Model name: model_name=EAM_Dynamo_MendelevKramerBecker_2008_Cu__MO_945691923444_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.639087498188019
cohesive_energy=3.283374415420919
mass=63.546
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=[1.6525650891392998e-19, 2.0798976409597799e-19, 2.4851361769973997e-19, 2.83413831318162e-19, 3.1394971578556796e-19, 3.3924007395325803e-19, 3.60683606022714e-19, 3.8026060231356e-19, 3.9913904959198197e-19, 4.17573693942786e-19, 4.35237691332636e-19, 4.51512601580808e-19, 4.65839265042036e-19, 4.77964537808148e-19, 4.88035820129472e-19, 4.96532162819574e-19, 5.03874938333196e-19, 5.1016187944501195e-19, 5.1534812520927e-19, 5.19412847329728e-19, 5.224121219885759e-19, 5.2444848849039e-19, 5.256292926696479e-19, 5.260138150618079e-19, 5.25630894846282e-19, 5.24353960068984e-19, 5.21713572976152e-19, 5.1724029581402395e-19, 5.105624236035119e-19, 5.01306649188894e-19, 4.89117289357422e-19, 4.737187697280479e-19, 4.5501015317283e-19, 4.3304591369732395e-19, 4.0780842735855595e-19, 3.7909101337073997e-19, 3.46437051393186e-19, 3.0905186181543e-19, 2.65805910110502e-19, 2.15071384818258e-19, 1.5442339160313898e-19, 8.140178824363799e-20, -7.5836627705439e-21, -1.21445789945517e-19, -2.80119756158658e-19, -5.28636578211666e-19, -9.752625410587739e-19, -1.88686740009546e-18, -3.8359312971228e-18, -7.8321603664773e-18, -1.6872361914990598e-17, -4.06621214472762e-17, -1.182105146684808e-16, -4.6718669559123e-16]
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: 0.0124954839721851
Energy: 0.013333996175945169
Energy: 0.012938116645384417
Energy: 0.012694263560315274
Energy: 0.5607271441200369
Energy: 0.01290641402377872
Energy: 0.013333996175945169
Energy: 0.10651900788182887
Energy: 0.10641840370573807
Energy: 0.10642844344548892
Energy: 0.10653216063559799
Energy: 0.1065519765230946
Energy: 0.012938116645384417
Energy: 0.10641840370453459
Energy: 0.10768929322795462
Energy: 0.013000427397059996
Energy: 0.10649272722283236
Energy: 0.10722637394721028
Energy: 0.012694263562137709
Energy: 0.10642844344397592
Energy: 0.013000427396165972
Energy: 0.012730078924428475
Energy: 0.10659053677853444
Energy: 0.012807408265954112
Energy: 0.5607271441200369
Energy: 0.10653216063497904
Energy: 0.10649272722314182
Energy: 0.1065905367788439
Energy: 0.10638464696224653
Energy: 0.10655357699565919
Energy: 0.01290641402377872
Energy: 0.10655197652216619
Energy: 0.10722637394597241
Energy: 0.012807408265954112
Energy: 0.10655357699627813
Energy: 0.012680652939488168

minimum gb energy = 0.0124954839721851 eV
minimum distance =  2.57048263967439 Angstroms
sigma value = 1


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

Energy: 1.3110597460870794
Energy: 0.8725633137105114
Energy: 0.9028498969608778
Energy: 0.876920868254034
Energy: 0.9090928776920184
Energy: 0.9030321522011262
Energy: 1.3121757179037263
Energy: 0.8366727441883686
Energy: 0.8356050226170032
Energy: 0.8262013019846506
Energy: 0.8233932482522295
Energy: 0.8366713435595102
Energy: 1.3251973826157768
Energy: 0.8663675111596951
Energy: 0.8545193551421842
Energy: 0.8492707759367278
Energy: 0.871156417917989
Energy: 0.838167930698932
Energy: 1.325559069536279
Energy: 0.8494345910018861
Energy: 0.8483567954732922
Energy: 0.8451486764394125
Energy: 0.8708104681639361
Energy: 0.8472108168006565
Energy: 1.3414413438266133
Energy: 0.8373908555365018
Energy: 0.8361980669718072
Energy: 0.8357780867796655
Energy: 0.8541752896569769
Energy: 0.8359369528300469
Energy: 1.2096913090610977
Energy: 0.8536043651850136
Energy: 0.8509199248200249
Energy: 0.8476870478326394
Energy: 0.854056918943191
Energy: 0.8510802925499661
Energy: 1.2101750322412155
Energy: 0.846724469438404
Energy: 0.8475387183531307
Energy: 0.8477544375831294
Energy: 0.8463495315784313
Energy: 0.852495643084529
Energy: 1.2485292298309698
Energy: 0.8492929555769416
Energy: 0.849145287129294
Energy: 0.8549336461829153
Energy: 0.8484534631997865
Energy: 0.8528214894064438
Energy: 0.9343972612863812
Energy: 0.8484451828505534
Energy: 0.8476359024790221
Energy: 0.8536897008587991
Energy: 0.8492890934919883
Energy: 0.8584884275418458
Energy: 0.9335457792366187
Energy: 0.8384877495266642
Energy: 0.8373488860304172
Energy: 0.8536738691100031
Energy: 0.8360287881086068
Energy: 0.8375045380260184
Energy: 0.9914364817245082
Energy: 0.8242514156236388
Energy: 0.8257878852376339
Energy: 0.9028002194778335
Energy: 0.822434241089924
Energy: 0.8544784768520647
Energy: 0.8857566421390779
Energy: 0.8362172213398514
Energy: 0.8476842207863585
Energy: 0.847889223950157
Energy: 0.8500386705086372
Energy: 0.8471170691194347
Energy: 0.8847305577131417
Energy: 0.8352566771602953
Energy: 0.8356186442522608
Energy: 0.8495651993222597
Energy: 0.8356194213136988
Energy: 0.8353187716174989
Energy: 0.8931521617906252
Energy: 0.8438400503406309
Energy: 0.8439633931888663
Energy: 0.8731408970913376
Energy: 0.8437489494982741
Energy: 0.8489818583445305
Energy: 0.893083829790654
Energy: 0.8361916566567322
Energy: 0.8353859481303123
Energy: 0.8704223037114766
Energy: 0.83771024145398
Energy: 0.8375532498079739
Energy: 0.8932774820165075
Energy: 0.8498821443568295
Energy: 0.8605161708894811
Energy: 0.8710024059304501
Energy: 0.849672656458144
Energy: 0.8611226451206206
Energy: 1.105453002553127
Energy: 0.8507839587228083
Energy: 0.8476909757425463
Energy: 0.8604803427883633
Energy: 0.849616283920497
Energy: 0.8530406202022126
Energy: 1.04765385917083
Energy: 0.8506115866376648
Energy: 0.8501688823560024
Energy: 0.8503589609646166
Energy: 0.8518880574682622
Energy: 0.849942258909201
Energy: 1.0471493443539954
Energy: 0.8505853153158557
Energy: 0.8500150061481436
Energy: 0.8494274449081034
Energy: 0.8500378721514614
Energy: 0.8495169870462803
Energy: 1.3270168082930922
Energy: 0.8503821915914345
Energy: 0.8508632268222062
Energy: 0.8490793719787967
Energy: 0.8504032307719219
Energy: 0.8498217836173456
Energy: 1.314632604190475
Energy: 0.8530548500040108
Energy: 0.8397129922938363
Energy: 0.8241179963354488
Energy: 0.8632991307627061
Energy: 0.8397189009338936
Energy: 1.2849872935102906
Energy: 0.8718872178760657
Energy: 0.8592498607717188
Energy: 0.8489853741227347
Energy: 0.8698722578010716
Energy: 0.8515972687889101
Energy: 1.3122673152677224
Energy: 0.8361752944384141
Energy: 0.8355306632814185
Energy: 0.8224654608018164
Energy: 0.8319253929447311
Energy: 0.8364608977396804

minimum gb energy = 0.822434241089924 eV
minimum distance =  2.36834432305259 Angstroms
sigma value = 33


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

Energy: 1.455018241750168
Energy: 0.9014038937103597
Energy: 0.901247783829355
Energy: 0.9032399350322906
Energy: 0.877913786548066
Energy: 0.9011795309549248
Energy: 1.3301724674401054
Energy: 0.8771150759768241
Energy: 0.8678570883576104
Energy: 0.8659741816178337
Energy: 0.8771634697960334
Energy: 0.8652775249966416
Energy: 1.1890809524250006
Energy: 0.8776954502202521
Energy: 0.8666093897780496
Energy: 0.8696931237449085
Energy: 0.8770565537054614
Energy: 0.8652572506341502
Energy: 1.2201757932689767
Energy: 0.8772478120119668
Energy: 0.8773824628094437
Energy: 0.8682616032925428
Energy: 0.8772624378482562
Energy: 0.868404271210748
Energy: 1.3312640776168645
Energy: 0.8803491202752017
Energy: 0.8670164701198885
Energy: 0.8665710227013845
Energy: 0.8798074102207656
Energy: 0.8663891434000772
Energy: 1.1922215024650868
Energy: 0.8792393719519798
Energy: 0.8713078785852332
Energy: 0.871254827664275
Energy: 0.8797336649618589
Energy: 0.8698955366828774
Energy: 1.1939124294651828
Energy: 0.8709368582009525
Energy: 0.8723300166708275
Energy: 0.8723397289969768
Energy: 0.8796724438079334
Energy: 0.8716639058182537
Energy: 1.0928995206771228
Energy: 0.8637889272883105
Energy: 0.8649759242800503
Energy: 0.8794574735767166
Energy: 0.8638948203059054
Energy: 0.863482823654016
Energy: 0.9302540664018779
Energy: 0.8630778554978502
Energy: 0.870611893905081
Energy: 0.8776377395009825
Energy: 0.863753182811867
Energy: 0.8719424136930815
Energy: 0.9304884797207044
Energy: 0.8659054480329114
Energy: 0.8652106525771184
Energy: 0.8789257835523662
Energy: 0.8659628687305748
Energy: 0.8673854865063644
Energy: 0.9583856945786026
Energy: 0.8530729107576529
Energy: 0.8528724960712553
Energy: 0.892286766446666
Energy: 0.8526363028021873
Energy: 0.8525448312406397
Energy: 0.8771865326603286
Energy: 0.8638124288762683
Energy: 0.8655579675937577
Energy: 0.8771855451966504
Energy: 0.8636963884269664
Energy: 0.8659471408186378
Energy: 0.8771127845968124
Energy: 0.8654923379315862
Energy: 0.8663296754142387
Energy: 0.8770964045984
Energy: 0.8658540183903113
Energy: 0.8670616146771262
Energy: 1.0824836744431472
Energy: 0.8681263100696447
Energy: 0.8683399022147157
Energy: 0.8770253377440912
Energy: 0.868204240504581
Energy: 0.8685578240136625
Energy: 0.9296423092935261
Energy: 0.8673610313538355
Energy: 0.8671848690067775
Energy: 0.8793538534072538
Energy: 0.866152275650952
Energy: 0.8671296005930793
Energy: 0.9312263114440468
Energy: 0.8708748152472655
Energy: 0.8701256630241577
Energy: 0.8781714202366601
Energy: 0.8711466770560332
Energy: 0.8698940439428915
Energy: 1.286700833139308
Energy: 0.8709921840915081
Energy: 0.8708181599266327
Energy: 0.880649436220725
Energy: 0.8754129883355958
Energy: 0.8708727803603498
Energy: 0.9881172455879986
Energy: 0.8795546260829193
Energy: 0.8744377178655044
Energy: 0.8642082322454918
Energy: 0.8793840297255692
Energy: 0.8641162746836372
Energy: 0.9880973064780995
Energy: 0.8775323019562826
Energy: 0.8726888175673367
Energy: 0.8636771861687402
Energy: 0.8778953645343838
Energy: 0.871216421865776
Energy: 1.331739927194872
Energy: 0.8774990284493229
Energy: 0.8681124947471147
Energy: 0.8657840218487611
Energy: 0.877388414727201
Energy: 0.8664751844743959
Energy: 1.4550300918519643
Energy: 0.8699037559061091
Energy: 0.8525778092340657
Energy: 0.8536873702943709
Energy: 0.8705830751678288
Energy: 0.8523654993940019
Energy: 1.3302425763514392
Energy: 0.87714902477618
Energy: 0.8693529799138766
Energy: 0.8633747197942772
Energy: 0.8771639558484959
Energy: 0.8662608248299429
Energy: 1.1907919271177663
Energy: 0.8779186757295555
Energy: 0.8673006926224992
Energy: 0.8655581539236922
Energy: 0.8771943385977198
Energy: 0.866358273586212
Energy: 1.2202264739089062
Energy: 0.8696943799460133
Energy: 0.8698627350808751
Energy: 0.8678696026200333
Energy: 0.967941688575813
Energy: 0.8905441714173052
Energy: 1.1909262948559718
Energy: 0.8795455060297911
Energy: 0.8677136413087317
Energy: 0.865861196351318
Energy: 0.8793109857703985
Energy: 0.8659285801578548
Energy: 1.1896489951041613
Energy: 0.876603195067884
Energy: 0.8709085860356041
Energy: 0.8717060245143395
Energy: 0.8768118482619883
Energy: 0.8693216815502527
Energy: 1.190783258931254
Energy: 0.8709349930789778
Energy: 0.8708774318867765
Energy: 0.8707748620294032
Energy: 0.8797538191159503
Energy: 0.8707941625362166
Energy: 1.1910681675028805
Energy: 0.8631567131594878
Energy: 0.8663491813580786
Energy: 0.8783443300724283
Energy: 0.8631690799317568
Energy: 0.8744485977513367
Energy: 0.9303343208152812
Energy: 0.8630209078859227
Energy: 0.8653212880779727
Energy: 0.8784587515168737
Energy: 0.8634566151627199
Energy: 0.8739661578037137
Energy: 0.9311143418980857
Energy: 0.8682076738799556
Energy: 0.8656436370755075
Energy: 0.878364281187182
Energy: 0.8662690232609671
Energy: 0.8655527708024348
Energy: 1.0825352626255085
Energy: 0.8524834068652561
Energy: 0.8523869756316411
Energy: 0.8771355597620775
Energy: 0.8538538236607043
Energy: 0.8525935351786931
Energy: 0.8771666381821281
Energy: 0.8634037003417945
Energy: 0.8667302461527508
Energy: 0.8771791716724792
Energy: 0.8629887206934436
Energy: 0.8717152580799343
Energy: 0.8774151085467147
Energy: 0.8660930756772935
Energy: 0.866259034186477
Energy: 0.8773976617867782
Energy: 0.8659702428676568
Energy: 0.8677213985680592
Energy: 0.8776194318611799
Energy: 0.8679868259628105
Energy: 0.8680245875350603
Energy: 0.8776648139858099
Energy: 0.8684169631243386
Energy: 0.867868859067766
Energy: 0.929457659465802
Energy: 0.8660201401730412
Energy: 0.8661854581330147
Energy: 0.8544349187310873
Energy: 0.865659941708113
Energy: 0.8666719389381379
Energy: 0.9293525658014228
Energy: 0.8703634973515747
Energy: 0.8703609979138575
Energy: 0.8796165550006975
Energy: 0.8721637632562961
Energy: 0.8724823566995978
Energy: 0.9294122975845532
Energy: 0.8709214535562827
Energy: 0.8707800180287351
Energy: 0.8924176592477309
Energy: 0.8708154518560743
Energy: 0.8709973626626902
Energy: 0.9881649652697824
Energy: 0.8722071899582605
Energy: 0.8716625549471452
Energy: 0.8641473352596521
Energy: 0.8772831256541719
Energy: 0.871218668118111
Energy: 0.9880260446005674
Energy: 0.8793417031466952
Energy: 0.8794078405361745
Energy: 0.86407793747959
Energy: 0.8774226755957237
Energy: 0.8637391342968045
Energy: 1.330992597502576
Energy: 0.8774141523994834
Energy: 0.8903162852674987
Energy: 0.8660650183359206
Energy: 0.8775596498155989
Energy: 0.8646875787928314
Energy: 1.3319219484828884
Energy: 0.8774168865089227
Energy: 0.8526601471358329
Energy: 0.862861472654628
Energy: 0.8771264319346987
Energy: 0.8529627483612937

minimum gb energy = 0.8523654993940019 eV
minimum distance =  2.36373945350728 Angstroms
sigma value = 51


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

Energy: 1.3619770256300816
Energy: 0.9866861499150456
Energy: 0.9871151599879319
Energy: 0.9075916048042371
Energy: 1.0043046755114415
Energy: 0.9065835050162118
Energy: 1.281142802490758
Energy: 0.898971048021899
Energy: 0.8969819423221133
Energy: 0.8566706805652655
Energy: 0.899005219613848
Energy: 0.8954963233820398
Energy: 1.2342959260602069
Energy: 0.8990699321328357
Energy: 0.891383144332156
Energy: 0.882125888280798
Energy: 0.8994816522117269
Energy: 0.8827729921263092
Energy: 1.2296565182766925
Energy: 0.8991882957182382
Energy: 0.887973431495916
Energy: 0.8768777636126638
Energy: 0.8989598808443914
Energy: 0.8771044760371614
Energy: 1.1383162829568292
Energy: 0.9023066519128594
Energy: 0.9025537861335882
Energy: 0.9170373113858373
Energy: 0.9021938484109866
Energy: 0.8578113068485707
Energy: 1.0186879478965094
Energy: 0.9016766060805929
Energy: 0.9023699083825393
Energy: 0.9020630219716806
Energy: 0.9017195880392619
Energy: 0.9011137511276022
Energy: 1.0188740487828816
Energy: 0.8560364863927825
Energy: 0.8564926451331786
Energy: 0.900958152995484
Energy: 0.8560156264158638
Energy: 0.9017291172715962
Energy: 1.017431158949293
Energy: 0.858660712050644
Energy: 0.8585565131051935
Energy: 0.8983857750938389
Energy: 0.8583522184153722
Energy: 0.8580367417290459
Energy: 0.8986020919084517
Energy: 0.8581110962344195
Energy: 0.8579691444477141
Energy: 0.8984550321288948
Energy: 0.8584424948876183
Energy: 0.8819102891012529
Energy: 0.898612751658456
Energy: 0.8730008580250855
Energy: 0.8811849456897074
Energy: 0.8987271172750577
Energy: 0.8730537720824905
Energy: 0.8957737166044939
Energy: 0.8997101485124164
Energy: 0.8865173555952323
Energy: 0.8869838682007493
Energy: 0.8997393063169111
Energy: 0.8837735382294855
Energy: 0.8867981369684687
Energy: 0.912134083606208
Energy: 0.8725326052448638
Energy: 0.8734084691327754
Energy: 0.8748400451767762
Energy: 0.866384013534334
Energy: 0.8955687370228428
Energy: 0.9115915528791971
Energy: 0.8749218246300536
Energy: 0.8742457983355585
Energy: 0.8888920371815595
Energy: 0.8839449636740432
Energy: 0.8893740780951497
Energy: 0.9120853322170756
Energy: 0.8785777722012045
Energy: 0.8791060185924925
Energy: 0.9078594462317164
Energy: 0.8785403240211804
Energy: 0.8792201404732773
Energy: 1.0933984751381958
Energy: 0.8914228995825404
Energy: 0.8917630628471009
Energy: 0.8908936584360966
Energy: 0.8925346900642064
Energy: 0.8803923693106467
Energy: 1.0933111495025656
Energy: 0.8914380075677681
Energy: 0.8915082592203796
Energy: 0.8985545163721393
Energy: 0.8915929822653068
Energy: 0.8909964332217856
Energy: 1.1390576497571847
Energy: 0.8924478250644705
Energy: 0.8912525226266673
Energy: 0.9012366250707876
Energy: 0.8923131307363543
Energy: 0.8710419747281964
Energy: 1.3651254740975844
Energy: 0.8994693792277991
Energy: 0.9080225446493704
Energy: 0.8587151742780919
Energy: 0.8993229634353003
Energy: 0.8105353109176923

minimum gb energy = 0.8105353109176923 eV
minimum distance =  2.35167374057167 Angstroms
sigma value = 19


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

Energy: 1.140795733231711
Energy: 0.8338208146884052
Energy: 0.8338461929145856
Energy: 0.9601721378994139
Energy: 0.8093643598824246
Energy: 0.9593620107216454
Energy: 1.1442661191004628
Energy: 0.809720976495552
Energy: 0.8097401853263163
Energy: 0.840591192907525
Energy: 0.8099480466105157
Energy: 0.8097147068102325
Energy: 0.9685753996635676
Energy: 0.8096150877819692
Energy: 0.8096939211899606
Energy: 0.8405200073818186
Energy: 0.8096909861677218
Energy: 0.8096932737880791
Energy: 0.9632712415721324
Energy: 0.809456875637427
Energy: 0.8095597446911057
Energy: 0.8386617099053842
Energy: 0.8095610931093548
Energy: 0.8095510380207844
Energy: 0.9682027088070982
Energy: 0.8094345677594527
Energy: 0.8408675110608201
Energy: 0.8408569720621798
Energy: 0.8094189876371048
Energy: 0.8402738641847047
Energy: 0.968745928737732
Energy: 0.7853754446486741
Energy: 0.8397454730181096
Energy: 0.8411862830876691
Energy: 0.7852727359866357
Energy: 0.8406896421749109
Energy: 0.9683671450604988
Energy: 0.8405738527491342
Energy: 0.8404743800947981
Energy: 0.8409942634443701
Energy: 0.7934349312652677
Energy: 0.8407446613107477
Energy: 0.9224176608645811
Energy: 0.7855345755834289
Energy: 0.7853103227965633
Energy: 0.8094246453309459
Energy: 0.7855071897173447
Energy: 0.7855361616274716
Energy: 0.8099170175258529
Energy: 0.7854768267019775
Energy: 0.7856175069181872
Energy: 0.809869814375988
Energy: 0.7854277633455198
Energy: 0.7855637899611436
Energy: 0.8094810144641813
Energy: 0.8096056108827936
Energy: 0.8096669838602306
Energy: 0.8095836777273201
Energy: 0.8409558294834106
Energy: 0.8098404431247661
Energy: 0.8097058120737372
Energy: 0.8803404327218242
Energy: 0.8382608872529975
Energy: 0.8096134560537592
Energy: 0.8807583091637627
Energy: 0.8097014347375551
Energy: 0.9693190295885813
Energy: 0.8404774728316561
Energy: 0.8405266106492393
Energy: 0.8096821962078016
Energy: 0.8405113494515781
Energy: 0.8096594244672398
Energy: 0.7852140878746376
Energy: 0.8406580477777079
Energy: 0.8406356275980167
Energy: 0.7852629006591755
Energy: 0.8409425947356086
Energy: 0.8407334645619218
Energy: 0.970954496955267
Energy: 0.8407478619749893
Energy: 0.8413407323747648
Energy: 0.8098439363424396
Energy: 0.8411041029319646
Energy: 0.8411054995256618
Energy: 1.1429922624930389
Energy: 0.809664541709256
Energy: 0.8095429256681862
Energy: 0.7854899112492374
Energy: 0.8097706984153282
Energy: 0.7857298956709805
Energy: 1.1434191947790484
Energy: 0.80962945708335
Energy: 0.7856006683401809
Energy: 0.7856020676207726
Energy: 0.8093360702828164
Energy: 0.7854556415327946
Energy: 0.9683733656623151
Energy: 0.8098465880931518
Energy: 0.8097964249822988
Energy: 0.8408725617987641
Energy: 0.8095557063131431
Energy: 0.8097495367174746
Energy: 0.9628320994345931
Energy: 0.809531682445327
Energy: 0.8095478479090894
Energy: 0.8388041019629452
Energy: 0.8094851704419982
Energy: 0.8095765693550292
Energy: 0.9627838418309229
Energy: 0.8096750650266206
Energy: 0.8095799141347211
Energy: 0.8580608255624099
Energy: 0.8095434175341713
Energy: 0.8097245530709314
Energy: 0.9697762948451908
Energy: 0.7853568684704462
Energy: 0.8407186894792853
Energy: 0.8408635597431665
Energy: 0.7852895263874203
Energy: 0.8395394036616409
Energy: 0.9672979985174284
Energy: 0.8406156734748177
Energy: 0.8410971650527582
Energy: 0.8422176987106027
Energy: 0.8095002921785689
Energy: 0.8410372768038259
Energy: 0.9688552471160872
Energy: 0.8407604245003227
Energy: 0.8404115214091736
Energy: 0.8411313763350767
Energy: 0.8406636362957229
Energy: 0.8404273745455895
Energy: 0.9225686600144981
Energy: 0.785476766996603
Energy: 0.7855823128520555
Energy: 0.9220069193000735
Energy: 0.7852322602192756
Energy: 0.7857012660322485
Energy: 0.809979464423137
Energy: 0.8097590214328563
Energy: 0.8097087990008413
Energy: 0.8095672827810605
Energy: 0.827322551175827
Energy: 0.8097848691026472
Energy: 0.8097931581300637
Energy: 0.809785460976206
Energy: 0.8097514504733047
Energy: 0.8097400570434976
Energy: 0.8408638066549418
Energy: 0.8097885663122477
Energy: 0.9228525019507435
Energy: 0.8384459684059231
Energy: 0.8380500269611643
Energy: 0.8094974046338691
Energy: 0.8383518768579309
Energy: 0.8095399387201178
Energy: 0.9693201007446648
Energy: 0.8406701903562108
Energy: 0.8403993417496902
Energy: 0.8093103554884491
Energy: 0.840863413794163
Energy: 0.8402939571718037
Energy: 0.7852830749445319
Energy: 0.8407879855091661
Energy: 0.841133220468637
Energy: 0.7853069177038242
Energy: 0.8409369618268316
Energy: 0.8391084741194599
Energy: 0.9227532301712754
Energy: 0.8407309338878507
Energy: 0.841280231467865
Energy: 0.7934651998738835
Energy: 0.8409755811595002
Energy: 0.8397556980427023
Energy: 1.1434585036779126
Energy: 0.8094955838639581
Energy: 0.7855595433006983
Energy: 0.7858856688258121
Energy: 0.8093624610459567
Energy: 0.7854982131546201

minimum gb energy = 0.7852140878746376 eV
minimum distance =  2.39731976543525 Angstroms
sigma value = 27


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

Energy: 0.9691619577012136
Energy: 0.9671897253824241
Energy: 0.9700885522120015
Energy: 0.8700168823179334
Energy: 0.8323258455114028
Energy: 0.968075444101868
Energy: 0.781425479220319
Energy: 0.8327216536039624
Energy: 0.8326700914662601
Energy: 0.8059551867125173
Energy: 0.8327132192886553
Energy: 0.8327345573780592
Energy: 0.87923309146191
Energy: 0.8327572725681517
Energy: 0.8327372855742052
Energy: 0.8048772825909564
Energy: 0.8327731182865081
Energy: 0.8330553261799374
Energy: 0.7813410194920822
Energy: 0.8328505338334257
Energy: 0.792120385881496
Energy: 0.822955394364147
Energy: 0.8328435206505183
Energy: 0.7919821446063986
Energy: 0.9702024988691755
Energy: 0.7792430007871449
Energy: 0.7907955774954227
Energy: 0.8328653461170474
Energy: 0.7785143078201133
Energy: 0.7926367744228802
Energy: 0.8339916495521359
Energy: 0.8713440508691133
Energy: 0.7795389320856612
Energy: 0.8344233612095064
Energy: 0.8711877037213352
Energy: 0.7794513820097252
Energy: 0.8331473978634882
Energy: 0.7924708829722138
Energy: 0.7918386281659562
Energy: 0.8326884910561553
Energy: 0.792561390520841
Energy: 0.7922494818038267
Energy: 0.880409554094152
Energy: 0.7888445425794005
Energy: 0.78648412284879
Energy: 0.8334232407904887
Energy: 0.7887841791384996
Energy: 0.8305352726499386
Energy: 0.8794609417705443
Energy: 0.786748517450368
Energy: 0.7918055821477328
Energy: 0.8326849416820147
Energy: 0.7889577745117081
Energy: 0.7917992872710241
Energy: 0.8802631568679171
Energy: 0.8194483809358254
Energy: 0.8197693850924634
Energy: 0.8348397258052367
Energy: 0.8204146600726605
Energy: 0.8211884593658257
Energy: 0.8794207507751597
Energy: 0.8325910801814568
Energy: 0.8332909759799682
Energy: 0.8339824441544963
Energy: 0.8310194501819348
Energy: 0.8363056026918168
Energy: 0.9716365692794381
Energy: 0.8335531205917601
Energy: 0.7919687877785836
Energy: 0.8054929141333664
Energy: 0.833146161704996
Energy: 0.7918238675720086

minimum gb energy = 0.7785143078201133 eV
minimum distance =  2.38173116536601 Angstroms
sigma value = 9


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

Energy: 1.4431563763734292
Energy: 0.8627255138674026
Energy: 0.8260805596766653
Energy: 1.182169248887992
Energy: 1.0052467118085826
Energy: 0.9801389660387603
Energy: 0.6972971424059691
Energy: 0.7312370434018544
Energy: 0.7315149424493953
Energy: 0.7220653705208768
Energy: 0.7314554452295857
Energy: 0.7189283979873125
Energy: 0.7506734838046988
Energy: 0.7325748797510936
Energy: 0.7321110542470348
Energy: 0.7461135846380302
Energy: 0.732514118208684
Energy: 0.7438898704216643
Energy: 0.7504786778593452
Energy: 0.700716355399878
Energy: 0.7456580846694663
Energy: 0.7316885658545329
Energy: 0.7282263965548211
Energy: 0.7303025858748139
Energy: 1.0083007614979358
Energy: 0.71287798806087
Energy: 0.7003428963316438
Energy: 0.7557863787617178
Energy: 0.7239007169846876
Energy: 0.7042154280896137
Energy: 0.7556181748388462
Energy: 0.7151658333507197
Energy: 0.6949396639831122
Energy: 0.7556305922634219
Energy: 0.7139173772492525
Energy: 0.7765137750985266
Energy: 0.7554258768744938
Energy: 0.7039384879782856
Energy: 0.7035407126819835
Energy: 0.7564415575690867
Energy: 0.7035581946773917
Energy: 0.7557768272646479
Energy: 0.755765122388269
Energy: 0.7373068307611853
Energy: 0.7041031262331708
Energy: 0.7556517551846379
Energy: 0.730260255781118
Energy: 0.7722099927712219
Energy: 1.0263093868162565
Energy: 0.7402365395970241
Energy: 0.753194864274616
Energy: 0.7634997245265326
Energy: 0.7406724301604234
Energy: 0.7323918779488958
Energy: 0.697275704100931
Energy: 0.7308082114340888
Energy: 0.781347655957635
Energy: 0.7181089369612672
Energy: 0.740451936741284
Energy: 0.6924470178373127
Energy: 0.6972216334723158
Energy: 0.7554553431434765
Energy: 0.7555169684564701
Energy: 0.7295295608167224
Energy: 0.7556516584641813
Energy: 0.7018141186822743
Energy: 0.8877712462182326
Energy: 0.7554072713559568
Energy: 0.7553414792750497
Energy: 0.717110329624948
Energy: 0.755540226048617
Energy: 0.7843648680430447
Energy: 1.275150807064948
Energy: 0.7633255350005527
Energy: 0.8107089655944643
Energy: 0.7589576808105561
Energy: 0.8433479732778716
Energy: 0.7573316360330767
Energy: 0.8875282079302538
Energy: 0.7554088819194208
Energy: 0.7480289782937054
Energy: 0.7181958959332597
Energy: 0.755783816213129
Energy: 0.7482977305221898
Energy: 0.7312372386451406
Energy: 0.7430769410984269
Energy: 0.7418771302783009
Energy: 0.7317146375295955
Energy: 0.7415846720463453
Energy: 0.7468122048743182
Energy: 0.7312674678418605
Energy: 0.7270948898392351
Energy: 0.7260792665401995
Energy: 0.731619490461391
Energy: 0.7423698230472064
Energy: 0.7320853533225856
Energy: 0.7311679938993447
Energy: 0.7017143546153708
Energy: 0.7030429924608078
Energy: 0.7313588316543899
Energy: 0.7149037966541031
Energy: 0.7433556988468659
Energy: 0.8522372408737352
Energy: 0.716552755460282
Energy: 0.7032176097907892
Energy: 0.7324441164550312
Energy: 0.7256309802830471
Energy: 0.7801197728183416
Energy: 0.7512595470707215
Energy: 0.7231383406590848
Energy: 0.7331554487497672
Energy: 0.7319879229787781
Energy: 0.7223795246426639
Energy: 0.7228064601505223
Energy: 0.7499887084110002
Energy: 0.7228727948008219
Energy: 0.7249793812071427
Energy: 0.7220743744151583
Energy: 0.72165385569482
Energy: 0.7205622595076683
Energy: 0.7504833880716218
Energy: 0.7462392845727122
Energy: 0.7428313106499959
Energy: 0.7447399123579966
Energy: 0.7325929830531391
Energy: 0.7239176725096342
Energy: 0.809032601826861
Energy: 0.7318470851803078
Energy: 0.757185991537176
Energy: 0.7236224679806624
Energy: 0.7320175105849063
Energy: 0.6936822567910911
Energy: 0.8093164835802761
Energy: 0.7314704769448096
Energy: 0.7322889633831795
Energy: 0.7235569852278472
Energy: 0.7314022903867735
Energy: 0.7029875547447539
Energy: 0.7499410171495082
Energy: 0.7325362100382978
Energy: 0.732779095819161
Energy: 0.7448912749410348
Energy: 0.7321147993652188
Energy: 0.7451799885499334
Energy: 0.9536408054075308
Energy: 0.6990471660423244
Energy: 0.7608599173271343
Energy: 0.743572305012247
Energy: 0.7317940804577343
Energy: 0.7425676990626294
Energy: 0.7502869911309031
Energy: 0.7167383304576643
Energy: 0.7036024273172048
Energy: 0.7560049154457937
Energy: 0.7167654025495673
Energy: 0.7482516803135102
Energy: 0.700223111474485
Energy: 0.8411913658509296
Energy: 0.7674123125626936
Energy: 0.7002317978337154
Energy: 0.942146625247492
Energy: 0.7831025576667267
Energy: 0.7554539136094133
Energy: 0.7038700396389556
Energy: 0.7044422053196183
Energy: 0.755404670393037
Energy: 0.717156108511275
Energy: 0.7406967513190288
Energy: 0.7556236423602314
Energy: 0.7184190647634796
Energy: 0.701493361042374
Energy: 0.7556586130834476
Energy: 0.7291504924127474
Energy: 0.7557306740526206
Energy: 0.9278101378153955
Energy: 0.7367751650088911
Energy: 0.7011849998031188
Energy: 0.7625800194821737
Energy: 0.7301419034380753
Energy: 0.7002983978624395
Energy: 0.6970961761810635
Energy: 0.7737519937754122
Energy: 0.7363267962652797
Energy: 0.7298712097758774
Energy: 0.7561637399945046
Energy: 0.7416728078755184
Energy: 0.7014714516926362
Energy: 0.7556350908604308
Energy: 0.7558338118939553
Energy: 0.7184200858083382
Energy: 0.7555478906116814
Energy: 0.6938234580636415
Energy: 0.8872394349419744
Energy: 0.7557208714422766
Energy: 0.7557281139549994
Energy: 0.749504937307592
Energy: 0.756264938757158
Energy: 0.772593427905023
Energy: 0.7546764112746126
Energy: 0.7554279404708071
Energy: 0.7554932582645506
Energy: 0.7283394704551813
Energy: 0.7552614107957869
Energy: 0.6959049058631435
Energy: 0.7544188334264658
Energy: 0.7556844557877113
Energy: 0.7485914965316136
Energy: 0.727432628064997
Energy: 0.7556977225245738
Energy: 0.7043028501108929
Energy: 0.7567817758956371
Energy: 0.740622532886524
Energy: 0.7279558367700819
Energy: 0.7509745110380456
Energy: 0.7403866775459914
Energy: 0.7450247901947891
Energy: 0.7331286529053984
Energy: 0.7439588411349352
Energy: 0.7200415357985301
Energy: 0.7323225768683728
Energy: 0.7399982334991431
Energy: 0.7319046366051405
Energy: 0.7317131848146717
Energy: 0.7217259141641647
Energy: 0.7210643638734098
Energy: 0.7315921581165329
Energy: 0.7209971360372709
Energy: 0.732191405118922
Energy: 0.7312617803066681
Energy: 0.7476800477355469
Energy: 0.8172953743895224
Energy: 0.7318378947645384
Energy: 0.761409240154917
Energy: 0.7806027182053645
Energy: 0.7498305726639954
Energy: 0.7216678072680731
Energy: 0.7212698748876186
Energy: 0.7315837347981479
Energy: 0.7210883175216065
Energy: 0.7301600247761645
Energy: 0.7480970517148152
Energy: 0.74199517180594
Energy: 0.7199997465963917
Energy: 0.7186805009071808
Energy: 0.7255844728432688
Energy: 0.7245858058846509
Energy: 0.7510229705987591
Energy: 0.7232713014230531
Energy: 0.7264218432611521
Energy: 0.7300732164774341
Energy: 0.7220130608683987
Energy: 0.7256861968819065
Energy: 0.8093288102063158
Energy: 0.7314388871841281
Energy: 0.7297778260656221
Energy: 0.7235409717244561
Energy: 0.7313616029274251
Energy: 0.7028980522592148

minimum gb energy = 0.6924470178373127 eV
minimum distance =  2.39812561139152 Angstroms
sigma value = 57


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

Energy: 0.586640840353872
Energy: 0.6035385150835216
Energy: 0.37600849055880486
Energy: 0.37477193751561183
Energy: 0.6119988482905903
Energy: 0.5939030306203129
Energy: 0.5877673105958676
Energy: 0.6333307246007165
Energy: 0.6685779092567885
Energy: 0.6712493746295971
Energy: 0.6693374450286987
Energy: 0.6741743050510484
Energy: 0.7653815617144338
Energy: 0.7562153389656748
Energy: 0.7631108397613677
Energy: 0.666423955017835
Energy: 0.783014662054379
Energy: 0.7550549240606638
Energy: 0.7769228190273149
Energy: 0.7538540707741695
Energy: 0.7954494488120626
Energy: 0.7200175404859315
Energy: 0.7675875284333511
Energy: 0.7318228964450882
Energy: 0.7516921185497243
Energy: 0.4932072124945493
Energy: 0.4596681295503785
Energy: 0.7501370319961266
Energy: 0.373229660610242
Energy: 0.7638630738892416
Energy: 0.7626875078854152
Energy: 0.4822857519785356
Energy: 0.4915357426383784
Energy: 0.7577453355401254
Energy: 0.37300378747772633
Energy: 0.42966553122471013
Energy: 0.7792259217960815
Energy: 0.7581925180454039
Energy: 0.7860580333360101
Energy: 0.7792844284514778
Energy: 0.7509471931845614
Energy: 0.7899810882782609
Energy: 0.7748316833891877
Energy: 0.7590675790381352
Energy: 0.7598919668337181
Energy: 0.7793517651516996
Energy: 0.7551375318793457
Energy: 0.7707347164635889
Energy: 0.7488092626334568
Energy: 0.7660218789672382
Energy: 0.7686778398979608
Energy: 0.800736124967423
Energy: 0.7876714610081997
Energy: 0.7924555706370258
Energy: 0.3730233395882629
Energy: 0.7676747880676046
Energy: 0.375084727369916
Energy: 0.37303532684925855
Energy: 0.8300154483583797
Energy: 0.4270330750680544
Energy: 0.37303473230216283
Energy: 0.7570559969404309
Energy: 0.7920577858239825
Energy: 0.37308737329383834
Energy: 0.7493095043296527
Energy: 0.37772715412725577
Energy: 0.7716137726449074
Energy: 0.7913769171199807
Energy: 0.7847091447151772
Energy: 0.7491128966067714
Energy: 0.7611439003369628
Energy: 0.7620386012854202
Energy: 0.8123805520330133
Energy: 0.7892239263857739
Energy: 0.7870639590394138
Energy: 0.7817890926271029
Energy: 0.7769452762168503
Energy: 0.7764137481380994
Energy: 0.8171875160210907
Energy: 0.7617404776873777
Energy: 0.7883225141664028
Energy: 0.744084982598041
Energy: 0.7606689555910573
Energy: 0.7886327445425866
Energy: 0.7905490504952207
Energy: 0.3732773723526574
Energy: 0.4217727858667396
Energy: 0.7736134960862937
Energy: 0.4832824082123561
Energy: 0.5104177328485594
Energy: 0.7666846129938808
Energy: 0.7346507943246143
Energy: 0.7540773702997441
Energy: 0.7554489038536681
Energy: 0.48171954591586935
Energy: 0.7638991760985112
Energy: 0.7495239206218892
Energy: 0.743838430676349
Energy: 0.775385577189124
Energy: 0.7381885829143932
Energy: 0.7702714143800617
Energy: 0.7464532227891335
Energy: 0.7645860193071918
Energy: 0.7499276752567948
Energy: 0.6749080367595399
Energy: 0.6544368727078173
Energy: 0.6460163825831501
Energy: 0.761518399387569
Energy: 0.5878263149394555
Energy: 0.6326316194532793
Energy: 0.6328463348288398
Energy: 0.37312383579178915
Energy: 0.6695873090189252
Energy: 0.6534169696918355

minimum gb energy = 0.37300378747772633 eV
minimum distance =  2.34402613645885 Angstroms
sigma value = 11


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

Energy: 1.143256886371979
Energy: 0.618995612680849
Energy: 0.7304400448731653
Energy: 0.9628024932080628
Energy: 0.723077513955722
Energy: 1.1642206982003462
Energy: 0.7591986388147902
Energy: 0.6283125144782189
Energy: 0.6216923126703126
Energy: 0.6125426079648598
Energy: 0.592306479030312
Energy: 0.6003896250523458
Energy: 0.5929159476438494
Energy: 0.5938780134782752
Energy: 0.5932506186046229
Energy: 0.5942635313201892
Energy: 0.6085715582680535
Energy: 0.6009045440757069
Energy: 0.5927625650729793
Energy: 0.6238624733048997
Energy: 0.5996190768673819
Energy: 0.5938106870723981
Energy: 0.6033283098530867
Energy: 0.6141221860448964
Energy: 0.5928805899099296
Energy: 0.710070652651789
Energy: 0.6473783468226313
Energy: 0.6113721063509886
Energy: 0.6014705257921538
Energy: 0.6022025411184919
Energy: 0.8019523540422979
Energy: 0.6722269243394665
Energy: 0.6501252178277585
Energy: 0.7011588560570482
Energy: 0.5987736602347868
Energy: 0.6502482472067045
Energy: 0.7264966003274711
Energy: 0.6147500972344346
Energy: 0.6170044466685543
Energy: 0.5916377089223901
Energy: 0.6101000050221099
Energy: 0.6003221824884875
Energy: 0.6049461433120444
Energy: 0.6703366812823124
Energy: 0.6700593982174746
Energy: 0.6094738180865996
Energy: 0.6701088273573629
Energy: 0.7039370805982813
Energy: 0.7990064554732098
Energy: 0.6149244282594815
Energy: 0.6737183897912378
Energy: 0.6097249103598955
Energy: 0.6015855018429676
Energy: 0.598680711982214
Energy: 0.9892702541255436
Energy: 0.6564877478460971
Energy: 0.6502449837333997
Energy: 0.9010450512902481
Energy: 0.6508516032581746
Energy: 0.6568962216685851
Energy: 1.0435939633102955
Energy: 0.6549068798910886
Energy: 0.6486470912877044
Energy: 0.6021219944820171
Energy: 0.6606656748486276
Energy: 0.7120777872695301
Energy: 0.8741068815240238
Energy: 0.577699939044362
Energy: 0.599235899747788
Energy: 0.6769915433826069
Energy: 0.5798922762362021
Energy: 0.5929207803635312
Energy: 0.7987006776401973
Energy: 0.5789661342691773
Energy: 0.7519904840752817
Energy: 0.783534579661332
Energy: 0.5803040584334531
Energy: 0.6689898478564233
Energy: 0.7949746926143673
Energy: 0.7117723459596245
Energy: 0.7100961179647027
Energy: 0.6641510665310844
Energy: 0.7106138023325036
Energy: 0.7097844661934616
Energy: 0.7916438102752686
Energy: 0.9094026958453103
Energy: 0.8583020395205688
Energy: 0.7077254550243619
Energy: 0.8584692390893278
Energy: 0.6617811715557156
Energy: 1.0160211425100207
Energy: 0.7116064395551093
Energy: 0.7103653789544441
Energy: 0.6106547830670195
Energy: 0.6782962367609138
Energy: 0.7097796192081974
Energy: 0.8471731357360829
Energy: 0.6573725569132458
Energy: 0.5922100777022257
Energy: 0.8107401342127425
Energy: 0.8396887900043161
Energy: 0.5921004109517304
Energy: 1.0799499063054054
Energy: 0.6544433485577067
Energy: 0.7083550531330894
Energy: 0.6103648400907714
Energy: 0.6530665961159031
Energy: 0.710260530560535
Energy: 0.9646661308507262
Energy: 0.601238263835623
Energy: 0.6144037960054324
Energy: 0.600460925121016
Energy: 0.6746645711216033
Energy: 0.6765419863744916
Energy: 0.7263408327570913
Energy: 0.6768904809011874
Energy: 0.6742776185760754
Energy: 0.7155892162144374
Energy: 0.8107998419370521
Energy: 0.6744134374566048
Energy: 1.0140669643369373
Energy: 0.7120880368361919
Energy: 0.6475756935484156
Energy: 0.6210077251949856
Energy: 0.715281795786815
Energy: 0.647950828654538
Energy: 0.8384571817767571
Energy: 0.7708407048308868
Energy: 0.7762672990775664
Energy: 0.7264756743247222
Energy: 0.9555937015458853
Energy: 0.7088352394679375
Energy: 0.6796199454594473
Energy: 0.6773071856006226
Energy: 0.6731385606213501
Energy: 0.5935053971016923
Energy: 0.6692662477896033
Energy: 0.6717378180056485
Energy: 0.667903398378631
Energy: 0.7190842244862641
Energy: 0.668015694241663
Energy: 0.6687981709222671
Energy: 0.5927531331967179
Energy: 0.6684693864010701
Energy: 0.6667610487572402
Energy: 0.6058812130455792
Energy: 0.6375450040312672
Energy: 0.6792440691384536
Energy: 0.5940848339755697
Energy: 0.5931941730923223
Energy: 0.9937906882581335
Energy: 0.6091855077645418
Energy: 0.5939641761476592
Energy: 0.5943523764363869
Energy: 0.6223485041682671
Energy: 0.577373786816038

minimum gb energy = 0.577373786816038 eV
minimum distance =  2.41093065637257 Angstroms
sigma value = 41


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

Energy: 1.1815511338971036
Energy: 0.6619914540434745
Energy: 0.6622141217725679
Energy: 0.9036666132401012
Energy: 0.7980775041788609
Energy: 0.9027319758123934
Energy: 0.7807869111049159
Energy: 0.6703847344283677
Energy: 0.674096237824227
Energy: 0.6551742474330542
Energy: 0.6408463327023449
Energy: 0.6508046678543855
Energy: 0.6421718126876004
Energy: 0.6593098821611001
Energy: 0.6513875791111479
Energy: 0.6422141709003206
Energy: 0.6435340833038125
Energy: 0.6512290502244307
Energy: 0.6427857158800523
Energy: 0.6689291732523457
Energy: 0.6514502493720818
Energy: 0.6427925665073193
Energy: 0.6596741159999124
Energy: 0.6597152554543703
Energy: 0.6402690136734152
Energy: 0.6630170705757906
Energy: 0.6517926957093426
Energy: 0.6534874914801695
Energy: 0.6611909804815708
Energy: 0.7488197160223298
Energy: 0.9133298639653985
Energy: 0.757291985717356
Energy: 0.755502639266474
Energy: 0.6404725186991567
Energy: 0.7608766920486638
Energy: 0.769373152769503
Energy: 0.8552353945780456
Energy: 0.6605539791219086
Energy: 0.6609877637633007
Energy: 0.6412488084475894
Energy: 0.6721982098624828
Energy: 0.6529068504634683
Energy: 0.6598328135265544
Energy: 0.7690076329702402
Energy: 0.7675411058041631
Energy: 0.6857201599324232
Energy: 0.7688711379386666
Energy: 0.6179598090597771
Energy: 0.912348217745113
Energy: 0.6524653649637328
Energy: 0.6513572369071216
Energy: 0.6463429063070352
Energy: 0.6609139353112731
Energy: 0.6514973491356427
Energy: 0.8495777347369047
Energy: 0.7718480646168092
Energy: 0.7715267350245151
Energy: 0.8178067228016015
Energy: 0.7602563353477516
Energy: 0.7721034324313089
Energy: 0.8505652520059453
Energy: 0.75709570040509
Energy: 0.6548381646715609
Energy: 0.8202115490674409
Energy: 0.7715597373085294
Energy: 0.6618072312592673
Energy: 1.036792676995839
Energy: 0.6183800218904174
Energy: 0.6177457131246673
Energy: 0.7778494266610633
Energy: 0.6188487383728175
Energy: 0.6508482269912895
Energy: 0.7599582765657035
Energy: 0.6175193612103456
Energy: 0.8920154456692724
Energy: 0.7601472056287316
Energy: 0.619093460715418
Energy: 0.8898348734797423
Energy: 0.7514254761293785
Energy: 0.6624894851662064
Energy: 0.6589555543542007
Energy: 0.6611432367499661
Energy: 0.6416543411253818
Energy: 0.6528056163900869
Energy: 0.7661919815043613
Energy: 0.771977809739388
Energy: 0.7626047068369306
Energy: 0.7665807955709271
Energy: 0.7614397059468678
Energy: 0.7668987178623774
Energy: 0.6401712340216916
Energy: 0.6635408335116566
Energy: 0.6518941681835831
Energy: 0.6742184127169468
Energy: 0.6409508372399871
Energy: 0.6515165659924582
Energy: 1.039569476960751
Energy: 0.6695750026504106
Energy: 0.6433606868563689
Energy: 0.9274109346880629
Energy: 0.6568631812707969
Energy: 0.8937595621428921
Energy: 0.9011213984456865
Energy: 0.673111176960338
Energy: 0.6611228073377431
Energy: 0.6184578987195386
Energy: 0.6537466858280514
Energy: 0.6189365776908285
Energy: 0.6429791790329215
Energy: 0.6563913610351128
Energy: 0.6624365500599261
Energy: 0.6426056760448439
Energy: 0.6435339075489221
Energy: 0.6517193113874442
Energy: 0.6415058327798329
Energy: 0.6599995147650147
Energy: 0.6515265911737902
Energy: 0.641681854249176
Energy: 0.6428496815148156
Energy: 0.6513480115210883
Energy: 0.6403472268845455
Energy: 0.6516485326099872
Energy: 0.6513523036817505
Energy: 0.6406901353465766
Energy: 0.6606001402707199
Energy: 0.6506402418548889
Energy: 1.11523449170579
Energy: 0.7718260772118349
Energy: 0.7721990643174574
Energy: 0.7982688047183499
Energy: 0.771909527720297
Energy: 0.7719029402622589
Energy: 0.9123716023090672
Energy: 0.659382476966141
Energy: 0.6533327217446906
Energy: 0.6426308285578219
Energy: 0.6614317647066806
Energy: 0.6515981896950837
Energy: 0.6595868237206133
Energy: 0.7562587232185158
Energy: 0.7563858152932288
Energy: 0.6857431708935993
Energy: 0.7661820604499783
Energy: 0.6180289480252288
Energy: 0.855248666371521
Energy: 0.6619678678919433
Energy: 0.6597691152175341
Energy: 0.6545783352070227
Energy: 0.6607287457705375
Energy: 0.653296616181776
Energy: 0.8501834051088107
Energy: 0.7719896575444474
Energy: 0.661787866286871
Energy: 0.8203667047129538
Energy: 0.7720062320726783
Energy: 0.651594976365436
Energy: 0.8495897311276908
Energy: 0.7713476467499455
Energy: 0.7570326939469872
Energy: 0.81808615545896
Energy: 0.7605307803545697
Energy: 0.7732609109642105
Energy: 1.0355083654743726
Energy: 0.644849679430026
Energy: 0.6593363141940867
Energy: 0.656854330515824
Energy: 0.6326101987766315
Energy: 0.6632127912891027
Energy: 0.7609382901656627
Energy: 0.8958504529969783
Energy: 0.890203322529309
Energy: 0.7609384820713156
Energy: 0.9009706717763729
Energy: 0.8900245335643788
Energy: 0.7505209270114795
Energy: 0.6623348540500865
Energy: 0.6547107046904332
Energy: 0.7283877104790761
Energy: 0.6600070276033516
Energy: 0.6539221698399981
Energy: 0.7608842049452781
Energy: 0.7569569058272062
Energy: 0.7617109894898147
Energy: 0.7610063552472135
Energy: 0.7627074893891236
Energy: 0.7609128410987949
Energy: 0.7609997804997284
Energy: 0.6625547145181804
Energy: 0.6605032044150183
Energy: 0.7721892524607548
Energy: 0.6419739702645255
Energy: 0.6614126115974296
Energy: 1.0396258240843694
Energy: 0.672533499737565
Energy: 0.6190058331931766
Energy: 0.9280119867638229
Energy: 0.6700053419851214
Energy: 0.6188550934557926

minimum gb energy = 0.6175193612103456 eV
minimum distance =  2.41134772775127 Angstroms
sigma value = 33


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

Energy: 0.7631387143481646
Energy: 1.0594105070366837
Energy: 1.0585975055171037
Energy: 0.680477149635286
Energy: 0.9337625798525983
Energy: 1.0703380898499675
Energy: 1.02937858437657
Energy: 0.706791724084339
Energy: 0.6877923193322066
Energy: 0.7090559963977652
Energy: 0.6930292646743834
Energy: 0.6862899773148404
Energy: 0.6943336364029039
Energy: 0.6871836514463947
Energy: 0.6875163117437418
Energy: 0.6944638896109321
Energy: 0.6872334156671567
Energy: 0.6929550561043042
Energy: 0.6945589829963853
Energy: 0.6919066247587676
Energy: 0.6917743153961499
Energy: 0.6948273453033499
Energy: 0.6875823042337125
Energy: 0.691096387782496
Energy: 0.694065685777002
Energy: 0.6650226342501361
Energy: 0.6651118172593123
Energy: 0.7119746428342537
Energy: 0.7125260638714054
Energy: 0.6652328730371571
Energy: 0.8927779572540115
Energy: 0.8621540958514022
Energy: 0.6645960794622172
Energy: 0.885402079543742
Energy: 0.901772147023043
Energy: 0.664435707806083
Energy: 1.0345988687231316
Energy: 0.6659808531148326
Energy: 0.7100834799548902
Energy: 0.6945746858756197
Energy: 0.7039799340949923
Energy: 0.7088753960367451
Energy: 0.7194752286771259
Energy: 0.6669502282955743
Energy: 0.6693233715369045
Energy: 0.6634724498037287
Energy: 0.6677295011197142
Energy: 0.6687229976251534
Energy: 0.7220859238796938
Energy: 0.6646161362764631
Energy: 0.6654686092471854
Energy: 0.7498829075465847
Energy: 0.6645002464503853
Energy: 0.6669124448749508
Energy: 0.9902020186385276
Energy: 0.6671501127634947
Energy: 0.6671532815362979
Energy: 0.7093865043779006
Energy: 0.6673872957960444
Energy: 0.6867916533937253
Energy: 0.9901199007740814
Energy: 0.6862116881252888
Energy: 0.6876613587656466
Energy: 0.6949896608972771
Energy: 0.7044730312522736
Energy: 0.6896042034192533
Energy: 0.8919937006365409
Energy: 0.6660371405228301
Energy: 0.6637538841431964
Energy: 0.6948562244740607
Energy: 0.6717411176091379
Energy: 0.6630056466000271
Energy: 0.6968035425583038
Energy: 0.6670169490633605
Energy: 0.7017737976224558
Energy: 0.6959668766301101
Energy: 0.6665101554026195
Energy: 0.7039997678135044
Energy: 0.6970073462597152
Energy: 0.7107427560811764
Energy: 0.68910170924751
Energy: 0.6942825227157934
Energy: 0.7107300158881272
Energy: 0.6878315776837333
Energy: 0.6666903710939269
Energy: 0.6886166305787831
Energy: 0.6883076049753227
Energy: 0.6872566719179929
Energy: 0.6885123842129073
Energy: 0.6887589507380286
Energy: 0.6930544112123748
Energy: 0.7074049526629451
Energy: 0.6904159904845055
Energy: 0.7299013442468555
Energy: 0.6937542668249368
Energy: 0.7085000095646712
Energy: 0.9851212021102853
Energy: 0.6976176414796104
Energy: 0.8653388803734919
Energy: 0.9021040051756761
Energy: 0.8853660810391119
Energy: 0.860959218240209
Energy: 0.9867131311828287
Energy: 0.6932170564549185
Energy: 0.6650796538875218
Energy: 0.6993949980352752
Energy: 0.7119821144490202
Energy: 0.6654143291229548
Energy: 0.8653301377499848
Energy: 0.6635992645533346
Energy: 0.6639399578906083
Energy: 0.6661865387904847
Energy: 0.6653377231637072
Energy: 0.6920991545104349
Energy: 0.8601089251266525
Energy: 0.6646970404774202
Energy: 0.6670085378445677
Energy: 0.6659679444714531
Energy: 0.7356537279576526
Energy: 0.6922674355160178
Energy: 0.6647032890669106
Energy: 0.6661985778764327
Energy: 0.665920293460605
Energy: 0.6647746116963066
Energy: 0.7299372441390175
Energy: 0.665885782984649
Energy: 0.8666470735513119
Energy: 0.6849753382147491
Energy: 0.6673728085162274
Energy: 0.8670369311266658
Energy: 0.864682575618636
Energy: 0.6673081349114238
Energy: 1.0038342695089635
Energy: 0.7074178586957033
Energy: 0.6882338799198833
Energy: 0.685057890850316
Energy: 0.7129904491204685
Energy: 0.6665328102439572
Energy: 0.7228059752561142
Energy: 0.8893064772133125
Energy: 0.6626166787068534
Energy: 1.0616705001743285
Energy: 0.9048509304389772
Energy: 0.66721625143042
Energy: 1.341328216132722
Energy: 0.7272316417647834
Energy: 0.7088616060359292
Energy: 0.6871988686291587
Energy: 0.7122549791342357
Energy: 0.6880918218261834
Energy: 0.694827466744313
Energy: 0.6874128573916647
Energy: 0.6875684984683806
Energy: 0.6948871056684459
Energy: 0.6890188885998494
Energy: 0.6939669480793035
Energy: 0.6942317032912659
Energy: 0.6924271002788414
Energy: 0.692842819032739
Energy: 0.6943945046209835
Energy: 0.7124344246565978
Energy: 0.6934334813379297
Energy: 0.6927823813704268
Energy: 0.665420700415013
Energy: 0.6663539606278212
Energy: 0.6931470288612492
Energy: 0.7088797360943047
Energy: 0.6673207370402696
Energy: 0.8945343005701177
Energy: 0.8626419891190731
Energy: 0.8604864823255897
Energy: 0.8861141972329306
Energy: 0.860834479403054
Energy: 0.8571790741202528
Energy: 0.7209724395551219
Energy: 0.6662164436025072
Energy: 0.7053314594183743
Energy: 0.6945101964582725
Energy: 0.684606455529291
Energy: 0.6884279963109117
Energy: 0.7194300726345004
Energy: 0.6671666068351063
Energy: 0.6817292090920066
Energy: 0.6635444342773279
Energy: 0.8701364614439597
Energy: 0.6698195913725375
Energy: 0.7237243361560097
Energy: 0.6848744258897648
Energy: 0.6664949000322452
Energy: 0.6941586363184377
Energy: 0.6845670755291439
Energy: 0.6664243599442267
Energy: 0.9905228989068777
Energy: 0.6863018223443489
Energy: 0.6866833706193946
Energy: 0.7082257670755596
Energy: 0.6682551100220523
Energy: 0.6869458303344262
Energy: 0.9901991171354406
Energy: 0.6875802054240739
Energy: 0.6864917328124279
Energy: 0.6946438122113632
Energy: 0.6673478587660804
Energy: 0.6914795335923095
Energy: 0.8907292244717053
Energy: 0.664084105029582
Energy: 0.663641155484266
Energy: 0.7117627159861986
Energy: 0.6696748488620244
Energy: 0.6664429378783157
Energy: 0.698027752680848
Energy: 0.7031785595096322
Energy: 0.6631694858565809
Energy: 0.8951361510564209
Energy: 0.7081490097751789
Energy: 0.6628181085536399
Energy: 0.6942755821644928
Energy: 0.7084916854033027
Energy: 0.7102634424940887
Energy: 0.6941820945713036
Energy: 0.7102052466367326
Energy: 0.6862072653780656
Energy: 0.68573899938014
Energy: 0.6874648194956877
Energy: 0.6871728183145351
Energy: 0.685838225392828
Energy: 0.6870452635404091
Energy: 0.6868211497364676
Energy: 0.6941890525476729
Energy: 0.7081225178697109
Energy: 0.6875554378782373
Energy: 0.725180368172225
Energy: 0.6941801996097916
Energy: 0.689241868212705
Energy: 0.9858016126519346
Energy: 0.6963451528695563
Energy: 0.7086384380282961
Energy: 0.9161585905795325
Energy: 0.6960602491117348
Energy: 0.8610024625687626
Energy: 0.986283681030199
Energy: 0.7125795712620772
Energy: 0.6651568804224455
Energy: 0.9104081160894741
Energy: 0.7128249736001961
Energy: 0.665555739101663
Energy: 0.6946758776128809
Energy: 0.6638099184480839
Energy: 0.6666659144756869
Energy: 0.6657005339399101
Energy: 0.7207540534829633
Energy: 0.6909737630679189
Energy: 0.6681895896605529
Energy: 0.6630872819434565
Energy: 0.6679313060762795
Energy: 0.6681468725632312
Energy: 0.6651886921808565
Energy: 0.6684391945439883
Energy: 0.6641221272440813
Energy: 0.6693606605968501
Energy: 0.666550168829908
Energy: 0.6643030740044633
Energy: 0.7378677686854964
Energy: 0.6668682495244437
Energy: 0.8701586295915072
Energy: 0.6852131483289107
Energy: 0.6672279840142686
Energy: 0.8703402236114498
Energy: 0.8646812092204681
Energy: 0.8725803855049613
Energy: 0.6930841421130722
Energy: 0.6866515926855377
Energy: 0.6934987645782047
Energy: 0.6845313054825053
Energy: 0.6948300602828944
Energy: 0.7099304967880102
Energy: 1.2575152508978258
Energy: 0.6894119012594255
Energy: 0.6627958704496312
Energy: 0.6656930801095042
Energy: 0.9027042469629494
Energy: 0.684301866628541

minimum gb energy = 0.6626166787068534 eV
minimum distance =  2.43120438101448 Angstroms
sigma value = 67


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

Energy: 1.0359099966898335
Energy: 0.7371682427186955
Energy: 0.7366326329073581
Energy: 0.7373357425303073
Energy: 0.7586991028574879
Energy: 0.7365968648902985
Energy: 0.7820829512573504
Energy: 0.7255179945283837
Energy: 0.725016940750213
Energy: 0.7272502312073561
Energy: 0.7259818380247701
Energy: 0.7248066002261842
Energy: 0.7445110231470049
Energy: 0.6962781307096545
Energy: 0.7275439509722229
Energy: 0.7271938448561183
Energy: 0.6974303250535429
Energy: 0.7275952102887445
Energy: 0.7454484534107937
Energy: 0.726296508827506
Energy: 0.7262692126045327
Energy: 0.7457632429403798
Energy: 0.7260862591340972
Energy: 0.7264003854495764
Energy: 0.7456703220651617
Energy: 0.7269241642904074
Energy: 0.7267310221135067
Energy: 0.7457205262740385
Energy: 0.72635610498246
Energy: 0.7285507582137324
Energy: 0.7485632164260392
Energy: 0.7408022257265318
Energy: 0.7277679949628354
Energy: 0.7484781096233377
Energy: 0.7406010960135351
Energy: 0.7479787752337678
Energy: 0.7823008774377973
Energy: 0.7257232607639413
Energy: 0.725338130252253
Energy: 0.7824777371585648
Energy: 0.7260449065561486
Energy: 0.7250646066852557

minimum gb energy = 0.6962781307096545 eV
minimum distance =  2.43274771679522 Angstroms
sigma value = 3


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

Energy: 1.2828261344258693
Energy: 0.8682006687920247
Energy: 0.8057830013228199
Energy: 0.8283407711383453
Energy: 0.9090857926936617
Energy: 0.8061663370086107
Energy: 0.8255078189488826
Energy: 0.8199345575819783
Energy: 0.8233476550114393
Energy: 0.8433557748566395
Energy: 0.8831663185885283
Energy: 0.810644857367433
Energy: 0.822038251506707
Energy: 0.8094468891098274
Energy: 0.8165589962097715
Energy: 0.8237995895394972
Energy: 0.8260665950350375
Energy: 0.8504294166165719
Energy: 0.8241822512971498
Energy: 0.8129572011665005
Energy: 0.8129827798250533
Energy: 0.8246514044159532
Energy: 0.8167046816942869
Energy: 0.8204471681075373
Energy: 0.8316792951065508
Energy: 0.833639223827234
Energy: 0.8349746839144864
Energy: 0.8129277158745889
Energy: 0.8352924605304729
Energy: 0.8210750787819436
Energy: 0.8273978316086765
Energy: 0.8358060767821478
Energy: 0.7996414241974044
Energy: 0.8435710888309677
Energy: 0.8427926491380995
Energy: 0.8040095063045153
Energy: 0.8118112553422482
Energy: 0.8387482755956139
Energy: 0.8168876816951584
Energy: 0.796382830147032
Energy: 0.8473740565599114
Energy: 0.8169862488671912
Energy: 0.9117041131941308
Energy: 0.9367351826605909
Energy: 0.799319289365717
Energy: 0.8598721312254346
Energy: 0.9360292345117129
Energy: 0.8045557664382204
Energy: 0.8137147292240741
Energy: 0.8267861765244494
Energy: 0.8178303404316554
Energy: 0.8197745700854155
Energy: 0.8669827498414454
Energy: 0.8470546640087097
Energy: 0.9520156642282647
Energy: 0.8742139596478531
Energy: 0.8739340332383952
Energy: 0.8876536863503857
Energy: 0.8747440136969725
Energy: 0.8103466364013441
Energy: 0.8941671939926247
Energy: 0.8646942027621025
Energy: 0.8636477604305305
Energy: 0.8657886498618284
Energy: 0.8168724129863844
Energy: 0.8329473737101812
Energy: 0.8394599273326373
Energy: 0.8240977609754176
Energy: 0.7988985993294051
Energy: 0.8385983758852011
Energy: 0.7997959676243069
Energy: 0.8064180533169664
Energy: 0.8148015221005007
Energy: 0.8218651268941095
Energy: 0.804135050829298
Energy: 0.8210262669911597
Energy: 0.8095713914136137
Energy: 0.8358073681682349
Energy: 0.8682199562814974
Energy: 0.8301222938370035
Energy: 0.8354231646318543
Energy: 0.8338267427607187
Energy: 0.82688275255773
Energy: 0.8356061252239031
Energy: 0.8462824021998926
Energy: 0.8244703397761856
Energy: 0.8218950648782387
Energy: 0.8028889348300203
Energy: 0.8243345612118683
Energy: 0.8212938263977492
Energy: 0.9098325757481
Energy: 0.8461282671340798
Energy: 0.8459718046702128
Energy: 0.9100508841435657
Energy: 0.8458498752806028
Energy: 0.8460811578594754
Energy: 0.9114846537986497
Energy: 0.8455412776061932
Energy: 0.8456501513974622
Energy: 0.9120615899324576
Energy: 0.8549745135569836
Energy: 0.8419338794624365
Energy: 0.8929598188664823
Energy: 0.84175377445308
Energy: 0.8546069718438166
Energy: 0.884250751242751
Energy: 0.8411828095004957
Energy: 0.824931885344339
Energy: 0.9508587525583888
Energy: 0.8469105938733565
Energy: 0.8469045397158789
Energy: 0.8747917619330219
Energy: 0.8455280305663593
Energy: 0.8717609639105525
Energy: 0.8683086336451308
Energy: 0.8006345083817097
Energy: 0.8537935234412456
Energy: 0.8745775497269161
Energy: 0.8001662927617725
Energy: 0.8715521796702185
Energy: 0.8081576083388139
Energy: 0.820153295750946
Energy: 0.8289053113274977
Energy: 0.8066144536831181
Energy: 0.8086761810410339
Energy: 0.8214585894502963
Energy: 0.8088187284230083
Energy: 0.8285379060201096
Energy: 0.8302241394846892
Energy: 0.8260344128708162
Energy: 0.8292858267272073
Energy: 0.8299816816385505
Energy: 0.81023874934428
Energy: 0.8231072320897179
Energy: 0.8264053151706571
Energy: 0.8106190622393832
Energy: 0.8198725641523282
Energy: 0.8256169338118212
Energy: 0.7979952163606713
Energy: 0.8588094022436822
Energy: 0.8585484876373816
Energy: 0.7979926577582369
Energy: 0.8587792895488973
Energy: 0.7991816800644955
Energy: 0.8284242701158194
Energy: 0.8108225084113924
Energy: 0.8707013031466138
Energy: 0.8423993157779887
Energy: 0.8092930831725701
Energy: 0.8492323120065058
Energy: 0.9522359909216599
Energy: 0.8592944097324695
Energy: 0.8077592982300216
Energy: 0.8606184693321468
Energy: 0.8690327268319993
Energy: 0.8139546441788456
Energy: 1.0802139870079561
Energy: 0.8596515637417511
Energy: 0.8081077636519781
Energy: 0.8616332265498622
Energy: 0.8693380312027713
Energy: 0.8285465785830766
Energy: 0.8158430555325529
Energy: 0.8106750644697099
Energy: 0.8463039697155049
Energy: 0.8458556364529084
Energy: 0.8115926150616946
Energy: 0.8508553363974853
Energy: 0.8126195676558111
Energy: 0.8450286606399839
Energy: 0.8240519866865471
Energy: 0.8208032817120541
Energy: 0.8467734790667794
Energy: 0.8216656027385033
Energy: 0.8267752777892318
Energy: 0.8368904913601245
Energy: 0.8379044253990551
Energy: 0.828290761155109
Energy: 0.8366233214097624
Energy: 0.8417414630143941
Energy: 0.8246956037257521
Energy: 0.8485161831355669
Energy: 0.849072573428191
Energy: 0.8232075866199313
Energy: 0.8115627125876427
Energy: 0.8495270754250311
Energy: 0.8289290844948343
Energy: 0.8170376947274616
Energy: 0.8190025584402465
Energy: 0.7929104905741311
Energy: 0.840059197696216
Energy: 0.8201037374353284
Energy: 0.910132098882008
Energy: 0.8426520205471026
Energy: 0.833866569514466
Energy: 0.859181670094961
Energy: 0.8423542298598161
Energy: 0.8424015237950746
Energy: 1.0227525526838959
Energy: 0.8628708774713412
Energy: 0.836479433861047
Energy: 0.8482369558125192
Energy: 0.8559555409929843
Energy: 0.8179356004975301
Energy: 0.8030993429607753
Energy: 0.8235746040858395
Energy: 0.839433598863272
Energy: 0.8661719654841611
Energy: 0.8152571383255569
Energy: 0.8533422318220986
Energy: 0.8407825035876977
Energy: 0.874216209731386
Energy: 0.8739163171623457
Energy: 0.8409558972619589
Energy: 0.8748139764744634
Energy: 0.8105462357324739
Energy: 0.8452370156267258
Energy: 0.8248228911805133
Energy: 0.8214886268321379
Energy: 0.8464271757943415
Energy: 0.7973867114829581
Energy: 0.8202175745520602
Energy: 0.8158241913759926
Energy: 0.8223113050959989
Energy: 0.8031723973564993
Energy: 0.8266632703126104
Energy: 0.8189103546689828
Energy: 0.8000512976264522
Energy: 0.7988435215945057
Energy: 0.8266121957721084
Energy: 0.8278609956402572
Energy: 0.8521974025409309
Energy: 0.8287046952399044
Energy: 0.851042211121764
Energy: 0.8450435427590356
Energy: 0.8214108000374243
Energy: 0.8499263442826186
Energy: 0.802917468978863
Energy: 0.820572365786596
Energy: 0.8595979786480489
Energy: 0.9113814970162993
Energy: 0.8469258881585923
Energy: 0.8466096888067757
Energy: 0.8342875430147778
Energy: 0.8512879237402377
Energy: 0.8465295704099286
Energy: 0.9692222347771197
Energy: 0.8486987990119645
Energy: 0.8190956857048955
Energy: 0.9403276232736888
Energy: 0.8591394750550536
Energy: 0.8332540601577094
Energy: 0.8932877480607327
Energy: 0.8437629303598589
Energy: 0.8444541961596436
Energy: 0.94004656631267
Energy: 0.8605799798534496
Energy: 0.8335884662555639
Energy: 0.8973479575808536
Energy: 0.8466813693257748
Energy: 0.8465988591944835
Energy: 0.8464076410025909
Energy: 0.8583035134902999
Energy: 0.847680569175221
Energy: 1.1413520731062103
Energy: 0.7975156107790012
Energy: 0.8315305172526374
Energy: 0.8810531108601063
Energy: 0.7973412204069662
Energy: 0.7891512267467555
Energy: 0.8106084698983735
Energy: 0.8172139185231225
Energy: 0.8166473424059824
Energy: 0.8110914072424831
Energy: 0.8108576745031856
Energy: 0.8224872517956269
Energy: 0.8088108917356374
Energy: 0.8243978717232093
Energy: 0.8220352095868717
Energy: 0.8263515266273407
Energy: 0.8253395192143513
Energy: 0.8267154193763924
Energy: 0.8085912543201698
Energy: 0.8283915434985706
Energy: 0.8291237206880476
Energy: 0.8088258377945905
Energy: 0.8204822714306788
Energy: 0.8292789523634494
Energy: 0.8067538759038826
Energy: 0.8508273180920017
Energy: 0.8538307708940215
Energy: 0.8073304674419152
Energy: 0.8589257466146759
Energy: 0.8533527185498867
Energy: 0.8213670532984997
Energy: 0.8586106196257459
Energy: 0.8587199544282225
Energy: 0.8905396830825082
Energy: 0.8654665182146439
Energy: 0.8443171372044372
Energy: 0.8194124353420252
Energy: 0.828667867760034
Energy: 0.8317034445801476
Energy: 0.8241488190116913
Energy: 0.882935112383876
Energy: 0.8277963014149776

minimum gb energy = 0.7891512267467555 eV
minimum distance =  2.33665483018125 Angstroms
sigma value = 81


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

Energy: 1.3810740841582436
Energy: 0.7799960737821152
Energy: 0.7804053775546526
Energy: 0.7800136543128343
Energy: 0.8946001008110858
Energy: 0.7800777946944646
Energy: 0.778590641962548
Energy: 0.8099969589909256
Energy: 0.8099176179782628
Energy: 0.8126123220024271
Energy: 0.808517918036011
Energy: 0.823356931205233
Energy: 0.8341127563424543
Energy: 0.8058171439407815
Energy: 0.802488683182708
Energy: 0.9052886190501678
Energy: 0.8056433834747481
Energy: 0.8608799554426171
Energy: 0.8038086713260176
Energy: 0.8037597341336583
Energy: 0.8278790145988579
Energy: 0.8037523022889757
Energy: 0.8029397354880791
Energy: 0.8269776388550604
Energy: 0.8099161219088017
Energy: 0.807189349938904
Energy: 0.8102191855740695
Energy: 0.8105715630092617
Energy: 0.8057552061106018
Energy: 0.8085273157288541
Energy: 0.804275933255298
Energy: 0.8106206496070685
Energy: 0.8069625069147799
Energy: 0.8116099498640754
Energy: 0.8109266682016251
Energy: 0.8138811979122521
Energy: 0.7950260701358214
Energy: 0.8634074840885428
Energy: 0.8096707084115127
Energy: 0.7944309086796478
Energy: 0.8770952876197613
Energy: 0.8157927570533516
Energy: 0.8024808646242011
Energy: 0.9619105853426042
Energy: 0.9149215892201814
Energy: 0.7809091525642217
Energy: 0.9625480688349876
Energy: 0.7924899501508182
Energy: 0.7955409997768862
Energy: 0.8148717760829643
Energy: 0.8172363942699801
Energy: 0.8158814708036662
Energy: 0.8674433501399225
Energy: 0.800769836910273
Energy: 0.9137253837333043
Energy: 0.7521290728503317
Energy: 0.7519545354509269
Energy: 0.9149008088780964
Energy: 0.7517997314836088
Energy: 0.7513567317617355
Energy: 0.7967696951374345
Energy: 0.7514206345434359
Energy: 0.7501615071229993
Energy: 0.7933310110380202
Energy: 0.7499437628502748
Energy: 0.8021918962684117
Energy: 0.7921169626587765
Energy: 0.8042426978157186
Energy: 0.8179950739861541
Energy: 0.8018089487873528
Energy: 0.8094064009603583
Energy: 0.8179726033806249
Energy: 0.7921156098673738
Energy: 0.8490380238182537
Energy: 0.8489021834689906
Energy: 0.8054755013268269
Energy: 0.8283564612237441
Energy: 0.8029349875012467
Energy: 0.8222833260143553
Energy: 0.8164098535759092
Energy: 0.8167164467000653
Energy: 0.8218097256386574
Energy: 0.8245530601765579
Energy: 0.8145167933000722
Energy: 0.823184158000032
Energy: 0.8374692112166977
Energy: 0.8203524291745433
Energy: 0.8214130401753202
Energy: 0.814604786226186
Energy: 0.8206667641697432
Energy: 0.9161877411855057
Energy: 0.8187169344442159
Energy: 0.8171276628257087
Energy: 0.8807080655010097
Energy: 0.819114576574397
Energy: 0.8177160433778964
Energy: 0.9153217038104807
Energy: 0.7805723483231769
Energy: 0.7884335471275099
Energy: 0.9152633199361604
Energy: 0.7919984470571044
Energy: 0.7915946210096878
Energy: 0.9242823717519978
Energy: 0.8076066406818215
Energy: 0.8036204324111169
Energy: 0.9110705074817039
Energy: 0.7980097673276647
Energy: 0.8025372266241254
Energy: 0.8894574647286724
Energy: 0.8111074352129214
Energy: 0.7512288920159407
Energy: 0.7504831127278615
Energy: 0.8096967265258951
Energy: 0.750755056332169
Energy: 0.7529460465034459
Energy: 0.8107912562423657
Energy: 0.7512029361318673
Energy: 0.7502798256327803
Energy: 0.8169005869432245
Energy: 0.7507460795299231
Energy: 0.7917617280610196
Energy: 0.8198310091389385
Energy: 0.8243305647436072
Energy: 0.7788152339555448
Energy: 0.8024846911418996
Energy: 0.8092615723953374
Energy: 0.8112154375139238
Energy: 0.8054736415321567
Energy: 0.8051259416460488
Energy: 0.8391214999735157
Energy: 0.8040761589056263
Energy: 0.8046947724884328
Energy: 0.8168446011241018
Energy: 0.8244267063661461
Energy: 0.8240625941752349
Energy: 0.8174936468964222
Energy: 0.8256054548000331
Energy: 0.8160121580256383
Energy: 0.8183826501281948
Energy: 0.8189661636650415
Energy: 0.8184598945631086
Energy: 0.8179701885014939
Energy: 0.822994535710815
Energy: 0.8181957598746744
Energy: 0.8199475941227135
Energy: 0.8585321274823419
Energy: 0.8171196954992688
Energy: 0.8173325751620251
Energy: 0.8163702376501103
Energy: 0.8178297876132299
Energy: 0.9198819066068797
Energy: 0.9334051519842422
Energy: 0.8916407524466631
Energy: 0.7914835794392413
Energy: 0.8881861411398279
Energy: 0.8591558889992774
Energy: 0.9193139978683257
Energy: 0.9039026629385735
Energy: 0.8645653213383725
Energy: 0.7905552496310714
Energy: 0.9036497061419194
Energy: 0.8583164941893144
Energy: 0.7936730912323072
Energy: 0.7515707096047244
Energy: 0.8035894552370733
Energy: 0.7932481287756166
Energy: 0.7728762514345964
Energy: 0.803634414233308
Energy: 0.8006996711626743
Energy: 0.750368817255346
Energy: 0.7501356498057207
Energy: 0.8050015769485704
Energy: 0.7500055577937897
Energy: 0.7507163073642518
Energy: 0.7995796151928899
Energy: 0.813571889984087
Energy: 0.8345800872361978
Energy: 0.8147956312613381
Energy: 0.8155670244734673
Energy: 0.8194587359063378
Energy: 0.7922401698781041
Energy: 0.8084022554351672
Energy: 0.8343024064534756
Energy: 0.8056868378685081
Energy: 0.8934043070023696
Energy: 0.8052370082164472
Energy: 0.7991489789149133
Energy: 0.8058823233749177
Energy: 0.8295300088195653
Energy: 0.7922534319814776
Energy: 0.7962167969644833
Energy: 0.8255533534544616
Energy: 0.8131161174418281
Energy: 0.8065919154619433
Energy: 0.8055139469726266
Energy: 0.8156370919421743
Energy: 0.8064274754241408
Energy: 0.8142651992162123
Energy: 0.8851839872847864
Energy: 0.8124087780789491
Energy: 0.8118194170831445
Energy: 0.8238399996796819
Energy: 0.8116352996905435
Energy: 0.8122282724180947
Energy: 0.8856518348080286
Energy: 0.8090615172927477
Energy: 0.8081466488244957
Energy: 0.8859520377916695
Energy: 0.7906428961890523
Energy: 0.8701700845981462
Energy: 0.8822711525794692
Energy: 0.7919922008486907
Energy: 0.7921169748233201
Energy: 0.8823422684857843
Energy: 0.7920672244356488
Energy: 0.8822112308367207
Energy: 0.9731491713588756
Energy: 0.8098147530543715
Energy: 0.8099625170965367
Energy: 0.884845248706765
Energy: 0.8085855816732951
Energy: 0.8138349471243195
Energy: 0.7756792437720816
Energy: 0.8592429752307219
Energy: 0.780630526426984
Energy: 0.7893263625768036
Energy: 0.858867130170123
Energy: 0.7933830057447725

minimum gb energy = 0.7499437628502748 eV
minimum distance =  2.28439353257454 Angstroms
sigma value = 43


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

Energy: 1.3850779391181778
Energy: 0.8929132070894577
Energy: 0.8329089320996004
Energy: 0.9280964103909126
Energy: 1.0020557708274573
Energy: 0.9281156446593235
Energy: 0.8451787385070629
Energy: 0.8236700637734072
Energy: 0.8223295999772039
Energy: 0.8232665876580804
Energy: 0.8137916118745376
Energy: 0.7946197698793771
Energy: 0.7722478269656592
Energy: 0.8319404705092018
Energy: 0.8396036920991798
Energy: 0.9189664533558761
Energy: 0.8533010116967291
Energy: 0.8647006871852997
Energy: 0.7859623663666483
Energy: 0.852111109369378
Energy: 0.8259072331726476
Energy: 0.7860311261564275
Energy: 0.8522639257207322
Energy: 0.82603678655281
Energy: 0.7857928348150469
Energy: 0.8018433073941295
Energy: 0.8019586798043755
Energy: 0.7859196020672499
Energy: 0.8015756571928891
Energy: 0.8008531788777055
Energy: 0.7855920719603936
Energy: 0.80184774353376
Energy: 0.8025220961752285
Energy: 0.8013705805143673
Energy: 0.8040126493320718
Energy: 0.8026695097652888
Energy: 0.7763565628766143
Energy: 0.7860825889277663
Energy: 0.7861378241400336
Energy: 0.8167793552530502
Energy: 0.7861021001464297
Energy: 0.7904664735422334
Energy: 0.8529272067043345
Energy: 0.8259089219481293
Energy: 0.8391628242426343
Energy: 0.8308831052586744
Energy: 0.8256822359071854
Energy: 0.8261874170317931
Energy: 0.7764332885144709
Energy: 0.8259874514519604
Energy: 0.8254091807600148
Energy: 0.7825010123021446
Energy: 0.7868263551101403
Energy: 0.8391097944280201
Energy: 0.7766965658928211
Energy: 0.8865961152333324
Energy: 0.8830644158042368
Energy: 0.8644973009151076
Energy: 0.8706186984961162
Energy: 0.8835189439929171
Energy: 0.7936575289220822
Energy: 0.8469916515006908
Energy: 0.8245539568751701
Energy: 0.8059053806173215
Energy: 0.8273672036412967
Energy: 0.8193772368517422
Energy: 0.7808012223779784
Energy: 0.8589929510552157
Energy: 0.8588438823624317
Energy: 0.7989558395104869
Energy: 0.8229386965068939
Energy: 0.8701215524595578
Energy: 0.7810692896249237
Energy: 0.837306164800753
Energy: 0.8832238392300364
Energy: 0.8666282220982279
Energy: 0.8367213380316375
Energy: 0.8837816723616289
Energy: 0.794032903468639
Energy: 0.8299383385986393
Energy: 0.819853164932983
Energy: 0.8118186268768889
Energy: 0.7862666278701891
Energy: 0.8199315753861296
Energy: 0.7933233231400662
Energy: 0.8144805680198848
Energy: 0.8385040900194541
Energy: 0.8197791563931941
Energy: 0.7997102453744481
Energy: 0.8185908203862048
Energy: 0.7969899227222796
Energy: 0.8268691399642107
Energy: 0.8160711641911201
Energy: 0.7957116747012314
Energy: 0.8041498175905217
Energy: 0.8179421911770707
Energy: 0.796986540524951
Energy: 0.8394843418824076
Energy: 0.8391804328608258
Energy: 0.7972710379394264
Energy: 0.8136604319062671
Energy: 0.7981557978180794
Energy: 0.8283939906263118
Energy: 0.8157087213351065
Energy: 0.8160851497225577
Energy: 0.8012062452342739
Energy: 0.8267434756706135
Energy: 0.8259165834721964
Energy: 0.7759321582927494
Energy: 0.8562413420724498
Energy: 0.8493083348914258
Energy: 0.8609232373802108
Energy: 0.8565169074857297
Energy: 0.8703151423878608
Energy: 0.7748990099499169
Energy: 0.8562378565928576
Energy: 0.8502714937861017
Energy: 0.8608567245223808
Energy: 0.8557846327416003
Energy: 0.8707768517392703
Energy: 0.82829360196828
Energy: 0.791679076216978
Energy: 0.8326050981885346
Energy: 0.8028510669524822
Energy: 0.7924596276131373
Energy: 0.8328802836565159
Energy: 0.8607610055557783
Energy: 0.8037165739306043
Energy: 0.8038730667973147
Energy: 0.8607890195857912
Energy: 0.8444307975551223
Energy: 0.8036553335451067
Energy: 0.8642401606447557
Energy: 0.7923930114652113
Energy: 0.8300822504608054
Energy: 0.7917771595428732
Energy: 0.8201755803548465
Energy: 0.8141737782161496
Energy: 0.9153508857794264
Energy: 0.798320691704455
Energy: 0.8365782192512189
Energy: 0.8344770195978971
Energy: 0.9017643178535146
Energy: 0.8258388384169161
Energy: 0.8496313116220651
Energy: 0.7976656651646857
Energy: 0.8358817241020814
Energy: 0.8336853235583482
Energy: 0.79597330945302
Energy: 0.8390977479578684
Energy: 0.8370468737228712
Energy: 0.8185653910549394
Energy: 0.8196158354615255
Energy: 0.8182773870951311
Energy: 0.8134796618872774
Energy: 0.8195481006986728
Energy: 0.836902068350448
Energy: 0.8188477293102118
Energy: 0.8190901368506193
Energy: 0.8179960148915182
Energy: 0.8198043665330506
Energy: 0.8189163645140302
Energy: 0.8502347606575301
Energy: 0.8102091797467074
Energy: 0.8163277423663001
Energy: 0.8233550979231258
Energy: 0.7966547811603018
Energy: 0.829544866235975
Energy: 0.946828658755402
Energy: 0.82554619512147
Energy: 0.8262408665264089
Energy: 0.9069123294285703
Energy: 0.8296673735242537
Energy: 0.8262693777988782
Energy: 0.8227314433886305
Energy: 0.82240794652266
Energy: 0.8220822776275725
Energy: 0.824585010190453
Energy: 0.8145693317864997
Energy: 0.7912496713234289
Energy: 0.7729204800858231
Energy: 0.8937407192637538
Energy: 0.8685586781953788
Energy: 0.805196479014356
Energy: 0.893565686500178
Energy: 0.8701369266255947

minimum gb energy = 0.7722478269656592 eV
minimum distance =  2.24550069358165 Angstroms
sigma value = 57


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

Energy: 1.0140009026740764
Energy: 0.8848508141143858
Energy: 0.8228353278051048
Energy: 0.7787077413535386
Energy: 0.8958475237706912
Energy: 0.8852906630604767
Energy: 0.8384440000028354
Energy: 0.8631315219300698
Energy: 0.8286167960633691
Energy: 0.8009532218796833
Energy: 0.876984589401461
Energy: 0.898539269310551
Energy: 0.8948891006292917
Energy: 0.7905135980674641
Energy: 0.7912230640602699
Energy: 0.7833213694039362
Energy: 0.790592009044859
Energy: 0.7916246726510353
Energy: 0.8872511081363521
Energy: 0.7908664153892504
Energy: 0.7905932840563997
Energy: 0.8870691234171965
Energy: 0.7914334496948943
Energy: 0.7929598401110519
Energy: 0.8895478197572814
Energy: 0.8693761091063282
Energy: 0.8756652140236217
Energy: 0.8891649545698914
Energy: 0.8712135917545144
Energy: 0.8698035541154109
Energy: 0.8073979983237647
Energy: 0.8606661907412756
Energy: 0.8640327801927913
Energy: 0.8721531193786461
Energy: 0.8642253845509226
Energy: 0.8598728849576692
Energy: 0.9050710888147764
Energy: 0.9173359435817648
Energy: 0.9165157265978376
Energy: 0.8774901793629944
Energy: 0.9166393727284201
Energy: 0.8946670802613429
Energy: 0.8349124099828199
Energy: 0.9079095213199425
Energy: 0.8948153934277
Energy: 0.8282198756199841
Energy: 0.8929306072296511
Energy: 0.8947755174067965
Energy: 0.8912764226147781
Energy: 0.9256099760053242
Energy: 0.925193797863763
Energy: 0.8933825766925954
Energy: 0.9254711715470406
Energy: 0.9288134285846156
Energy: 1.0240178075519226
Energy: 0.8638896234837055
Energy: 0.86378553801418
Energy: 1.0248500840072063
Energy: 0.8638426023673076
Energy: 0.8636209640370003
Energy: 0.8528034180047865
Energy: 0.863648444044207
Energy: 0.862284502672216
Energy: 0.9270131950993087
Energy: 0.8150131065271721
Energy: 0.9463476011746587
Energy: 0.7640934635624317
Energy: 0.8719890774513547
Energy: 0.8716373432023993
Energy: 0.7401403976704678
Energy: 0.8718853045033755
Energy: 0.8552809521966791
Energy: 0.7643141285745381
Energy: 0.8709207568596157
Energy: 0.8147428429843735
Energy: 0.8819650865138093
Energy: 0.8709359886851997
Energy: 0.8148347112531762
Energy: 0.9330936944949665
Energy: 0.8597379562758339
Energy: 0.859712545942382
Energy: 0.9397575775226276
Energy: 0.9003033220292508
Energy: 0.8604226726812034
Energy: 0.8843641833838638
Energy: 0.7907243484546367
Energy: 0.7908370331192824
Energy: 0.8754359826180586
Energy: 0.7908711021689818
Energy: 0.829499405947045
Energy: 0.8847784503674401
Energy: 0.8740848652331448
Energy: 0.8775444809788266
Energy: 0.8858570796045802
Energy: 0.8734458534609516
Energy: 0.8784017615616803
Energy: 0.8853766785438295
Energy: 0.8693712021754777
Energy: 0.8694946940978281
Energy: 0.8721214323108512
Energy: 0.8715139642315648
Energy: 0.8684623801458172
Energy: 0.885595304048723
Energy: 0.8748391637956352
Energy: 0.8750158495690449
Energy: 0.870629181466393
Energy: 0.8702867152483792
Energy: 0.8769161545221916
Energy: 0.8958136307463606
Energy: 0.8729085168459128
Energy: 0.873116585063096
Energy: 0.8632861487712086
Energy: 0.8813998143011307
Energy: 0.8727421827711989
Energy: 0.8956438108583531
Energy: 0.8783993037594112
Energy: 0.8860463670510886
Energy: 0.8956497756968964
Energy: 0.8864798317250069
Energy: 0.8847246001923577
Energy: 0.8988026432651975
Energy: 0.916389818434368
Energy: 0.8831595229385287
Energy: 0.8983562401711496
Energy: 0.924504494904182
Energy: 0.7922391882508962
Energy: 1.031349252953809
Energy: 0.8637445025909568
Energy: 0.8636390770172222
Energy: 0.9146697912478118
Energy: 0.8639364538439341
Energy: 0.903748448004606
Energy: 0.9625616205211666
Energy: 0.863470123064872
Energy: 0.8631546236444966
Energy: 0.7996243471262628
Energy: 0.868904553644056
Energy: 0.8902789361451544
Energy: 0.8373077122849909
Energy: 0.8335459743090265
Energy: 0.8149694972445485
Energy: 0.8814835519494406
Energy: 0.8285013359655549
Energy: 0.8783288697015332

minimum gb energy = 0.7401403976704678 eV
minimum distance =  2.26370969338003 Angstroms
sigma value = 17


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

Energy: 0.6954574397970585
Energy: 0.9085015370973382
Energy: 0.888643269071353
Energy: 0.7611043812142846
Energy: 0.8140770858464693
Energy: 0.7609014316786049
Energy: 0.7288601273335383
Energy: 0.8172776750816713
Energy: 0.7907076011535681
Energy: 0.810327220429753
Energy: 0.8025147249396889
Energy: 0.7290837442705388
Energy: 0.8075871545864548
Energy: 0.6941980572921789
Energy: 0.6961636435552211
Energy: 0.8052489257931803
Energy: 0.6941251248449091
Energy: 0.6951611837827478
Energy: 0.8048296616270536
Energy: 0.6941646882215249
Energy: 0.6962578628284634
Energy: 0.8047752244476892
Energy: 0.6942072238560073
Energy: 0.8048767973725617
Energy: 0.8058757127232282
Energy: 0.7248814461482269
Energy: 0.7016580579540405
Energy: 0.8067179807165988
Energy: 0.7137163391299269
Energy: 0.7013669384345615
Energy: 0.7296050651968146
Energy: 0.7024462365991238
Energy: 0.7021833803245073
Energy: 0.69780349611851
Energy: 0.7103962746776747
Energy: 0.6969449454396198
Energy: 0.7103995747298018
Energy: 0.7106001838733138
Energy: 0.7104812460176875
Energy: 0.7207261057492758
Energy: 0.7108790708895127
Energy: 0.7069008305641272
Energy: 0.710759823923676
Energy: 0.7002897676258455
Energy: 0.712918008454064
Energy: 0.7005380225826673
Energy: 0.7001163758571818
Energy: 0.7122768643528736
Energy: 0.712523216803391
Energy: 0.7007037041563245
Energy: 0.7001681151164725
Energy: 0.7110012990091268
Energy: 0.6998337114207184
Energy: 0.7112083833394639
Energy: 0.7102070975766457
Energy: 0.7011573017308173
Energy: 0.7011925397865063
Energy: 0.7101246848076593
Energy: 0.7014401818843203
Energy: 0.7015332229857719
Energy: 0.7131169888428948
Energy: 0.7015898256473998
Energy: 0.7015167093143977
Energy: 0.7204274290602046
Energy: 0.8057680059794786
Energy: 0.7016111495032394
Energy: 0.8029077721437149
Energy: 0.8049501375549841
Energy: 0.8049570385001142
Energy: 0.8006557793752436
Energy: 0.805082502242549
Energy: 0.8054109398431005
Energy: 0.8037100874945953
Energy: 0.7902946964110639
Energy: 0.7897183947420404
Energy: 0.7252332416934677
Energy: 0.8001655224872442
Energy: 0.7767318761289658
Energy: 0.8142076503541514
Energy: 0.800744847727249
Energy: 0.7902138964079577
Energy: 0.8030304806393783
Energy: 0.8078260067473384
Energy: 0.7289004497654507
Energy: 0.9569373025647518
Energy: 0.7984943093239365
Energy: 0.7979140780993398
Energy: 0.9560651670446975
Energy: 0.7981849372349523
Energy: 0.8160590562568936
Energy: 0.838023474090435
Energy: 0.8025285280499843
Energy: 0.719745566889621
Energy: 0.8165410567493285
Energy: 0.8103702480268915
Energy: 0.7773140523310645
Energy: 0.8763154941564926
Energy: 0.7903017763950453
Energy: 0.8661335961743986
Energy: 0.7191375004581602
Energy: 0.8244408340013839
Energy: 0.8665539340145658

minimum gb energy = 0.6941251248449091 eV
minimum distance =  2.35026271683728 Angstroms
sigma value = 17


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

Energy: 0.6451562667610045
Energy: 0.8607437934407197
Energy: 0.7196480227117722
Energy: 0.6987008734914276
Energy: 0.7807475915352701
Energy: 0.7198614498766415
Energy: 0.7037875538196425
Energy: 0.7534268097085581
Energy: 0.7523548424802415
Energy: 0.7720586899673751
Energy: 0.7524560382795296
Energy: 0.6589763694950238
Energy: 0.9346042209114657
Energy: 0.6508334711766409
Energy: 0.6614707068386385
Energy: 0.7717339720857957
Energy: 0.6510843133641095
Energy: 0.6618512489416433
Energy: 0.7734717537418687
Energy: 0.6626471317755784
Energy: 0.6619121908620536
Energy: 0.7743198899836972
Energy: 0.6624391052964419
Energy: 0.6860941614939049
Energy: 0.6826688969468455
Energy: 0.6604966942283461
Energy: 0.6619220056753511
Energy: 0.6834066336010352
Energy: 0.6810902703982424
Energy: 0.6588984409835752
Energy: 0.621689790953182
Energy: 0.6600571542548487
Energy: 0.6494067351598862
Energy: 0.6505014008582539
Energy: 0.6739512938112936
Energy: 0.6496578253430305
Energy: 0.6321754451343284
Energy: 0.6747171792143758
Energy: 0.6741055036931642
Energy: 0.6486273524327747
Energy: 0.6765542254427289
Energy: 0.6595488013913707
Energy: 0.6321288975393502
Energy: 0.634322159392576
Energy: 0.6423791832166589
Energy: 0.6529657855422023
Energy: 0.634495997128364
Energy: 0.6426356615791081
Energy: 0.6332054081319636
Energy: 0.6421259319139168
Energy: 0.6444578838900468
Energy: 0.6343524248023903
Energy: 0.6432570435102195
Energy: 0.6332517744571734
Energy: 0.6332965131610325
Energy: 0.6368176217210537
Energy: 0.636487224264935
Energy: 0.6327875940080143
Energy: 0.6376832329719684
Energy: 0.6366321846921851
Energy: 0.6467069907812719
Energy: 0.6439178836087934
Energy: 0.6371103705646538
Energy: 0.6370611993835463
Energy: 0.6333078043727473
Energy: 0.6368873004747857
Energy: 0.6348616122234522
Energy: 0.6332925881824193
Energy: 0.6332055342328432
Energy: 0.6437486986260349
Energy: 0.636662596089318
Energy: 0.6434303692011605
Energy: 0.6449936721369277
Energy: 0.6439673135433017
Energy: 0.6432219718200195
Energy: 0.6422672370540369
Energy: 0.6437338108287183
Energy: 0.6422827807764334
Energy: 0.6747943253132441
Energy: 0.64935881171479
Energy: 0.6461681709819844
Energy: 0.6747706522336562
Energy: 0.6484985808816125
Energy: 0.6739895599609771
Energy: 0.6737371903071319
Energy: 0.6433277974592073
Energy: 0.6431809742995993
Energy: 0.6738134883844902
Energy: 0.6433832347699849
Energy: 0.6594203442761346
Energy: 0.7766819994706257
Energy: 0.6834943868772899
Energy: 0.6593106118424529
Energy: 0.6810608628315893
Energy: 0.7720929163021504
Energy: 0.6605525679699719
Energy: 0.6320923986291287
Energy: 0.7715281288755456
Energy: 0.7716914384844311
Energy: 0.6803717939258592
Energy: 0.7713526818839037
Energy: 0.6605890352260999
Energy: 0.6845530069226573
Energy: 0.7520560377621609
Energy: 0.7380598255765748
Energy: 0.6911005753954104
Energy: 0.7718412569558786
Energy: 0.6610392787472918
Energy: 0.8602660202178847
Energy: 0.7730009748107611
Energy: 0.7063710322901461
Energy: 0.7726457186263375
Energy: 0.6809643492976877
Energy: 0.6615484897505189
Energy: 0.9309725128260864
Energy: 0.6819825649665724
Energy: 0.6740876153449683
Energy: 0.7755584136309577
Energy: 0.6814489623674025
Energy: 0.7571256658081357
Energy: 0.8949958578050213
Energy: 0.738691968466569
Energy: 0.7517025738456494
Energy: 0.7739758444646299
Energy: 0.7671250725264653
Energy: 0.7530528909573831
Energy: 0.6410493397208918
Energy: 0.7579362929929238
Energy: 0.823383786613085
Energy: 0.6914023502287648
Energy: 0.7701107846838513
Energy: 0.6937300662613088
Energy: 0.6438551645180352
Energy: 0.7527658699121709
Energy: 0.7525243966251192
Energy: 0.6451294043662033
Energy: 0.7538181531421475
Energy: 0.8063255191313926
Energy: 0.8956098221944493
Energy: 0.6654013025625082
Energy: 0.7201449203543465
Energy: 0.7724883894538455
Energy: 0.6611591552249431
Energy: 0.7201085551509908
Energy: 0.7714027416773845
Energy: 0.6511486924203345
Energy: 0.6645191493929768
Energy: 0.7715810857609277
Energy: 0.6511064723987624
Energy: 0.6616742803493978
Energy: 0.7749508408843688
Energy: 0.6827192463636844
Energy: 0.66051098415552
Energy: 0.7753262877036589
Energy: 0.6829867525909419
Energy: 0.7269792838681206
Energy: 0.6219160630958406
Energy: 0.6596374614019223
Energy: 0.6599907796462123
Energy: 0.6504570645552761
Energy: 0.6601216437021571
Energy: 0.6498544198001233
Energy: 0.6728334844880057
Energy: 0.6743648089850495
Energy: 0.6746718102240786
Energy: 0.673366573692234
Energy: 0.6755557134057221
Energy: 0.6744097328590996
Energy: 0.6333532063730257
Energy: 0.6447390158659101
Energy: 0.6448386813135747
Energy: 0.6459949025972237
Energy: 0.6737912182191789
Energy: 0.6494603328427605
Energy: 0.633202702551624
Energy: 0.63440120346446
Energy: 0.6421650320379187
Energy: 0.6333008519100103
Energy: 0.6344457051367047
Energy: 0.6421210725180582
Energy: 0.6370197689299022
Energy: 0.6396551436508862
Energy: 0.6384825462257505
Energy: 0.6334231935502198
Energy: 0.6366824416959788
Energy: 0.6379054612005746
Energy: 0.6334729009377793
Energy: 0.6404252704154945
Energy: 0.639280311123018
Energy: 0.6425939544957543
Energy: 0.636883879398515
Energy: 0.6393231187208727
Energy: 0.7002131237139898
Energy: 0.6330723654350702
Energy: 0.6330846049213907
Energy: 0.7005746614678173
Energy: 0.6336323360437461
Energy: 0.633081256845866
Energy: 0.6321894593059252
Energy: 0.6420148888683845
Energy: 0.6425881420458884
Energy: 0.6757163042735977
Energy: 0.6437046704981358
Energy: 0.646308073932501
Energy: 0.6741235562438778
Energy: 0.6461930734199538
Energy: 0.6457213754708907
Energy: 0.6739128987691969
Energy: 0.6478111214483475
Energy: 0.646695561053558
Energy: 0.6739656657691135
Energy: 0.6427880194367931
Energy: 0.6586762739780044
Energy: 0.6740605657963349
Energy: 0.6426502398073098
Energy: 0.681331760582863
Energy: 0.7780609586164025
Energy: 0.672268798159153
Energy: 0.6582432950848959
Energy: 0.6839263175852306
Energy: 0.6827689604815673
Energy: 0.6612076835740525
Energy: 0.6312412138599715
Energy: 0.7715569653645122
Energy: 0.7714641627195967
Energy: 0.6903033970395377
Energy: 0.7726768200001966
Energy: 0.7711861525365876
Energy: 0.6321559544439838
Energy: 0.7520411761295107
Energy: 0.6734390763154088
Energy: 0.6590754661654168
Energy: 0.753537254385177
Energy: 0.6590760492387732
Energy: 0.8597273520143064
Energy: 0.7600459126217618
Energy: 0.718733347547296
Energy: 0.7729064489846661
Energy: 0.7759668684728294
Energy: 0.6829368453121553
Energy: 0.8640234958059227
Energy: 0.6738650573247966
Energy: 0.7368256776833565
Energy: 0.7718154185093641
Energy: 0.659756268904867
Energy: 0.7374932817357489
Energy: 0.8937250649033156
Energy: 0.70495256416163
Energy: 0.7517317789360238
Energy: 0.7735441186476092
Energy: 0.6810425158754927
Energy: 0.7202917772005861
Energy: 0.6450364211966692
Energy: 0.7533647062492964
Energy: 0.7384093105386036
Energy: 0.6463365575523372
Energy: 0.7796046608924867
Energy: 0.8063323396238337

minimum gb energy = 0.621689790953182 eV
minimum distance =  2.33771713418899 Angstroms
sigma value = 57


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

Energy: 0.7334563084901217
Energy: 0.809487426338547
Energy: 0.6611580474756039
Energy: 0.6427935764905396
Energy: 0.9667199623923851
Energy: 0.6565075395016687
Energy: 0.8251683230028952
Energy: 0.7497930616204704
Energy: 0.7118507603413481
Energy: 0.7332094759791019
Energy: 0.7358733642392492
Energy: 0.6187737373773772
Energy: 0.8689714692377987
Energy: 0.6095107323970899
Energy: 0.6097513966752925
Energy: 0.738222259634172
Energy: 0.6098151333445487
Energy: 0.6308301816644376
Energy: 0.7357080867442787
Energy: 0.609685158287756
Energy: 0.6308093272024716
Energy: 0.7356550801275514
Energy: 0.65567376294839
Energy: 0.654899768692869
Energy: 0.6743062519282089
Energy: 0.6459684746338284
Energy: 0.6253040502311156
Energy: 0.6744468553838736
Energy: 0.6471949248166946
Energy: 0.6366050424889066
Energy: 0.5694018782983044
Energy: 0.6444619161536642
Energy: 0.6089287034399958
Energy: 0.5892592505269265
Energy: 0.6444783035631564
Energy: 0.6089921321886699
Energy: 0.7385387493592513
Energy: 0.6503658068142634
Energy: 0.6449931525052672
Energy: 0.6070537989313675
Energy: 0.6473079926986292
Energy: 0.6072540070830872
Energy: 0.7833329019818923
Energy: 0.5878644798549136
Energy: 0.5876394431375056
Energy: 0.6082087998094547
Energy: 0.5881486126729661
Energy: 0.5984244737228169
Energy: 0.5990642647225091
Energy: 0.5986668004764695
Energy: 0.6080144625273814
Energy: 0.6002486894934315
Energy: 0.6130752298236204
Energy: 0.5971718934924652
Energy: 0.5969384162325915
Energy: 0.5904252664057952
Energy: 0.58966616946928
Energy: 0.5971751624382109
Energy: 0.6069198262514746
Energy: 0.5900754921782769
Energy: 0.5933695459209771
Energy: 0.5751198442476575
Energy: 0.5936098943088802
Energy: 0.5801630321039349
Energy: 0.5753004278893108
Energy: 0.5838835167172562
Energy: 0.5998769304118424
Energy: 0.5818580606319822
Energy: 0.5753661122462121
Energy: 0.5952629381591331
Energy: 0.5785694653058212
Energy: 0.583883413773964
Energy: 0.5754113595971824
Energy: 0.6262258467694708
Energy: 0.6250865815728172
Energy: 0.5828073997961256
Energy: 0.6085847344190635
Energy: 0.6048063749163348
Energy: 0.5756229959074094
Energy: 0.5861673205481746
Energy: 0.5747643858974041
Energy: 0.5769673097751453
Energy: 0.5934595447553717
Energy: 0.5750323610914961
Energy: 0.5749901907047633
Energy: 0.5848340786384428
Energy: 0.5844410367695037
Energy: 0.5750160756409542
Energy: 0.608379540803152
Energy: 0.5849205520642434
Energy: 0.692136259383123
Energy: 0.5972934989991937
Energy: 0.5960984750132521
Energy: 0.5959071982528951
Energy: 0.5969303463606692
Energy: 0.5947802289715189
Energy: 0.6084201675083497
Energy: 0.5972444809373044
Energy: 0.5973540485935321
Energy: 0.6108617896216846
Energy: 0.6027528893615534
Energy: 0.6033244736454356
Energy: 0.6076290586036366
Energy: 0.6056068951916024
Energy: 0.606068781930078
Energy: 0.6447352811190206
Energy: 0.6053687946156794
Energy: 0.6033472276950624
Energy: 0.644806207393707
Energy: 0.6078724949632383
Energy: 0.6446200893783915
Energy: 0.6459159593258957
Energy: 0.6082615867434447
Energy: 0.6446950547101998
Energy: 0.81163247419713
Energy: 0.5989962859094513
Energy: 0.5986918780782432
Energy: 0.6500057756939682
Energy: 0.5992436727073959
Energy: 0.6449482800302446
Energy: 0.8101006083189225
Energy: 0.6482674848004474
Energy: 0.6150554709636104
Energy: 0.6481740348507757
Energy: 0.6462841361804917
Energy: 0.6463201172939199
Energy: 0.6357537664278294
Energy: 0.733185313707977
Energy: 0.6241518681316413
Energy: 0.6010608526742328
Energy: 0.7327974094202526
Energy: 0.6225767423059813
Energy: 0.6543117955812401
Energy: 0.704344331623999
Energy: 0.6807329236353075
Energy: 0.6543060659599198
Energy: 0.7364531491953659
Energy: 0.6750718160073484
Energy: 0.8097656600829927
Energy: 0.6460317099206845
Energy: 0.6231186422750395
Energy: 0.7348173499487433
Energy: 0.6492214846349702
Energy: 0.6264669022643384
Energy: 0.8689599229588486
Energy: 0.628525544084975
Energy: 0.6258042607649316
Energy: 0.7328520336916476
Energy: 0.6234064580699059
Energy: 0.6982842326982205
Energy: 0.8376688339149012
Energy: 0.7192054373912145
Energy: 0.6807931982997072
Energy: 0.7380851514969796
Energy: 0.739063668815822
Energy: 0.6383472994126711
Energy: 0.5801114772159441
Energy: 0.7193154301543153
Energy: 0.6308337450586528
Energy: 0.6131404803754045
Energy: 0.7333796068065511
Energy: 0.6304698539752918

minimum gb energy = 0.5694018782983044 eV
minimum distance =  2.38076424613635 Angstroms
sigma value = 43


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

Energy: 0.49403604356183667
Energy: 0.7023887441719332
Energy: 0.5804423279404284
Energy: 0.5395507341986318
Energy: 0.6335949667727567
Energy: 0.5631362294819623
Energy: 0.7011558357901546
Energy: 0.6378175851362743
Energy: 0.5218441003765394
Energy: 0.6317893337473041
Energy: 0.6320136163687429
Energy: 0.520471941405294
Energy: 0.7062089915695919
Energy: 0.5091735147942587
Energy: 0.5226328528073748
Energy: 0.6320518325227905
Energy: 0.5105558341866537
Energy: 0.5231031974138495
Energy: 0.6346730814994911
Energy: 0.5224889431793609
Energy: 0.5233336742777637
Energy: 0.6318101567286113
Energy: 0.5414017483976019
Energy: 0.5595068310339332
Energy: 0.5875514982593076
Energy: 0.5578878760363825
Energy: 0.5219406886839899
Energy: 0.5878364678039453
Energy: 0.5662818091189327
Energy: 0.5216460898504292
Energy: 0.4793430825083721
Energy: 0.5645571241999779
Energy: 0.514626280966107
Energy: 0.4937222553482374
Energy: 0.564483611800754
Energy: 0.5037086335465185
Energy: 0.6345076975065341
Energy: 0.5651730834446081
Energy: 0.5646724143427789
Energy: 0.506332650444898
Energy: 0.5647841455290823
Energy: 0.5053302431928198
Energy: 0.6717217881443568
Energy: 0.4907934054433718
Energy: 0.4987576264767008
Energy: 0.5056628319323513
Energy: 0.49089097795444625
Energy: 0.49861791025604935
Energy: 0.5269719040356509
Energy: 0.49904429263066763
Energy: 0.5260454141138095
Energy: 0.5283723613955834
Energy: 0.5396292610187942
Energy: 0.5252130126625966
Energy: 0.5252332082066621
Energy: 0.5045941231198712
Energy: 0.5013748721681884
Energy: 0.5252776003200961
Energy: 0.5021525050031379
Energy: 0.5014329447319908
Energy: 0.5021815400959083
Energy: 0.5002123979649166
Energy: 0.4924404365441775
Energy: 0.48405716806708105
Energy: 0.5001298944835755
Energy: 0.48794741267836667
Energy: 0.52545625268016
Energy: 0.5004101812723668
Energy: 0.5004110957350562
Energy: 0.49757044881099355
Energy: 0.5006306469180032
Energy: 0.4990262667756296
Energy: 0.6510775832151167
Energy: 0.4822324253963656
Energy: 0.484416320804856
Energy: 0.6530456982935385
Energy: 0.48249882087395835
Energy: 0.484547040426533
Energy: 0.4851466081262474
Energy: 0.5332989506678076
Energy: 0.48519022544931223
Energy: 0.486625903000547
Energy: 0.5017025256608805
Energy: 0.4852432561578384
Energy: 0.48528011197677295
Energy: 0.4834281668876474
Energy: 0.48298086262177126
Energy: 0.48521323887972423
Energy: 0.4945806620420618
Energy: 0.4861679163006862
Energy: 0.5638472388705152
Energy: 0.4781558487746579
Energy: 0.48449420942906213
Energy: 0.48206600669886296
Energy: 0.4782300934092376
Energy: 0.48202217425467303
Energy: 0.4880596457960234
Energy: 0.47813616481746174
Energy: 0.4779112337794216
Energy: 0.48370503372356444
Energy: 0.47830929821091855
Energy: 0.48522777651584714
Energy: 0.5672119652224917
Energy: 0.5061928868048201
Energy: 0.49537742842224386
Energy: 0.5677366742619715
Energy: 0.5054131556006284
Energy: 0.4947596656296488
Energy: 0.478128961865632
Energy: 0.48853527543546643
Energy: 0.4782535276426405
Energy: 0.47895448412586805
Energy: 0.5787658400682445
Energy: 0.4780249890163334
Energy: 0.6459867596713381
Energy: 0.4957780025400312
Energy: 0.495575709819866
Energy: 0.6475245362873499
Energy: 0.4958901528810978
Energy: 0.5084051822356666
Energy: 0.5027250364460197
Energy: 0.48539764602120333
Energy: 0.48513707666179867
Energy: 0.48953598020868205
Energy: 0.48543393234187104
Energy: 0.4907016803413705
Energy: 0.47894470511363957
Energy: 0.4852132698681836
Energy: 0.49233780625021956
Energy: 0.4847013213526929
Energy: 0.48528517699468005
Energy: 0.48462531081566457
Energy: 0.5001681496433992
Energy: 0.4870918105482597
Energy: 0.4868041328570897
Energy: 0.5002118312930287
Energy: 0.5059326207906113
Energy: 0.4872356023058921
Energy: 0.5003970991923657
Energy: 0.4968338985029267
Energy: 0.5003291239524968
Energy: 0.5019088407331104
Energy: 0.5252013209618228
Energy: 0.5002204938654212
Energy: 0.658760635910035
Energy: 0.48663206194987546
Energy: 0.492674292971718
Energy: 0.6609050838579067
Energy: 0.486797707262915
Energy: 0.4924804978331706
Energy: 0.5648384262088192
Energy: 0.52538434222721
Energy: 0.5253077654403465
Energy: 0.5012737212864051
Energy: 0.5255517696631146
Energy: 0.5009410319050114
Energy: 0.5133911668141982
Energy: 0.525404405973196
Energy: 0.5057542185266803
Energy: 0.48882483227421947
Energy: 0.525405225837063
Energy: 0.4956597049608654
Energy: 0.5493247189192665
Energy: 0.509876187084208
Energy: 0.5062873814586597
Energy: 0.5647044588034842
Energy: 0.5233817375578841
Energy: 0.5065933199670981
Energy: 0.5663009424616976
Energy: 0.509343909167617
Energy: 0.5650629888583355
Energy: 0.5675073082525238
Energy: 0.5633938715636896
Energy: 0.564645037667928
Energy: 0.6928676494572602
Energy: 0.4993014326679638
Energy: 0.5094951268258913
Energy: 0.5528613221614401
Energy: 0.49941897179155104
Energy: 0.5092590255067302
Energy: 0.6915367592591553
Energy: 0.5555761366710406
Energy: 0.5531172688996939
Energy: 0.5525701428453876
Energy: 0.5607177998668375
Energy: 0.524846633828213
Energy: 0.4856476890298974
Energy: 0.6317475988890688
Energy: 0.5333868754084654
Energy: 0.5074247513406167
Energy: 0.6318163545645434
Energy: 0.5163655977580376
Energy: 0.6323683801368304
Energy: 0.5833810844408234
Energy: 0.558711238601605
Energy: 0.5466207275053139
Energy: 0.6340098541168796
Energy: 0.5586378678118907
Energy: 0.6902855989343253
Energy: 0.5387548687933458
Energy: 0.5384437428868701
Energy: 0.6322306234881991
Energy: 0.5680563717340475
Energy: 0.590926605838563
Energy: 0.7061535111241204
Energy: 0.5237594571354609
Energy: 0.5386760950309913
Energy: 0.6320569036959076
Energy: 0.5267759934109936
Energy: 0.5595940611932667
Energy: 0.7051931139048344
Energy: 0.5988966950456671
Energy: 0.5585339904040071
Energy: 0.6319404906106582
Energy: 0.6318520081900755
Energy: 0.5581557026640875

minimum gb energy = 0.4779112337794216 eV
minimum distance =  2.38342718240556 Angstroms
sigma value = 81


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

Energy: 0.03204353893446746
Energy: 0.5794034010320283
Energy: 0.0326319433202667
Energy: 0.033892976902345114
Energy: 0.034906103699854064
Energy: 0.032556561994128416
Energy: 0.06588680792533937
Energy: 0.03331682618361707
Energy: 0.03344738105626041
Energy: 0.06561687234042207
Energy: 0.03339132884992492
Energy: 0.033477607543285125
Energy: 0.06476409373733337
Energy: 0.032503305930653474
Energy: 0.03261455938716471
Energy: 0.06471807170981693
Energy: 0.0323930768661601
Energy: 0.06495600958494416
Energy: 0.03385954286423582
Energy: 0.03252787331776844
Energy: 0.03273623037886181
Energy: 0.0332068675825981
Energy: 0.03258916175490377
Energy: 0.06551279897143088
Energy: 0.06497026656283668
Energy: 0.06479456851660552
Energy: 0.06467964312142867
Energy: 0.06610692174608779
Energy: 0.06484336498828547
Energy: 0.06478070130839318
Energy: 0.033130012909305125
Energy: 0.03323242286148324
Energy: 0.03262343088580956
Energy: 0.03439980639210373
Energy: 0.03332249641045342
Energy: 0.03261040115220108
Energy: 0.06507593738171856
Energy: 0.033323396492891746
Energy: 0.033178238792548685
Energy: 0.06469183465259978
Energy: 0.03321179668259696
Energy: 0.03348962086469976
Energy: 0.06464523630802053
Energy: 0.03250595383301889
Energy: 0.03276532587997292
Energy: 0.06468086002006262
Energy: 0.03243557604922442
Energy: 0.06539480429729197
Energy: 0.034615437919549234
Energy: 0.032629218747189166
Energy: 0.06620941599199251
Energy: 0.034596774706972686
Energy: 0.03261244842258058
Energy: 0.06688023239224215
Energy: 0.03241881145407605
Energy: 0.06506458660268502
Energy: 0.06483847916759782
Energy: 0.032831122747617916
Energy: 0.06487453633642211
Energy: 0.06482641773917323

minimum gb energy = 0.03204353893446746 eV
minimum distance =  2.54762344407671 Angstroms
sigma value = 3


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

Energy: 0.5994116276115836
Energy: 0.6182850613134697
Energy: 0.5904846634921689
Energy: 0.5827224074542657
Energy: 0.5912186130942123
Energy: 0.5879531448419968
Energy: 0.6116311534852859
Energy: 0.6043154446049206
Energy: 0.6043277713846359
Energy: 0.5891593466649837
Energy: 0.6045718927707271
Energy: 0.6044509033999184
Energy: 0.6327554804952416
Energy: 0.5775062133398254
Energy: 0.5775242366498762
Energy: 0.6071012526978097
Energy: 0.5776887666245863
Energy: 0.5954369822331707
Energy: 0.5888328304372368
Energy: 0.5780100500421926
Energy: 0.5784166287540284
Energy: 0.5888016238845533
Energy: 0.5343922348418476
Energy: 0.5953728873424461
Energy: 0.5361021276735147
Energy: 0.5990995268093624
Energy: 0.5997058677596627
Energy: 0.535897225580574
Energy: 0.6045796405194466
Energy: 0.6043283906256165
Energy: 0.567792123622617
Energy: 0.6022004809113545
Energy: 0.5888794409199228
Energy: 0.5579848304848724
Energy: 0.600503753701464
Energy: 0.5578117888596644
Energy: 0.5906374188170028
Energy: 0.5440267606111714
Energy: 0.5901785125099994
Energy: 0.5907003861206965
Energy: 0.5454229650387944
Energy: 0.5960451159842169
Energy: 0.5882736190181076
Energy: 0.5649392640297367
Energy: 0.5650091699509657
Energy: 0.5883250382283803
Energy: 0.5411518011991917
Energy: 0.5471401593696557
Energy: 0.5914797856509644
Energy: 0.5645674974139333
Energy: 0.5989785342550732
Energy: 0.596236443151568
Energy: 0.5043025775425649
Energy: 0.5940883447624725
Energy: 0.5486447827594321
Energy: 0.5447229182342453
Energy: 0.5444730342389251
Energy: 0.5486820441839123
Energy: 0.5459139932126102
Energy: 0.5542401263727521
Energy: 0.5598739077029297
Energy: 0.5716120884717083
Energy: 0.5717267514985401
Energy: 0.54642442970932
Energy: 0.5648358062487272
Energy: 0.5467487049131253
Energy: 0.5101712928419451
Energy: 0.5737268436459918
Energy: 0.5727262680909219
Energy: 0.5104126747712151
Energy: 0.5741477741882892
Energy: 0.5087614487115903
Energy: 0.5083265002732126
Energy: 0.5353299578506823
Energy: 0.5512713354149107
Energy: 0.5084508885315656
Energy: 0.5351646723049871
Energy: 0.5295433709687346
Energy: 0.5492989512811782
Energy: 0.5230949145155122
Energy: 0.550784177621038
Energy: 0.5527151474300418
Energy: 0.5229485451365856
Energy: 0.5517090785028518
Energy: 0.5503402065032377
Energy: 0.48478895627315066
Energy: 0.48497829431065814
Energy: 0.5481814533456787
Energy: 0.485901457597752
Energy: 0.48541532616188915
Energy: 0.5485130089743859
Energy: 0.5380564794924884
Energy: 0.5403514780603121
Energy: 0.5381538116078991
Energy: 0.5418194216821558
Energy: 0.5399774320550924
Energy: 0.47805920679931585
Energy: 0.5397603772555204
Energy: 0.5394054267085432
Energy: 0.47680703055694773
Energy: 0.5386780804788717
Energy: 0.4749009926471219
Energy: 0.4772046510363063
Energy: 0.535615489242687
Energy: 0.5356295273454946
Energy: 0.47686114202089364
Energy: 0.5352973122682413
Energy: 0.5351332451284805
Energy: 0.541134028896853
Energy: 0.5402358969042558
Energy: 0.5347253590861305
Energy: 0.5352972498577977
Energy: 0.5404727408226476
Energy: 0.5353784060345594
Energy: 0.5406255447612666
Energy: 0.4739172672919464
Energy: 0.4735247380581983
Energy: 0.5413392637274349
Energy: 0.47738767025641915
Energy: 0.4735534267443297
Energy: 0.5405211472409873
Energy: 0.5385243749095723
Energy: 0.5403821582513505
Energy: 0.5408829140354579
Energy: 0.547798493794435
Energy: 0.539335529463014
Energy: 0.49427888125255115
Energy: 0.5384536795836455
Energy: 0.513198613152639
Energy: 0.4853527076267346
Energy: 0.5524990242879896
Energy: 0.48476239474048244
Energy: 0.4868194084496318
Energy: 0.5509260659580225
Energy: 0.5511084520650227
Energy: 0.48680865552541214
Energy: 0.550857837617069
Energy: 0.5512386403705347
Energy: 0.5525403510885093
Energy: 0.50859840025174
Energy: 0.5505601972775787
Energy: 0.5411996318143876
Energy: 0.508477116657193
Energy: 0.5411168452824558
Energy: 0.5652380078670884
Energy: 0.5094002186484321
Energy: 0.5091246110269281
Energy: 0.5670791442068963
Energy: 0.5102524276806374
Energy: 0.508817768935001
Energy: 0.5665228129317627
Energy: 0.5561096497951119
Energy: 0.556437605808492
Energy: 0.5654487539599369
Energy: 0.5363055111735908
Energy: 0.5716318131431074
Energy: 0.5463433761099791
Energy: 0.5559531336849393
Energy: 0.5564981618450848
Energy: 0.5464528542023784
Energy: 0.5733578345301943
Energy: 0.5442405576247171
Energy: 0.5205719775422863
Energy: 0.6012168712833391
Energy: 0.6000947610516535
Energy: 0.520572538793775
Energy: 0.5950292775811287
Energy: 0.5998610825530586
Energy: 0.5664460105922713
Energy: 0.5857672935393902
Energy: 0.579891462958102
Energy: 0.5504909830632893
Energy: 0.5886844348574007
Energy: 0.5506622487758299
Energy: 0.543709699155028
Energy: 0.5920986846685978
Energy: 0.5893305521738732
Energy: 0.5437224238195509
Energy: 0.5912249120027577
Energy: 0.5896929167751069
Energy: 0.60042776237365
Energy: 0.5721825265039822
Energy: 0.5719296415189475
Energy: 0.5999841510255096
Energy: 0.5446717282417248
Energy: 0.5718539378749824
Energy: 0.6339112763834778
Energy: 0.572135012613661
Energy: 0.610135917323686
Energy: 0.603896641962837
Energy: 0.5440475004463561
Energy: 0.5995473004990225
Energy: 0.5497672875672338
Energy: 0.5889133879151935
Energy: 0.5891556844102973
Energy: 0.5497979015926409
Energy: 0.5914602866438121
Energy: 0.5734566988794759

minimum gb energy = 0.4735247380581983 eV
minimum distance =  2.29340487353724 Angstroms
sigma value = 67


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

Energy: 0.735408796069548
Energy: 0.7290857332432864
Energy: 0.7277581347505868
Energy: 0.7019723499211176
Energy: 0.7051414178109413
Energy: 0.7447033391136567
Energy: 0.7229280660240057
Energy: 0.720869454235427
Energy: 0.7205761887141002
Energy: 0.7204105109827127
Energy: 0.7349467347338358
Energy: 0.7181112685643893
Energy: 0.7571324281754919
Energy: 0.700496618165443
Energy: 0.7133486410718021
Energy: 0.721280604907203
Energy: 0.7004836070802064
Energy: 0.7134381615852516
Energy: 0.700176749216114
Energy: 0.7135624855087399
Energy: 0.7138181548291519
Energy: 0.6998568811172953
Energy: 0.701573911941309
Energy: 0.7138058293282598
Energy: 0.6913903278432278
Energy: 0.7345023631290779
Energy: 0.7202285442639152
Energy: 0.6914791204737176
Energy: 0.7359921584066051
Energy: 0.7189093002490011
Energy: 0.6891685948824114
Energy: 0.7092423806414706
Energy: 0.6949083583985673
Energy: 0.67932733073691
Energy: 0.7067140698167917
Energy: 0.6953145350141023
Energy: 0.6955987734969287
Energy: 0.6925690365638433
Energy: 0.6913858759847391
Energy: 0.6916472818981607
Energy: 0.6904497887070591
Energy: 0.6899885298485778
Energy: 0.6935301719888547
Energy: 0.676544873464282
Energy: 0.676330293777268
Energy: 0.691907024931538
Energy: 0.6759507390616694
Energy: 0.6948196506254595
Energy: 0.691474129036226
Energy: 0.7064895289294322
Energy: 0.705209925280927
Energy: 0.6978599430237286
Energy: 0.6347683311161948
Energy: 0.7086569849199619
Energy: 0.6966698032631338
Energy: 0.6404642526121582
Energy: 0.635488630694004
Energy: 0.6975632196991153
Energy: 0.637477112144698
Energy: 0.6357193186385773
Energy: 0.692100160640972
Energy: 0.6782799484566718
Energy: 0.6785653952232058
Energy: 0.6778775995404914
Energy: 0.6793194501066968
Energy: 0.6784480826688822
Energy: 0.6059371044399448
Energy: 0.680196867551754
Energy: 0.6795881030767005
Energy: 0.6043251965996885
Energy: 0.6811561720906641
Energy: 0.6039948892383247
Energy: 0.6043170273077402
Energy: 0.6681536815276421
Energy: 0.6717879784468166
Energy: 0.6044400575838553
Energy: 0.6680931695222013
Energy: 0.6040562334826942
Energy: 0.6751798236335869
Energy: 0.6795242646463524
Energy: 0.6706880830021931
Energy: 0.6683084473288858
Energy: 0.6753916559534359
Energy: 0.6702659515833979
Energy: 0.6752643185285657
Energy: 0.6085224860669319
Energy: 0.6044539795514425
Energy: 0.6760789239000243
Energy: 0.6050671736027188
Energy: 0.6038971208446298
Energy: 0.6772439208951843
Energy: 0.6789166413122324
Energy: 0.6810661864107866
Energy: 0.6813258156257853
Energy: 0.6487548702714205
Energy: 0.6789058848193316
Energy: 0.6443414980288338
Energy: 0.665717011004287
Energy: 0.6700074014242815
Energy: 0.636446537515491
Energy: 0.6659746293836507
Energy: 0.6361437914047728
Energy: 0.6353992819558368
Energy: 0.7049355346635626
Energy: 0.7067347222002394
Energy: 0.6351895754761716
Energy: 0.7045753063325132
Energy: 0.6351827481615279
Energy: 0.677318435742776
Energy: 0.6937113585335118
Energy: 0.6867038408226205
Energy: 0.6859258527376373
Energy: 0.6910073519356656
Energy: 0.6866929946647096
Energy: 0.681500812954593
Energy: 0.6912082831020456
Energy: 0.6905631048209595
Energy: 0.6814892790701473
Energy: 0.6930722075575307
Energy: 0.6904094833974169
Energy: 0.6902446761634299
Energy: 0.7196788536835311
Energy: 0.7196573984535691
Energy: 0.6899737832838551
Energy: 0.7024113400406934
Energy: 0.7197971136541232
Energy: 0.7572215219201521
Energy: 0.6832523218981487
Energy: 0.7195126512979748
Energy: 0.721321010617491
Energy: 0.6832522749025953
Energy: 0.7196581954140294
Energy: 0.72284837415607
Energy: 0.694966689138101
Energy: 0.6939225041350251
Energy: 0.7230240280669493
Energy: 0.6932280726039322
Energy: 0.6903020119592256

minimum gb energy = 0.6038971208446298 eV
minimum distance =  2.30306410679415 Angstroms
sigma value = 33


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

Energy: 0.8526303006249756
Energy: 0.8554751818192582
Energy: 0.8585732503231058
Energy: 0.821416790103421
Energy: 0.8595655170310867
Energy: 0.8224053545602664
Energy: 0.7991763256512552
Energy: 0.8178207272702781
Energy: 0.8142980419437872
Energy: 0.8176669850184028
Energy: 0.8174525401481795
Energy: 0.8141611796480082
Energy: 0.8723051964781731
Energy: 0.8020220579698943
Energy: 0.8020404013856804
Energy: 0.81707841038346
Energy: 0.802064091307421
Energy: 0.802146946857245
Energy: 0.8154309912815941
Energy: 0.8041312804904671
Energy: 0.8038069480019094
Energy: 0.8153474728556777
Energy: 0.7523434933151824
Energy: 0.8036696554949686
Energy: 0.7561304846843244
Energy: 0.8118116749111564
Energy: 0.8140120901501259
Energy: 0.7563514048219416
Energy: 0.8191686213718122
Energy: 0.8136954004480705
Energy: 0.791182368986185
Energy: 0.8119115403812016
Energy: 0.8119748027079526
Energy: 0.7446407746870191
Energy: 0.8038297358455496
Energy: 0.7741460927554923
Energy: 0.7564377971257177
Energy: 0.8145264923471577
Energy: 0.8126855581890476
Energy: 0.7563842236669336
Energy: 0.8131053559496254
Energy: 0.7522670298298908
Energy: 0.7567217147422836
Energy: 0.7778146553111698
Energy: 0.7784834146720829
Energy: 0.7568018017527309
Energy: 0.6913911485650515
Energy: 0.7521091731397985
Energy: 0.7700605525262073
Energy: 0.778714217745044
Energy: 0.7770577902868449
Energy: 0.771651950354791
Energy: 0.6898934314016983
Energy: 0.7776785822901446
Energy: 0.7733096503697257
Energy: 0.6910803993837291
Energy: 0.6907155045127866
Energy: 0.7744651671049143
Energy: 0.6917629746719569
Energy: 0.6903530019921642
Energy: 0.7720598192151993
Energy: 0.7409658007930787
Energy: 0.7619663541988992
Energy: 0.7613807240862697
Energy: 0.7337755789959032
Energy: 0.7627617550850264
Energy: 0.6907053355272179
Energy: 0.7616558692347977
Energy: 0.7619090030761968
Energy: 0.6905137889104938
Energy: 0.7577751747601239
Energy: 0.6906325942451035
Energy: 0.6901347169135681
Energy: 0.7767764577765912
Energy: 0.7778764445350289
Energy: 0.6902079927788763
Energy: 0.7780893084022409
Energy: 0.6905232216802281
Energy: 0.7745925224752584
Energy: 0.7769405858128172
Energy: 0.7778273260034279
Energy: 0.7580122942476897
Energy: 0.7731616070077746
Energy: 0.7579991164712417
Energy: 0.7804991457386606
Energy: 0.7567995608570978
Energy: 0.7520122003575362
Energy: 0.7762048352290358
Energy: 0.7591304728469356
Energy: 0.7520162713073457
Energy: 0.8079224337795894
Energy: 0.7902907452540043
Energy: 0.790229022499905
Energy: 0.8055629772819952
Energy: 0.706690939706849
Energy: 0.8125556066787559
Energy: 0.871847186308052
Energy: 0.7906020223435812
Energy: 0.7904866772975099
Energy: 0.816683413383155
Energy: 0.7066214745542103
Energy: 0.7903401739654875
Energy: 0.84962920529498
Energy: 0.8178730772436476
Energy: 0.8093827766248436
Energy: 0.8187152101683607
Energy: 0.8181557249898304
Energy: 0.8024089476638662
Energy: 0.8017121819843667
Energy: 0.8173431168781329
Energy: 0.8248363100147789
Energy: 0.7599772927278965
Energy: 0.8173280220385587
Energy: 0.7885956871632861
Energy: 0.7989856812353281
Energy: 0.8177246325927512
Energy: 0.8178864997958659
Energy: 0.7992406492805513
Energy: 0.8191173592868987
Energy: 0.8138473122915558
Energy: 0.8686536306093485
Energy: 0.8036045021326375
Energy: 0.8034409212113771
Energy: 0.8155928890578316
Energy: 0.8080097837338625
Energy: 0.8032590747435819
Energy: 0.8165452378674785
Energy: 0.8024131669442374
Energy: 0.8025351533031114
Energy: 0.8163798740195483
Energy: 0.8021364531472986
Energy: 0.8023485741591798
Energy: 0.7566188617423373
Energy: 0.8143129904349351
Energy: 0.813966020177989
Energy: 0.7558550429868439
Energy: 0.8177095708425692
Energy: 0.8139880199963535
Energy: 0.7912682477764831
Energy: 0.8026039247366968
Energy: 0.8116250544204671
Energy: 0.7742894810852274
Energy: 0.8033412091263863
Energy: 0.7742946957891412
Energy: 0.7563117519912418
Energy: 0.813881049600281
Energy: 0.8135176839081733
Energy: 0.756244952280859
Energy: 0.814013076288117
Energy: 0.7525976607431698
Energy: 0.7650044232623081
Energy: 0.7777842393921688
Energy: 0.7529771519348067
Energy: 0.7569569194123386
Energy: 0.7449066940364888
Energy: 0.7518900226616297
Energy: 0.7709172586485773
Energy: 0.7775155444366216
Energy: 0.7768327427508315
Energy: 0.7727332715238754
Energy: 0.7487160250810477
Energy: 0.7790755851954445
Energy: 0.7718312552580392
Energy: 0.6911450828404643
Energy: 0.6906966453686242
Energy: 0.7733223547096975
Energy: 0.6926419856854104
Energy: 0.6905202274687717
Energy: 0.7723326816631573
Energy: 0.7337739224807399
Energy: 0.7619013177413172
Energy: 0.7194675152365114
Energy: 0.732441412102284
Energy: 0.7621709625773029
Energy: 0.6903427723794483
Energy: 0.7619451114714286
Energy: 0.7616866351986269
Energy: 0.6904383640280478
Energy: 0.7575917794335241
Energy: 0.69073296747576
Energy: 0.6911408101900068
Energy: 0.7764353987450453
Energy: 0.6910014402915254
Energy: 0.6908988539835261
Energy: 0.7773658387183124
Energy: 0.690490039971914
Energy: 0.7748608295124889
Energy: 0.7775311327299718
Energy: 0.7780094856647776
Energy: 0.7576039882314708
Energy: 0.7719013161954077
Energy: 0.7575672012191865
Energy: 0.7735813119954946
Energy: 0.7564156843752096
Energy: 0.7520562986856905
Energy: 0.7738324489697672
Energy: 0.7616907690669524
Energy: 0.7520080942281521
Energy: 0.8012002157092352
Energy: 0.7601184636193159
Energy: 0.8101184494932173
Energy: 0.8092602122194146
Energy: 0.7062636476376013
Energy: 0.8098380124819279
Energy: 0.8691013645088542
Energy: 0.7913329947187336
Energy: 0.7913384143528899
Energy: 0.8168534670881467
Energy: 0.7553409844430721
Energy: 0.7909516540697484
Energy: 0.8494401335850459
Energy: 0.8130283327587825
Energy: 0.8093242446223279
Energy: 0.8179183589112193
Energy: 0.7558797158363993
Energy: 0.8030063556547244
Energy: 0.8022924969184742
Energy: 0.8167323017439274
Energy: 0.8247388849922762
Energy: 0.788354972094387
Energy: 0.8171859313630419
Energy: 0.7885814745002065

minimum gb energy = 0.6898934314016983 eV
minimum distance =  2.30961710777067 Angstroms
sigma value = 41


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

Energy: 0.9806448803519026
Energy: 0.988782715118596
Energy: 0.9897058448558386
Energy: 0.9027359801522118
Energy: 0.8477966336690186
Energy: 0.9880134951979033
Energy: 0.8685019227108947
Energy: 0.8469028375584146
Energy: 0.8458641310548681
Energy: 0.9044097093903167
Energy: 0.8477358234943756
Energy: 0.8522128365589122
Energy: 0.9831866157522351
Energy: 0.8773652129590498
Energy: 0.912715438648818
Energy: 0.8471122506215016
Energy: 0.8357166026379174
Energy: 0.9128473248768711
Energy: 0.8474269910968891
Energy: 0.8778340458554614
Energy: 0.912772982009132
Energy: 0.8464032992563993
Energy: 0.8348981134336715
Energy: 0.8322537625788157
Energy: 0.8303283576413482
Energy: 0.8472872904436701
Energy: 0.8518307291806377
Energy: 0.8303425890853591
Energy: 0.8475381778794446
Energy: 0.851273331465841
Energy: 0.9213694644772046
Energy: 0.8506595578455408
Energy: 0.8498776124996642
Energy: 0.8350128275154661
Energy: 0.859008956090557
Energy: 0.850810692282463
Energy: 0.8290017121795745
Energy: 0.9123372499263553
Energy: 0.8854800770051041
Energy: 0.8293130217173993
Energy: 0.9115144288336589
Energy: 0.8383279560787525
Energy: 0.8303194846240132
Energy: 0.807603373581473
Energy: 0.8383375507969766
Energy: 0.8297145373175304
Energy: 0.8389282504325882
Energy: 0.8386306192027577
Energy: 0.8940889920304601
Energy: 0.8395887027576071
Energy: 0.8397132427369371
Energy: 0.8906500957927411
Energy: 0.8583362264478896
Energy: 0.8830417521002468
Energy: 0.8555422607586978
Energy: 0.8351244517286992
Energy: 0.8392575938159195
Energy: 0.8460463590627685
Energy: 0.8309185889548056
Energy: 0.8384049029380666
Energy: 0.860368875426315
Energy: 0.8403619118706122
Energy: 0.850045300386838
Energy: 0.851314244407272
Energy: 0.7865179665782505
Energy: 0.8520558214280479
Energy: 0.982619187337325
Energy: 0.8800328142699847
Energy: 0.8806856150730411
Energy: 0.8476166280995
Energy: 0.7869693793599124
Energy: 0.8801144728363324
Energy: 0.9753169217488515
Energy: 0.8325147174308913
Energy: 0.890757068994086
Energy: 0.8475992342247455
Energy: 0.9085669443396677
Energy: 0.9124326894019033
Energy: 0.9225436027195016
Energy: 0.8470601588859351
Energy: 0.7888835600481727
Energy: 0.7850036063831373
Energy: 0.846290653259204
Energy: 0.7893495994525552

minimum gb energy = 0.7850036063831373 eV
minimum distance =  2.37953623271165 Angstroms
sigma value = 11


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

Energy: 0.9936729064728324
Energy: 1.1033922798728577
Energy: 1.1995456574957124
Energy: 1.07308452158116
Energy: 1.099225382044744
Energy: 1.0357059200877294
Energy: 1.0514894841043
Energy: 0.9498978848316056
Energy: 0.9457310822671603
Energy: 0.9716003249640317
Energy: 0.9506375312586641
Energy: 0.9728062913013725
Energy: 1.0981889877236803
Energy: 0.9438477394961097
Energy: 0.9446590030985642
Energy: 1.0545903938281425
Energy: 0.9438368970295032
Energy: 0.9621196025755341
Energy: 0.9968938003304572
Energy: 0.962127002268902
Energy: 0.9653953153770997
Energy: 0.9969303801593732
Energy: 0.9556015277120123
Energy: 0.9671718592451525
Energy: 0.970776856967536
Energy: 0.9517817559551208
Energy: 0.9526324470431926
Energy: 0.9429418432847494
Energy: 0.9511062311359176
Energy: 0.972571745688294
Energy: 0.9978219302427699
Energy: 0.9551996515611046
Energy: 0.9552801744874057
Energy: 0.9759950519227519
Energy: 0.989667873790636
Energy: 0.9638444609812312
Energy: 0.9703760857324768
Energy: 0.954959948650538
Energy: 0.9554736053181128
Energy: 0.9705392836503582
Energy: 0.9660099344976922
Energy: 0.9516552648673668
Energy: 0.9606291663187728
Energy: 0.9594117609474632
Energy: 0.9711018982303657
Energy: 0.9506226816394328
Energy: 0.9702779246301569
Energy: 0.9693002476922312
Energy: 0.9930292034762174
Energy: 0.9734092443872728
Energy: 0.9704787790535018
Energy: 0.9418913692559514
Energy: 0.9530950889162879
Energy: 0.9420763023292097
Energy: 0.9931283061050923
Energy: 0.9730166586347643
Energy: 0.9706394949515569
Energy: 0.9574318662595149
Energy: 0.965330075609929
Energy: 0.9661259097397253
Energy: 0.9604000111375265
Energy: 0.9570791005047736
Energy: 0.9734465902465128
Energy: 0.9509335103541535
Energy: 0.9485194168878329
Energy: 0.968230457974814
Energy: 1.0014967434331388
Energy: 0.9667640142401523
Energy: 1.0062094084736466
Energy: 1.00223611219896
Energy: 0.9479645336324644
Energy: 0.9771888879883363
Energy: 0.9452078911297985
Energy: 0.9774693121311168
Energy: 0.975128978767145
Energy: 0.9451384127707784
Energy: 0.9710773790066586
Energy: 0.9561446726231626
Energy: 0.9639905034507044
Energy: 0.952712682970207
Energy: 0.9529034854489581
Energy: 0.9632116998623869
Energy: 1.0326326171422942
Energy: 0.9482900597687666
Energy: 0.9454273937055061
Energy: 0.9647325117117409
Energy: 0.9652103589278649
Energy: 0.9493420811356731
Energy: 0.9683937208983464
Energy: 0.9645080741358356
Energy: 0.9394713354208863
Energy: 0.9646126983568698
Energy: 0.9649823838465394
Energy: 0.9405198535590914
Energy: 0.9649951932099846
Energy: 0.9654033682642661
Energy: 0.9568996308958646
Energy: 0.9647503868237691
Energy: 0.9648830205984422
Energy: 0.9569038653093523
Energy: 0.9754495499609247
Energy: 0.9595842023750866
Energy: 0.9538401662046606
Energy: 0.9809496297504816
Energy: 0.9804133400680445
Energy: 0.9714951761073831
Energy: 1.0191769170423883
Energy: 0.9536624401242624
Energy: 0.9494755043706222
Energy: 0.9564209856774466
Energy: 0.9623177274122056
Energy: 0.9499952176825806
Energy: 0.9647437146980703
Energy: 0.968734536727232
Energy: 0.9731722806161212
Energy: 0.9423322346242825
Energy: 0.9434335439963931
Energy: 0.9558276812668568
Energy: 0.9422645100265826
Energy: 0.9629620189492911
Energy: 1.0144390165767512
Energy: 0.9662303340451338
Energy: 0.9585074351716015
Energy: 0.962755192744002
Energy: 0.9533900030235788
Energy: 0.9633676355773504
Energy: 0.9806807421764386
Energy: 0.9620468529454612
Energy: 0.9631246587935365
Energy: 0.9464498193953672
Energy: 0.9605933755110618
Energy: 0.9674548843526822
Energy: 0.9630714187319138
Energy: 0.9554279770451531
Energy: 0.9674118383335396
Energy: 0.9427308235284193
Energy: 0.9610486126867933
Energy: 0.9840074256477932
Energy: 1.0141718704597382
Energy: 0.9499193549778503
Energy: 0.951962515169494
Energy: 0.94989395357445
Energy: 0.9500638397496208
Energy: 0.9613797725057048
Energy: 1.0173486424445768
Energy: 0.9640492871682999
Energy: 0.9627815993833417
Energy: 0.9989284466923447
Energy: 0.9737012676980028
Energy: 0.9480701963605861
Energy: 1.0080719655758317
Energy: 0.9485083398479606
Energy: 0.9486375089883701
Energy: 0.980866505970088
Energy: 0.9477741129958897
Energy: 0.9642746365503098
Energy: 1.0081015427353297
Energy: 0.9396037372974001
Energy: 0.9617306623058205
Energy: 0.9645442355496616
Energy: 0.9412746348913587
Energy: 0.9653153069981917
Energy: 0.9973168982887426
Energy: 0.9556923767928959
Energy: 0.9651085442727294
Energy: 0.9818056788740817
Energy: 0.9542479738964688
Energy: 0.9658653591017655
Energy: 1.0980742846414515
Energy: 0.9435550287257091
Energy: 0.9461950424250967
Energy: 1.0626695604757788
Energy: 0.9802699071114188
Energy: 0.9635978267074948
Energy: 1.0980470571267809
Energy: 0.9464372048881848
Energy: 0.9565162639874507
Energy: 0.9764294699515587
Energy: 0.9455692171284568
Energy: 0.9648232770308764
Energy: 0.9755038155579016
Energy: 0.999888757248783
Energy: 0.9519705865703175
Energy: 0.9415477059418503
Energy: 0.9994291013771489
Energy: 0.9798137306645943

minimum gb energy = 0.9394713354208863 eV
minimum distance =  2.25683658281722 Angstroms
sigma value = 57


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

Energy: 1.2558907464142837
Energy: 1.0503091385178842
Energy: 1.0512154590424299
Energy: 1.0519116189912783
Energy: 1.3264938762011347
Energy: 1.0512229104875968
Energy: 0.9719018257873804
Energy: 0.9949830832347019
Energy: 0.9931699952945938
Energy: 0.9752277941235992
Energy: 0.9807321222942174
Energy: 0.9853654807709527
Energy: 1.0417108039948881
Energy: 0.9996472165463988
Energy: 1.0029923320800747
Energy: 1.0142566956118975
Energy: 1.000406790646092
Energy: 1.017014728686667
Energy: 0.9763412735494309
Energy: 0.9793238955786439
Energy: 0.9821421202714186
Energy: 0.9765762310992891
Energy: 1.0006047161023068
Energy: 0.9906969263263105
Energy: 0.9751833046636592
Energy: 1.0146823846650685
Energy: 0.9935587694257083
Energy: 0.973405168652303
Energy: 1.0143590682935193
Energy: 0.9933601210282853
Energy: 0.9808335018682726
Energy: 1.0215496340129533
Energy: 1.0117531023759114
Energy: 1.013402844482869
Energy: 1.023626207847543
Energy: 1.0154445520067679
Energy: 1.0226248016568191
Energy: 0.9471771181581906
Energy: 0.9615560857851803
Energy: 1.021126413747998
Energy: 0.9443099635091103
Energy: 1.0105885619371295
Energy: 1.0427607986437029
Energy: 0.9780475800354241
Energy: 0.9805317106009327
Energy: 0.9798282394399351
Energy: 0.9729821371035456
Energy: 0.9862088902496714
Energy: 0.9696705212591346
Energy: 1.0138760348733074
Energy: 1.0409729984128777
Energy: 0.9931391309306917
Energy: 1.013986470801798
Energy: 1.0430500681852442
Energy: 0.9697471209479577
Energy: 1.0138795381817667
Energy: 1.0412449757371904
Energy: 0.9820838995768604
Energy: 1.0157244948665909
Energy: 1.0431537704367164
Energy: 1.0440371309501968
Energy: 0.9787814055396987
Energy: 0.9800977555324496
Energy: 0.9677319391909595
Energy: 0.9734112571946391
Energy: 0.983347052829444
Energy: 1.0169464391600154
Energy: 0.9994091664222122
Energy: 1.0003912056212851
Energy: 1.0149293350426394
Energy: 1.0004976722469716
Energy: 1.0166599436115307
Energy: 0.9784938995507417
Energy: 0.9842966423369319
Energy: 0.9833742929755861
Energy: 0.9816289932536902
Energy: 0.9792320059307585
Energy: 0.9829504123874656
Energy: 0.9652673043032773
Energy: 1.0145108160148124
Energy: 1.0188024359069874
Energy: 1.0036726013661315
Energy: 1.0152536055489414
Energy: 1.0165301436242504
Energy: 0.9772866126115776
Energy: 0.9431328201790135
Energy: 0.9939276745076533
Energy: 0.9730174502226132
Energy: 0.942935420448745
Energy: 0.9932633491528973
Energy: 1.0408896822089078
Energy: 0.9445015163626969
Energy: 0.9842879208011033
Energy: 1.0407531059513366
Energy: 0.9416210202883051
Energy: 1.01778219790341
Energy: 0.9707214558503016
Energy: 0.9852902758348897
Energy: 0.9889874913479686
Energy: 0.9776456293470001
Energy: 0.9804759802895214
Energy: 0.9841342022430604

minimum gb energy = 0.9416210202883051 eV
minimum distance =  2.3224747861613 Angstroms
sigma value = 9


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

Energy: 1.4563946031170123
Energy: 0.9879027070920535
Energy: 1.0313735192783249
Energy: 1.023860638301852
Energy: 1.0679277914742384
Energy: 1.0331081824768484
Energy: 1.1465308062582356
Energy: 1.002221876903469
Energy: 1.0017849656423972
Energy: 1.0113645325465466
Energy: 1.002045020645935
Energy: 1.0127833061961231
Energy: 1.0559196171539877
Energy: 1.0440218256794314
Energy: 1.067804212762477
Energy: 1.049151279166095
Energy: 1.0418674377590287
Energy: 1.0432062611428095
Energy: 1.0227164645810691
Energy: 1.023623337672754
Energy: 1.0218902741992348
Energy: 1.0321599075643328
Energy: 1.0285693932953857
Energy: 1.0218336356955633
Energy: 1.0194424131955737
Energy: 1.0021741302576523
Energy: 1.0043472604723456
Energy: 1.019305151173414
Energy: 1.0034301430895138
Energy: 1.00579260399883
Energy: 1.017025485415437
Energy: 1.0092691573313695
Energy: 1.0076794836683143
Energy: 1.012464462831028
Energy: 1.0069342168292439
Energy: 1.0073846719047486
Energy: 1.026855231448441
Energy: 1.063646430966723
Energy: 1.0190316618303055
Energy: 1.0008757468208183
Energy: 1.0672187186535054
Energy: 1.0184508601266367
Energy: 1.063357598045883
Energy: 1.0256430986688592
Energy: 1.0116403263619809
Energy: 1.0159277729348497
Energy: 1.0295756891602408
Energy: 1.0113491120617482
Energy: 1.1224979887294633
Energy: 1.0011740620856246
Energy: 1.002667594031225
Energy: 1.048220763307391
Energy: 1.0009370399975994
Energy: 1.0434836393863614
Energy: 1.121649118281268
Energy: 1.0008146518044783
Energy: 1.0050310356456702
Energy: 1.057381413918626
Energy: 0.9997821840973391
Energy: 1.0074122185371308
Energy: 1.0638554381214813
Energy: 1.012774316065992
Energy: 1.010601899851479
Energy: 0.9984071194671089
Energy: 1.016827388137488
Energy: 1.0093083952717283
Energy: 1.0638423607167156
Energy: 1.0155089386998852
Energy: 1.0131754340941723
Energy: 1.0020057745732756
Energy: 1.0129256663547
Energy: 1.0125503259279203
Energy: 1.1419274353336477
Energy: 1.0417643835447674
Energy: 1.0423752008898435
Energy: 1.0752444393847713
Energy: 1.0435008967060868
Energy: 1.0644225464469865
Energy: 1.137614254503608
Energy: 1.0496927958356068
Energy: 1.049261523128661
Energy: 1.0733593203991707
Energy: 1.0490028152373176
Energy: 1.0500752885346987
Energy: 1.0812384609636894
Energy: 1.012084507815965
Energy: 1.0102979477518659
Energy: 0.9990436454970184
Energy: 1.0155121930363884
Energy: 1.0066004822329564
Energy: 1.042807518826732
Energy: 1.062475516804514
Energy: 0.9928596135649171
Energy: 1.046850621343857
Energy: 1.0474639642412944
Energy: 1.0017030334197463
Energy: 1.0826636607894429
Energy: 1.023623383081485
Energy: 1.02433198135647
Energy: 1.05345895955006
Energy: 1.049859039861321
Energy: 1.0261461136071708
Energy: 1.086654602762943
Energy: 1.0464068170861376
Energy: 1.0456371844959753
Energy: 1.0467038279087502
Energy: 1.049077575165776
Energy: 1.0459155005131773
Energy: 1.05416488007021
Energy: 1.0148101030616765
Energy: 1.0143633064609603
Energy: 1.0462601034229808
Energy: 1.027607218864622
Energy: 1.0128672168431794
Energy: 1.0559244964596837
Energy: 1.0167361175901721
Energy: 1.0153263760278286
Energy: 1.0506689794868944
Energy: 1.0216843247631688
Energy: 1.0445639936191717
Energy: 1.1071248659001878
Energy: 1.0147311306129165
Energy: 1.0136344432731594
Energy: 1.030381692354452
Energy: 1.001117308002157
Energy: 1.0138823316776187

minimum gb energy = 0.9879027070920535 eV
minimum distance =  2.24431300987299 Angstroms
sigma value = 27


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

Energy: 1.0132396892960038
Energy: 0.9763883169801674
Energy: 0.9147834747725753
Energy: 0.9344026195419864
Energy: 1.2619804817959277
Energy: 0.9749076774114298
Energy: 1.0217126354495591
Energy: 0.9599474349044117
Energy: 0.9617450847061872
Energy: 0.9869658625286704
Energy: 0.9670789227616222
Energy: 0.9970856135930425
Energy: 1.0713157912273834
Energy: 1.0347512829353671
Energy: 0.9648161480556388
Energy: 0.9833003794963984
Energy: 0.9674845896282765
Energy: 1.0345604271836386
Energy: 1.054394540457326
Energy: 0.9623981377200014
Energy: 1.0575138899875762
Energy: 1.037624423325226
Energy: 0.9611661358220357
Energy: 1.0299736551676615
Energy: 0.975338772384849
Energy: 0.9624996043292016
Energy: 0.9850470979724324
Energy: 0.9753126581456902
Energy: 0.9976124309246648
Energy: 0.988334448474718
Energy: 1.0593665136628125
Energy: 0.9792936890468679
Energy: 0.9879914397861245
Energy: 1.0624936120975312
Energy: 0.9742471016102169
Energy: 0.978263734840331
Energy: 1.1176882286029581
Energy: 0.9183892658405141
Energy: 0.917429519392516
Energy: 0.9870726581585216
Energy: 0.9145510064731501
Energy: 0.9163402566184785
Energy: 1.1129256064977313
Energy: 0.94225416070929
Energy: 0.9850054865078716
Energy: 1.0586630927209328
Energy: 0.9526981191881412
Energy: 0.9864738939665754
Energy: 1.2072867996698098
Energy: 0.9895394318382903
Energy: 0.9914632619242778
Energy: 0.9902185970297206
Energy: 0.9894394461704555
Energy: 0.9885027302917776
Energy: 1.2065189706891124
Energy: 1.0145681921285281
Energy: 0.9885553820356381
Energy: 0.9899813534393725
Energy: 1.0160902994062093
Energy: 0.9858568991340523
Energy: 1.1160340365074326
Energy: 1.02168180774884
Energy: 1.0214092696324035
Energy: 1.023430602469625
Energy: 0.9761568190029243
Energy: 1.0212194377904669
Energy: 1.112625456741784
Energy: 0.9916586702065834
Energy: 0.9909185691423845
Energy: 0.9921880037504243
Energy: 0.9922839416733119
Energy: 0.9918131262597971
Energy: 0.9426837514530729
Energy: 0.991432310722164
Energy: 0.9148500077864926
Energy: 0.941154405479994
Energy: 0.9914154466757364
Energy: 0.9147804999946413
Energy: 0.9497504854327119
Energy: 0.9907501895384493
Energy: 0.9913023007348976
Energy: 0.9514203715188534
Energy: 1.0396183325610597
Energy: 0.9148830040375265
Energy: 1.0699102114160242
Energy: 0.9916292032847932
Energy: 0.9912507081357472
Energy: 0.998365622938276
Energy: 0.9934483084845523
Energy: 0.992312763088251
Energy: 1.0708226483011047
Energy: 0.9912713134179402
Energy: 0.9933930958927472
Energy: 1.014572009186826
Energy: 0.9934307466030623
Energy: 1.0108385084966802
Energy: 0.9770963399157293
Energy: 1.020344803411407
Energy: 1.0207214868772758
Energy: 0.9761499293103967
Energy: 1.0254336837948117
Energy: 1.0028108788229058
Energy: 1.049397537682142
Energy: 0.9856368549026279
Energy: 0.9912098069518657
Energy: 0.9827576738903196
Energy: 0.9871886294283201
Energy: 0.9869927857908511
Energy: 1.1114789852163098
Energy: 0.9150470362686813
Energy: 0.9150327464948214
Energy: 0.9867103843668898
Energy: 0.9515439021527243
Energy: 0.9147429389645338
Energy: 1.1177209777728843
Energy: 0.91506735301062
Energy: 0.9150529673351955
Energy: 0.9613815359615611
Energy: 0.9530454148410468
Energy: 0.9147438946609753
Energy: 1.2105335713540728
Energy: 0.9903067535658365
Energy: 0.9867204811629353
Energy: 0.9860698331539111
Energy: 0.988949844616498
Energy: 0.9893927440809758
Energy: 0.9660579127449253
Energy: 0.9741975338990704
Energy: 1.0397233180016758
Energy: 0.9667218165725846
Energy: 0.9720437135744494
Energy: 1.0403403118925532
Energy: 1.1158274548455573
Energy: 0.982177104199147
Energy: 0.9604987016388893
Energy: 0.9611585963149789
Energy: 1.0465973126151626
Energy: 1.0559402694499496
Energy: 1.1311068744803328
Energy: 1.0324637344830934
Energy: 0.9626561637581297
Energy: 0.9629865219609396
Energy: 0.9610646142103904
Energy: 1.0307890279970817
Energy: 1.0208580873381499
Energy: 0.9610837109705411
Energy: 0.9605277511876017
Energy: 0.9513562920839757
Energy: 0.9605802774126379
Energy: 0.9747625430561457

minimum gb energy = 0.9145510064731501 eV
minimum distance =  2.30306592333947 Angstroms
sigma value = 19


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

Energy: 1.430414736583013
Energy: 1.0743344339677463
Energy: 0.9358592669257567
Energy: 0.9226705986100163
Energy: 1.0819092323976929
Energy: 0.9526083629760943
Energy: 1.0902916600798358
Energy: 0.9703481111605329
Energy: 0.9427114030592372
Energy: 0.942421826521697
Energy: 0.9691377050550283
Energy: 0.9425145903861369
Energy: 1.047585032748453
Energy: 0.9383675674338425
Energy: 0.9399926349365442
Energy: 0.938861490474722
Energy: 0.9382471062834877
Energy: 0.9405388711330167
Energy: 0.9935461083924474
Energy: 0.9431481482115928
Energy: 0.9429658447007471
Energy: 0.9617600345160184
Energy: 0.9689742781468484
Energy: 0.9426626114394996
Energy: 0.9565490127203531
Energy: 0.9386363245688144
Energy: 0.9398280821230388
Energy: 0.9482589506836223
Energy: 0.9388007574769474
Energy: 0.9384407023309382
Energy: 0.9803063680110176
Energy: 0.9429643586139524
Energy: 0.9431007139847881
Energy: 0.9571510404583015
Energy: 0.9428136937704109
Energy: 0.9431449536910925
Energy: 1.0708116187191774
Energy: 0.9453476475513255
Energy: 0.9461365842650165
Energy: 1.0454479298436645
Energy: 0.962482403028858
Energy: 0.9456968292748292
Energy: 1.0193556319632109
Energy: 0.9361053772631597
Energy: 0.9426208194772693
Energy: 1.0207156077723911
Energy: 0.9359662821245706
Energy: 0.9427371188202451
Energy: 0.9524472392526679
Energy: 0.9433198535605701
Energy: 0.9432618840091787
Energy: 0.9532475721981871
Energy: 0.9433709264739978
Energy: 0.9426138243640576
Energy: 0.9591110278678283
Energy: 0.9588367360614566
Energy: 0.9573294874846484
Energy: 0.9568354048269334
Energy: 0.9575283373216791
Energy: 0.9395089692858777
Energy: 1.0592171833609003
Energy: 0.9256300911220942
Energy: 0.9251025791378462
Energy: 0.9321766133560506
Energy: 0.9246693758068709
Energy: 0.9261138620581605
Energy: 1.0616005012121588
Energy: 0.9384343702784135
Energy: 0.9237856153506576
Energy: 0.9237133679221632
Energy: 0.9285748253913427
Energy: 0.9240166611552586
Energy: 1.0024266198300276
Energy: 0.9562898884315995
Energy: 0.9466106924150811
Energy: 0.9227062731114501
Energy: 0.9592687060580645
Energy: 0.9857773881357852
Energy: 1.0696106941221226
Energy: 0.9386237900356804
Energy: 0.9384845654880559
Energy: 0.9238919606903173
Energy: 0.969266561587928
Energy: 0.9444809190254378
Energy: 1.057544635531415
Energy: 0.9235430999329498
Energy: 0.9231845641302773
Energy: 0.9236754995791837
Energy: 0.9312781486359367
Energy: 0.923177447789206
Energy: 1.0544272687056424
Energy: 0.9322967366456975
Energy: 0.9238349828778964
Energy: 0.9238176177123263
Energy: 0.9235641665200119
Energy: 0.9239100670226793
Energy: 0.9757117354278229
Energy: 0.9486527643254844
Energy: 0.9214216345896841
Energy: 0.9257745093895599
Energy: 0.9235343416760237
Energy: 0.9607753164997186
Energy: 1.0311500963697624
Energy: 0.9235092350568875
Energy: 0.9235390430162458
Energy: 0.9229844619286739
Energy: 0.9244719261188926
Energy: 0.9236664179161909
Energy: 1.0407684850427765
Energy: 0.9216011319675098
Energy: 0.9214431949328914
Energy: 0.9691933760255845
Energy: 0.9237553740002018
Energy: 0.9235353607901542
Energy: 0.9346905542428718
Energy: 0.9214717621373667
Energy: 0.9213343722562153
Energy: 0.9583135150780114
Energy: 0.9237780961090135
Energy: 0.9233740457580872
Energy: 0.9287087857976315
Energy: 0.9236222243565777
Energy: 0.9233635745249578
Energy: 0.9323246951161818
Energy: 0.9236781345209507
Energy: 0.9231892052632383
Energy: 0.9275975586264616
Energy: 0.9235176538904116
Energy: 0.9232533904962766
Energy: 0.9314587722869571
Energy: 0.9237316850760731
Energy: 0.9231862251504778
Energy: 0.9918811062286074
Energy: 0.9180425438673873
Energy: 0.9178942753420124
Energy: 0.9384546952460793
Energy: 0.9212158711412386
Energy: 0.9507709389158966
Energy: 1.0280571540317314
Energy: 0.9177296618594896
Energy: 0.9248943027639354
Energy: 1.003620982041954
Energy: 0.924628776542507
Energy: 0.924966680230378
Energy: 1.009087435175945
Energy: 0.9237545322928005
Energy: 0.9235787163365266
Energy: 0.9353755715515448
Energy: 0.9240313107389755
Energy: 0.9235035773907074
Energy: 0.9718620710874745
Energy: 0.9238837330036163
Energy: 0.9245141801327429
Energy: 0.9381896585672719
Energy: 0.9240938736546466
Energy: 0.9755196540533042
Energy: 1.0500479391000637
Energy: 0.9382879389189288
Energy: 0.9432241597652615
Energy: 0.9389434003210769
Energy: 0.9389168188186438
Energy: 0.9389181142871309
Energy: 1.0477330861365608
Energy: 0.9427400923253101
Energy: 0.9422042313550033
Energy: 0.9435682937706587
Energy: 0.9625824700635119
Energy: 0.9422738754667226
Energy: 1.0260345109429505
Energy: 1.0388083455698214
Energy: 0.9426572751764806
Energy: 0.9154004784762673
Energy: 0.9776076802590267
Energy: 0.9233681461018397

minimum gb energy = 0.9154004784762673 eV
minimum distance =  2.25989284489962 Angstroms
sigma value = 101


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

Energy: 1.3093625504420539
Energy: 1.0583287013366465
Energy: 1.060369629201608
Energy: 1.1850585828026716
Energy: 1.0197627382634435
Energy: 1.1871330780836697
Energy: 1.056508755671093
Energy: 0.9170038391531089
Energy: 0.902110508908914
Energy: 0.8923427834198554
Energy: 0.9078530661814563
Energy: 0.9012804389176793
Energy: 1.0242535146795053
Energy: 0.8930730935575723
Energy: 0.89346008495092
Energy: 0.9283041067054261
Energy: 0.8934147831776359
Energy: 0.8940940831196051
Energy: 0.9480216708897172
Energy: 0.9016256233108675
Energy: 0.901979463545913
Energy: 0.8922858248489408
Energy: 0.9067501742417365
Energy: 0.8926025316397008
Energy: 0.9055423462675817
Energy: 0.8940167924693118
Energy: 0.8945909626169954
Energy: 0.9005717573771219
Energy: 0.9290844749896457
Energy: 0.904207595213379
Energy: 0.943776226018963
Energy: 0.9199740775564159
Energy: 0.9195291545150422
Energy: 0.9012240638188063
Energy: 0.892609506781067
Energy: 0.8925605849255538
Energy: 1.0541854271618893
Energy: 0.9005364835934022
Energy: 0.8907838082022852
Energy: 1.0605407317337643
Energy: 0.8880863551463407
Energy: 0.900275009065429
Energy: 0.8994224756477343
Energy: 0.9026314161299607
Energy: 0.9022127350728723
Energy: 0.9525372041940207
Energy: 0.8857699369471564
Energy: 0.9023695528150758
Energy: 0.8935763334751792
Energy: 0.8928564254554509
Energy: 0.8925709300848149
Energy: 0.8916747097750657
Energy: 0.8932036470939431
Energy: 0.8952989477792915
Energy: 0.8898400331102395
Energy: 0.8929216943443725
Energy: 0.8932136229225612
Energy: 0.8920493510343669
Energy: 0.8931580386566953
Energy: 0.8935433491363155
Energy: 1.0367028932673783
Energy: 0.8768786217860609
Energy: 0.8769972223305603
Energy: 0.9891991097569215
Energy: 0.8785233268251826
Energy: 0.8783950463009518
Energy: 1.032011101714871
Energy: 0.8926954496176402
Energy: 0.8933595899231824
Energy: 0.8925672752232183
Energy: 0.8927229422374179
Energy: 0.8931888800674627
Energy: 0.9325947740645825
Energy: 0.9057860571956703
Energy: 0.90528676582929
Energy: 0.8845406001491932
Energy: 0.8876317438677795
Energy: 0.9051202627548377
Energy: 0.9320764508713133
Energy: 0.8934903024539474
Energy: 0.8936668057287954
Energy: 0.8921038088804614
Energy: 0.8924679852328176
Energy: 0.8932684510995197
Energy: 1.0255452964054226
Energy: 0.893472019361091
Energy: 0.893652863351652
Energy: 0.8928106555428775
Energy: 0.8908668353128116
Energy: 0.8952756395728937
Energy: 1.0242458328435582
Energy: 0.9069663476298153
Energy: 0.893018413480368
Energy: 0.902519213016945
Energy: 0.9011767832158561
Energy: 0.8926300873715942
Energy: 0.9531581148857017
Energy: 1.043989612499058
Energy: 0.9061412508629766
Energy: 0.8665402044400695
Energy: 1.0484674713245399
Energy: 0.8763772879372888
Energy: 1.0573526639772646
Energy: 0.9024168378439232
Energy: 0.9028737688815199
Energy: 0.8998858317532993
Energy: 0.8921122100213642
Energy: 0.9251462273031302
Energy: 1.02412635704074
Energy: 0.8920987370066166
Energy: 0.901603698910457
Energy: 0.8925816144097286
Energy: 0.8939291265674097
Energy: 0.9034509280731164
Energy: 1.0040407783578031
Energy: 0.9013305658373456
Energy: 0.9023816500058037
Energy: 0.8923214532096898
Energy: 0.9031482586782961
Energy: 0.9028396894191844
Energy: 0.9078970065538245
Energy: 0.8926747780324499
Energy: 0.8946284846491778
Energy: 0.90140126571186
Energy: 0.8927770255944584
Energy: 0.9033001029277259
Energy: 0.947896555842979
Energy: 0.9032572979907662
Energy: 0.9033832607823581
Energy: 0.8993507595460103
Energy: 0.9027803328660832
Energy: 0.9028850555945166
Energy: 1.0742592436323743
Energy: 0.8889161553669116
Energy: 0.890146479281474
Energy: 1.0748317339309346
Energy: 0.885103961987556
Energy: 0.8912541328258736
Energy: 1.0549799023091535
Energy: 0.8882575341233261
Energy: 0.8887250612874825
Energy: 1.0495864309439409
Energy: 0.8843540905306172
Energy: 0.8927950568670451
Energy: 0.9019094121044622
Energy: 0.903036797333034
Energy: 0.9025012970670787
Energy: 0.9036740685400736
Energy: 0.8925336155457398
Energy: 0.9020395375376329
Energy: 0.8936547061529564
Energy: 0.892934822572405
Energy: 0.8936740349054513
Energy: 0.8885768621246106
Energy: 0.8929486344010819
Energy: 0.8927984127733355
Energy: 0.9940187392639235
Energy: 0.8783108336892549
Energy: 0.8783589902329249
Energy: 0.8924007492385923
Energy: 0.8784971756580948
Energy: 0.8778718265945056
Energy: 1.0259241370405965
Energy: 0.8763812520431917
Energy: 0.8765234398629658
Energy: 0.9502357342219111
Energy: 0.8722220684532199
Energy: 0.893063958773943
Energy: 0.931747818524236
Energy: 0.892778781534748
Energy: 0.8929773249302535
Energy: 0.8862641945004068
Energy: 0.8928672461067929
Energy: 0.8925743081057232
Energy: 0.9322427293604792
Energy: 0.8929613521214481
Energy: 0.8932227432765744
Energy: 0.8845953183291085
Energy: 0.8924956434057578
Energy: 0.8929253954017194
Energy: 1.0255579738696157
Energy: 0.8916543805167291
Energy: 0.8922934002628777
Energy: 0.8929270531215006
Energy: 0.8889291701538125
Energy: 0.8932575271178623
Energy: 1.024974257756185
Energy: 0.8930344516842356
Energy: 0.9016253698752797
Energy: 0.892893940702986
Energy: 0.9030292888436892
Energy: 0.9018357886435645
Energy: 0.9534931901760798
Energy: 0.8934841767201842
Energy: 0.9027631587074584
Energy: 0.8667928741155659
Energy: 0.8928659974683665
Energy: 0.9060774688718607

minimum gb energy = 0.8665402044400695 eV
minimum distance =  2.2497446917454 Angstroms
sigma value = 33


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

Energy: 0.014137026251011868
Energy: 0.014790372353136341
Energy: 0.014752860232596757
Energy: 0.0157069141855835
Energy: 0.7638173699513285
Energy: 0.014745845154228842
Energy: 0.01541860360992625
Energy: 0.11169830205236723
Energy: 0.11023264856275765
Energy: 0.10954343748978192
Energy: 0.11141778441528491
Energy: 0.11006405210866924
Energy: 1.105564415332343
Energy: 0.7644089551609125
Energy: 0.7626493267558424
Energy: 0.7611452936180494
Energy: 0.7623160634405833
Energy: 0.7624886127674481
Energy: 0.4502159701450679
Energy: 0.1116983020519539
Energy: 0.11023264856317098
Energy: 0.10954343748978192
Energy: 0.11141778441569823
Energy: 0.11006405210823157

minimum gb energy = 0.014137026251011868 eV
minimum distance =  2.54014754861987 Angstroms
sigma value = 1