 1.2388925067560186
Energy: 1.1569899140558235
Energy: 1.18207463828955
Energy: 1.1776097643770442
Energy: 1.15300577728406
Energy: 1.1786281909697722
Energy: 1.1628960981531513
Energy: 1.1791026497119375
Energy: 1.1795960302113162
Energy: 1.1679235482517487
Energy: 1.1789490655916761
Energy: 1.1797318461562416
Energy: 1.1754930376460941
Energy: 1.1755788040401554
Energy: 1.177570245493077
Energy: 1.1427863775212004
Energy: 1.156591826277416
Energy: 1.178365564084044
Energy: 1.2345476557461013
Energy: 1.1477573068626992
Energy: 1.1462058934506631
Energy: 1.1906980995061323
Energy: 1.1439121311394718
Energy: 1.1763210162877036
Energy: 1.1419905129369536
Energy: 1.151139813125566
Energy: 1.1535414520694744
Energy: 1.186834506019241
Energy: 1.149630540903488
Energy: 1.15403918701251
Energy: 1.1435022430758461
Energy: 1.1736784165500942
Energy: 1.168243158921739
Energy: 1.1478320832086337
Energy: 1.1735271641799387
Energy: 1.1649618766394292
Energy: 1.1411599193388489
Energy: 1.147824315269638
Energy: 1.164267882660172
Energy: 1.1488164468652398
Energy: 1.1914727856532723
Energy: 1.1668125320633176
Energy: 1.2548711528251468
Energy: 1.1105263750540428
Energy: 1.1109782560380752
Energy: 1.1755590991655631
Energy: 1.1159782799529605
Energy: 1.1726220388033612
Energy: 1.2617533468666937
Energy: 1.1628544496193212
Energy: 1.1659825133203565
Energy: 1.1667596613386613
Energy: 1.1486057878534348
Energy: 1.1656596477778403
Energy: 1.1742679209161184
Energy: 1.1734832410997806
Energy: 1.173804728120174
Energy: 1.1387288591241713
Energy: 1.1744235104154337
Energy: 1.1673924121792174
Energy: 1.1745327466256603
Energy: 1.170606152834409
Energy: 1.1631928780918783
Energy: 1.1450032917443678
Energy: 1.169253854195921
Energy: 1.1758985811859735
Energy: 1.2621204651518219
Energy: 1.1550374068647438
Energy: 1.1639454646812333
Energy: 1.1780275141170895
Energy: 1.1497642313290144
Energy: 1.1740159049037218
Energy: 1.2621188857477699
Energy: 1.1559862211129595
Energy: 1.1773241976658062
Energy: 1.1717637467339668
Energy: 1.1542144499348448
Energy: 1.1785080921511026
Energy: 1.179552013062234
Energy: 1.1919351422934288
Energy: 1.1822400671340492
Energy: 1.1104071917293605
Energy: 1.1929433350659102
Energy: 1.1079287142826144
Energy: 1.3029944564845444
Energy: 1.173148901845161
Energy: 1.1812465459386985
Energy: 1.1803255549333886
Energy: 1.173194315296304
Energy: 1.180362425420955
Energy: 1.2621625160543166
Energy: 1.1556520872899572
Energy: 1.1631576023964578
Energy: 1.1759949681224902
Energy: 1.1480103793401149
Energy: 1.152259222557346
Energy: 1.2424628354655038
Energy: 1.1510043106321628
Energy: 1.1533874133322732
Energy: 1.173909309171062
Energy: 1.1484794906872888
Energy: 1.1537539613592374
Energy: 1.1660450932308033
Energy: 1.173716841280393
Energy: 1.1750023897229915
Energy: 1.171768844781545
Energy: 1.1731519497525835
Energy: 1.176651210017555
Energy: 1.2050726502062503
Energy: 1.1514991436047
Energy: 1.1546790536685314
Energy: 1.1702676678777815
Energy: 1.1520090733411303
Energy: 1.1564373770658025
Energy: 1.202207296484245
Energy: 1.1441514243802058
Energy: 1.1445606310531868
Energy: 1.182933973398202
Energy: 1.1477322947897381
Energy: 1.143818042314675
Energy: 1.2221422291674486
Energy: 1.1461799609857397
Energy: 1.1432117529645258
Energy: 1.189861955129173
Energy: 1.1504301731567965
Energy: 1.1838822338918389
Energy: 1.1520430323782915
Energy: 1.1510396506945073
Energy: 1.1528049501104076
Energy: 1.1541814166616602
Energy: 1.1728945041028298
Energy: 1.1532494117029375
Energy: 1.1440217863596247
Energy: 1.1564503355816722
Energy: 1.1623920457460175
Energy: 1.1486051323467352
Energy: 1.159420034791488
Energy: 1.1757489780561028
Energy: 1.186526395095464
Energy: 1.1113800834390979
Energy: 1.1117214555858532
Energy: 1.1476489319543794
Energy: 1.114969090653483
Energy: 1.1120330661921647
Energy: 1.262020247857392
Energy: 1.1139095961923455
Energy: 1.114346261014981
Energy: 1.1780183680155691
Energy: 1.1122860339462466
Energy: 1.17785552928152
Energy: 1.1734153721349538
Energy: 1.178221011322869
Energy: 1.1748039912491457
Energy: 1.1435369600223897
Energy: 1.1462777105502073
Energy: 1.1680836721724677
Energy: 1.1766701749421948
Energy: 1.1487383237156368
Energy: 1.177741989968267
Energy: 1.144160422152037
Energy: 1.14879504968714
Energy: 1.1775625975464112
Energy: 1.261204483484027
Energy: 1.153545379898162
Energy: 1.1731469686331764
Energy: 1.1602258110989567
Energy: 1.1483510287375884
Energy: 1.1772273442390626
Energy: 1.2624220590475346
Energy: 1.1491706989331214
Energy: 1.15572169124175
Energy: 1.1757909447454544
Energy: 1.152699713734564
Energy: 1.1571080237051428
Energy: 1.1815996867608982
Energy: 1.1520190193629218
Energy: 1.1654623223187635
Energy: 1.1083821456134264
Energy: 1.1444281810101384
Energy: 1.1816705969618515

minimum gb energy = 1.1079287142826144 eV
minimum distance =  2.25372401020938 Angstroms
sigma value = 33


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

Energy: 0.020482217370141664
Energy: 1.1541583858113447
Energy: 0.021362212843545364
Energy: 0.023065235774709907
Energy: 1.1537160470331194
Energy: 0.021305698138670434
Energy: 0.6104046536135003
Energy: 0.1607471368025036
Energy: 0.15834528956173607
Energy: 0.1600408709952779
Energy: 0.1611861222178349
Energy: 0.15817781885247414
Energy: 1.6099548489257385
Energy: 1.1555218356598347
Energy: 1.1531654623401992
Energy: 1.1495614331428203
Energy: 1.152993789425007
Energy: 1.1525571593218393
Energy: 0.02129933799557585
Energy: 0.1607471368025036
Energy: 0.1583452895631394
Energy: 0.1600408709948101
Energy: 0.16118612221689935
Energy: 0.15817781885294194

minimum gb energy = 0.020482217370141664 eV
minimum distance =  2.45667626683306 Angstroms
sigma value = 1