Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Pt__MO_757342646688_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.9200000464916234
cohesive_energy=5.770453838362463
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4434970601686398e-19, 2.43348200231724e-19, 3.27387171214926e-19, 4.00798904584806e-19, 4.6584887810184e-19, 5.23958222440386e-19, 5.76112276230354e-19, 6.230352233103119e-19, 6.652894276787939e-19, 7.0331548791015e-19, 7.374787002769319e-19, 7.6807706963306395e-19, 7.9539097688949595e-19, 8.19571026649824e-19, 8.408735671754879e-19, 8.59442794363548e-19, 8.75426108464332e-19, 8.889564901384619e-19, 9.00147693926952e-19, 9.09110270017548e-19, 9.159371446550219e-19, 9.20718039730878e-19, 9.23533064076816e-19, 9.24455917818e-19, 9.2345455742175e-19, 9.2019412797156e-19, 9.14237235246348e-19, 9.050599674867958e-19, 8.92024658392572e-19, 8.74368671885892e-19, 8.511531324592319e-19, 8.212404947024519e-19, 7.832240475308999e-19, 7.35368633649954e-19, 6.755065080738119e-19, 6.00917174877942e-19, 5.08159158652512e-19, 3.9283929106709396e-19, 2.4928426466069395e-19, 7.010147622637259e-20, -1.54468252548891e-19, -4.37483942973504e-19, -7.966871377864019e-19, -1.25657912316303e-18, -1.8516996229791598e-18, -2.6318635131391197e-18, -3.6706988208583795e-18, -5.0805982370120394e-18, -7.02004907423538e-18, -9.745896268724939e-18, -1.375507092528216e-17, -2.00123076823038e-17, -3.0597888703141796e-17, -5.07226691851524e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018927836923584417
Energy: 0.10143318776826184
Energy: 0.768986400584113
Energy: 0.019948462826854314
Energy: 0.10143318776043848
Energy: 0.8908960450064117
Energy: 0.019948462827387724
Energy: 0.8908960450340305
Energy: 0.7689864005752526
Energy: 0.019948462826854314
Energy: 0.018927836923584417
Energy: 0.10143318776043848
Energy: 0.019948462825817127
Energy: 0.8908960450079823
Energy: 0.10143318776826184
Energy: 0.8908960449985883

minimum gb energy = 0.018927836923584417 eV
minimum distance =  2.64195614984375 Angstroms
sigma value = 1


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

Energy: 1.3426767823199879
Energy: 0.8488159055960174
Energy: 0.8500194791609319
Energy: 0.8075893590355958
Energy: 0.8337182226708029
Energy: 0.8792465345429958
Energy: 0.8332838622822025
Energy: 0.8792465345410552
Energy: 0.8476676080510491
Energy: 0.8479650508805927
Energy: 0.8420045383620701
Energy: 0.8479650508773581
Energy: 0.8326203397174575
Energy: 0.8381907107532518
Energy: 0.8328857990871456
Energy: 0.8381907107577802
Energy: 0.8769619159903435
Energy: 0.833390020934577
Energy: 0.8331244073875377
Energy: 0.833390020934577
Energy: 0.8338896103559607
Energy: 0.8914362725669173
Energy: 0.8334477535364694
Energy: 0.8914362725682111
Energy: 0.8738295217621973
Energy: 0.8916839440207653
Energy: 0.8761932527924999
Energy: 0.8916839440220591
Energy: 0.8740824266449995
Energy: 0.9183784991513319
Energy: 0.8474374823687444
Energy: 0.9183784991526256
Energy: 0.8752576659233038
Energy: 0.9126875138497954
Energy: 0.8475229098668053
Energy: 0.912687513845914
Energy: 0.8759769657424539
Energy: 0.9119505500384839
Energy: 0.8764960927731857
Energy: 0.9119505500404246
Energy: 0.873820191179822
Energy: 0.9118763211166712
Energy: 0.848022125613996
Energy: 0.911876321111496
Energy: 0.8813501851374699
Energy: 0.9118089551098003
Energy: 0.8456602107425496
Energy: 0.9118089551104472
Energy: 0.8755938765238708
Energy: 0.8911742346149166
Energy: 0.8738034188215806
Energy: 0.8911742346116821
Energy: 0.8343169403666909
Energy: 0.8949955079023049
Energy: 0.867663748090954
Energy: 0.894995507901011
Energy: 0.874748476339525
Energy: 0.8337331109461705
Energy: 0.8340956743585468
Energy: 0.833733110941642
Energy: 0.8043363345131639
Energy: 0.83370783971235
Energy: 0.8348363763115282
Energy: 0.8337078397129969
Energy: 0.8489955108987928
Energy: 0.8487584850889214
Energy: 0.8042618998184583
Energy: 0.8487584850889214
Energy: 0.8329223887943937
Energy: 0.8336728422881089
Energy: 0.8593359474645402
Energy: 0.8336728422868152
Energy: 0.8440817623189373
Energy: 0.8483653023361138
Energy: 0.8496939851066839
Energy: 0.8483653023328792
Energy: 0.8340663072488393
Energy: 0.8336855424821482
Energy: 0.8325014845600899
Energy: 0.8336855424795605
Energy: 0.8341169531860888
Energy: 0.8358194139538319
Energy: 0.876921942470532
Energy: 0.8358194139544787
Energy: 0.8341943413327182
Energy: 0.8338094198122904
Energy: 0.833929158051869
Energy: 0.8338094198168187
Energy: 0.8766103663332797
Energy: 0.8936695045781707
Energy: 0.8707273403168011
Energy: 0.8936695045755831
Energy: 0.8447343219175059
Energy: 0.8937632270715475
Energy: 0.8708465858966832
Energy: 0.8937632270663722
Energy: 0.8451264785074714
Energy: 0.913440172977508
Energy: 0.8774243046205632
Energy: 0.9134401729788019
Energy: 0.8772284052906667
Energy: 0.9114471406456824
Energy: 0.8770584443602082
Energy: 0.9114471406430946
Energy: 0.8473339918385486
Energy: 0.9119652542747386
Energy: 0.8740406784257589
Energy: 0.9119652542766794
Energy: 0.8443547634672974
Energy: 0.9128898449031233
Energy: 0.8785674307278216
Energy: 0.9128898448998888
Energy: 0.873978067014365
Energy: 0.8914354609529792
Energy: 0.8763131920211735
Energy: 0.8914354609536261
Energy: 0.8746187229050257
Energy: 0.8951305486128485
Energy: 0.8347164775802643
Energy: 0.8951305486134954
Energy: 0.833795008513997
Energy: 0.8337065770341704
Energy: 0.8748855617113723
Energy: 0.8337065770322298
Energy: 0.8347752306450553
Energy: 0.8335343544875787
Energy: 0.804663670900924
Energy: 0.8335343544869318
Energy: 0.8041962057613623
Energy: 0.8339786833679786
Energy: 0.849631798798827
Energy: 0.8339786833673316

minimum gb energy = 0.8041962057613623 eV
minimum distance =  2.34628120126227 Angstroms
sigma value = 1


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

Energy: 1.5223662324929776
Energy: 0.8954247141311052
Energy: 0.8958251875566178
Energy: 0.8495370860493842
Energy: 0.8810623671641568
Energy: 0.9273748692920494
Energy: 0.880313808654685
Energy: 0.9273748692920494
Energy: 0.8954664169509567
Energy: 0.8954648309061464
Energy: 0.8896480148025686
Energy: 0.895464830899508
Energy: 0.8864564604710542
Energy: 0.8818984592031682
Energy: 0.8803277144404453
Energy: 0.8818984592039059
Energy: 0.8893377634804074
Energy: 0.881945082895633
Energy: 0.8802801393896859
Energy: 0.8819450828889946
Energy: 0.8820174525069697
Energy: 0.9855176065514645
Energy: 0.880607727603477
Energy: 0.9855176065544147
Energy: 0.8798038812787605
Energy: 0.9508887634608612
Energy: 0.8815385808776588
Energy: 0.9508887634689746
Energy: 0.9244893436430188
Energy: 0.9700826715178084
Energy: 0.8917463473134173
Energy: 0.9700826715251842
Energy: 0.8892626498831525
Energy: 0.9662018853299726
Energy: 0.8445953158171974
Energy: 0.9662018853314478
Energy: 0.8916857803954207
Energy: 0.9670306176723555
Energy: 0.9288933130173891
Energy: 0.9670306176657171
Energy: 0.9250978753245389
Energy: 0.9494050424945806
Energy: 0.880533644036095
Energy: 0.9494050424960557
Energy: 0.919326158503261
Energy: 0.9546032158892037
Energy: 0.8823677350193994
Energy: 0.954603215892154
Energy: 0.8817993899994928
Energy: 0.8816070031148173
Energy: 0.9168717783987987
Energy: 0.8816070031303066
Energy: 0.8801233652568733
Energy: 0.882129763784584
Energy: 0.8455519528062136
Energy: 0.8821297637749953
Energy: 0.8485887003798818
Energy: 0.8961324934918431
Energy: 0.8950100332586822
Energy: 0.8961324934918431
Energy: 0.9128000235237399
Energy: 0.882034805857326
Energy: 0.8802074326435158
Energy: 0.882034805862489
Energy: 0.8983816451678724
Energy: 0.8960776621887108
Energy: 0.887388546399325
Energy: 0.8960776621916612
Energy: 0.8799783724780192
Energy: 0.8818009506676033
Energy: 0.8807142499715498
Energy: 0.8818009506698161
Energy: 0.8896035816098231
Energy: 0.8844841083523207
Energy: 0.8824185913614213
Energy: 0.884484108355271
Energy: 0.8794268097908148
Energy: 0.8811749709114347
Energy: 0.8815549494175796
Energy: 0.8811749709003708
Energy: 0.8797129878535686
Energy: 0.9542498698200663
Energy: 0.8950783397393404
Energy: 0.95424986980974
Energy: 0.9217276448390763
Energy: 0.9519792992919075
Energy: 0.8916223750346246
Energy: 0.9519792992963331
Energy: 0.881468917497382
Energy: 0.9667349208355375
Energy: 0.8494069342279641
Energy: 0.9667349208370126
Energy: 0.88997175010664
Energy: 0.9665699183792946
Energy: 0.8917436139508557
Energy: 0.9665699183719187
Energy: 0.9244932747549391
Energy: 0.9496113071024039
Energy: 0.8816102716594597
Energy: 0.9496113071046166
Energy: 0.9258357370166692
Energy: 0.9528570608248924
Energy: 0.8831054142566039
Energy: 0.9528570608300555
Energy: 0.8815267523533283
Energy: 0.8814956591389816
Energy: 0.9270411130985471
Energy: 0.8814956591441447
Energy: 0.8802515321534322
Energy: 0.8819321189228372
Energy: 0.8457486801626546
Energy: 0.8819321189206244
Energy: 0.8461114529146377
Energy: 0.8800911478217751
Energy: 0.8958952842604117
Energy: 0.8800911478232504

minimum gb energy = 0.8445953158171974 eV
minimum distance =  2.35295049975705 Angstroms
sigma value = 25


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

Energy: 1.4483905280892149
Energy: 0.950611463971395
Energy: 0.9517372760378483
Energy: 0.897705177963473
Energy: 0.9086582657556307
Energy: 0.9818720899745433
Energy: 0.9085382187777618
Energy: 0.9818720899720099
Energy: 0.9513956415071338
Energy: 0.9506237485128216
Energy: 0.910133838047972
Energy: 0.9506237485145365
Energy: 0.8971176143376807
Energy: 0.9398772530584756
Energy: 0.9074137011640365
Energy: 0.9398772530601904
Energy: 0.9074192044704142
Energy: 0.9400380393945263
Energy: 0.9375588022507259
Energy: 0.9400380393988136
Energy: 0.8961670196453009
Energy: 1.041807146037275
Energy: 0.938254747035382
Energy: 1.0418071460347027
Energy: 0.9368952565132364
Energy: 1.0312465498035797
Energy: 0.9389433737099531
Energy: 1.031246549804437
Energy: 0.93711920357839
Energy: 1.0189206608683516
Energy: 0.9068745145391018
Energy: 1.0189206608683516
Energy: 0.938372035752201
Energy: 1.0299091920144692
Energy: 0.8913609152091143
Energy: 1.0299091920136116
Energy: 0.936154300212173
Energy: 1.0276863868066892
Energy: 0.9384475810572452
Energy: 1.0276863868041166
Energy: 0.8912559461686373
Energy: 0.9402027581919149
Energy: 0.9380803159451415
Energy: 0.9402027581901999
Energy: 0.8917471796502291
Energy: 0.9402561538833688
Energy: 0.9095488458458628
Energy: 0.9402561538833688
Energy: 0.9505650101672689
Energy: 0.9504005546843614
Energy: 0.8916358300467108
Energy: 0.950400554683504
Energy: 0.9454930854185533
Energy: 0.9397730214858017
Energy: 0.8909911889929687
Energy: 0.9397730214858017
Energy: 0.9461254043662554
Energy: 0.9503241911170984
Energy: 0.955177002409137
Energy: 0.9503241911170984
Energy: 0.9360149972021028
Energy: 0.9398074208735475
Energy: 0.8981597712019985
Energy: 0.939807420874405
Energy: 0.9400458789236043
Energy: 0.9379093627141477
Energy: 0.9072597194838301
Energy: 0.9379093627132903
Energy: 0.9384108197342749
Energy: 0.9371044684317835
Energy: 0.897680043569768
Energy: 0.9371044684326408
Energy: 0.9386869322717998
Energy: 1.0360637622981794
Energy: 0.9357321782948994
Energy: 1.0360637622981794
Energy: 0.9077337611268218
Energy: 1.0361094406464726
Energy: 0.935928538105023
Energy: 1.0361094406464726
Energy: 0.8925829446438094
Energy: 1.0279404474999123
Energy: 0.9371268013684265
Energy: 1.0279404474973401
Energy: 0.8954592910390694
Energy: 1.0293453918727282
Energy: 0.9393783834808256
Energy: 1.0293453918727282
Energy: 0.9383445041045532
Energy: 0.9403352858823408
Energy: 0.8924075404165067
Energy: 0.9403352858831983
Energy: 0.9380351111270488
Energy: 0.940014919919509
Energy: 0.8921012152466054
Energy: 0.9400149199203665
Energy: 0.892651199942367
Energy: 0.9357687601344103
Energy: 0.9504683737766263
Energy: 0.9357687601361253

minimum gb energy = 0.8909911889929687 eV
minimum distance =  2.35849797377661 Angstroms
sigma value = 9


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

Energy: 1.3411494972053584
Energy: 1.013109692882082
Energy: 1.0148952916975853
Energy: 0.9507974396654216
Energy: 1.0068929871638201
Energy: 1.0390679625821901
Energy: 1.0053132814122323
Energy: 1.0390679625842356
Energy: 1.0140882474965907
Energy: 1.0133018000533316
Energy: 1.0128081146670898
Energy: 1.0133018000533316
Energy: 0.9996500119634955
Energy: 1.0234109487413399
Energy: 1.0048636481254873
Energy: 1.0234109487413399
Energy: 1.0018405548214835
Energy: 1.0115488487216175
Energy: 1.0048807350719566
Energy: 1.0115488487195716
Energy: 0.999946497483524
Energy: 1.1051843758936986
Energy: 1.0068601977295164
Energy: 1.1051843758936986
Energy: 1.0508765859675588
Energy: 1.1019066987665065
Energy: 1.0061452632893253
Energy: 1.1019066987634378
Energy: 1.0062544086585643
Energy: 1.1046431214581685
Energy: 1.0070015093625815
Energy: 1.1046431214622132
Energy: 1.0074534432145128
Energy: 1.0235608203190476
Energy: 0.9426830539787414
Energy: 1.0235608203159792
Energy: 1.0047963244142164
Energy: 1.024337765660175
Energy: 0.9415978261062538
Energy: 1.024337765653015
Energy: 0.9425416360504577
Energy: 1.012902113412079
Energy: 1.0123173556103404
Energy: 1.0129021134079876
Energy: 1.0520809745745003
Energy: 1.0253131359466467
Energy: 1.0055892381960245
Energy: 1.0253131359466467
Energy: 1.0164641423673262
Energy: 1.0121876136468835
Energy: 1.012401616793655
Energy: 1.0121876136489292
Energy: 0.9983656030401414
Energy: 1.0256093759128724
Energy: 0.9972964531374582
Energy: 1.0256093759108267
Energy: 1.0021077970874461
Energy: 1.0324209798799995
Energy: 1.0057328365447784
Energy: 1.0324209798779538
Energy: 0.9993610456259456
Energy: 1.0113416262965225
Energy: 1.0051180130550619
Energy: 1.0113416262995911
Energy: 1.0532515896343844
Energy: 1.1051071909241625
Energy: 1.0057121672996063
Energy: 1.1051071909272312
Energy: 1.0521566147326946
Energy: 1.1037591063585224
Energy: 1.0050059495620693
Energy: 1.1037591063636365
Energy: 1.0086222927944577
Energy: 1.024465207333455
Energy: 0.9416228143115842
Energy: 1.024465207332432
Energy: 1.0047350092111325
Energy: 1.0247578210232444
Energy: 0.9412943166613198
Energy: 1.0247578210191528
Energy: 0.9422676637770951
Energy: 0.9974167423696285
Energy: 1.0119986279534166
Energy: 0.9974167423696285

minimum gb energy = 0.9412943166613198 eV
minimum distance =  2.40036469932978 Angstroms
sigma value = 25


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

Energy: 1.1935893584092068
Energy: 1.0912301672235423
Energy: 1.0934566078250256
Energy: 1.0133915722512432
Energy: 1.0965145361933673
Energy: 1.075086256729041
Energy: 1.0294257590239455
Energy: 1.0750862567315707
Energy: 1.0914416743967135
Energy: 1.0905931250276741
Energy: 1.109879050728028
Energy: 1.0905931250289393
Energy: 1.0898461403731952
Energy: 1.076205043889294
Energy: 1.0293594059515474
Energy: 1.076205043890559
Energy: 1.0260096209118192
Energy: 1.1083013942787525
Energy: 1.032363423997918
Energy: 1.1083013942812825
Energy: 1.006534752193187
Energy: 1.1136235048906709
Energy: 1.0277152024101366
Energy: 1.1136235048906709
Energy: 1.0021600379248172
Energy: 1.1071735112264591
Energy: 1.0295806008777018
Energy: 1.1071735112264591
Energy: 1.001903778459421
Energy: 1.1072437626761267
Energy: 1.033692900166813
Energy: 1.1072437626761267
Energy: 1.0894995866622124
Energy: 1.0894550254310922
Energy: 1.167665246011842
Energy: 1.089455025432357
Energy: 1.0303622252568518
Energy: 1.0075392191857033
Energy: 1.0877476046427086
Energy: 1.0075392191844383
Energy: 1.1058039342538084
Energy: 1.0898281899909452
Energy: 1.0956349367191913
Energy: 1.0898281899909452
Energy: 1.0892546311496853
Energy: 1.1067884687834029
Energy: 1.0891380692236747
Energy: 1.1067884687834029
Energy: 1.0295684938256007
Energy: 1.1137931869742355
Energy: 1.0259065500040667
Energy: 1.113793186971706
Energy: 1.03122399439979
Energy: 1.108526741752018
Energy: 1.0091073945065638
Energy: 1.108526741753283
Energy: 1.0304424908531111
Energy: 1.1064855147091972
Energy: 1.001937007604796
Energy: 1.1064855147079322
Energy: 1.0300378922996782
Energy: 1.1068256022727592
Energy: 1.0019695292244724
Energy: 1.1068256022752891
Energy: 1.164849507174744
Energy: 1.007950648011172
Energy: 1.087962762320749
Energy: 1.007950648008642

minimum gb energy = 1.001903778459421 eV
minimum distance =  2.43220387413155 Angstroms
sigma value = 17


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

Energy: 1.608608412504883
Energy: 1.1820814022949002
Energy: 1.1829682808162254
Energy: 1.1296013321390357
Energy: 1.0547275548076849
Energy: 1.0916163067634772
Energy: 1.1395753883347428
Energy: 1.0916163067620446
Energy: 1.08614623596482
Energy: 1.0784469695989498
Energy: 1.1903168804236386
Energy: 1.0784469695996661
Energy: 1.078156165789261
Energy: 1.1395539858001131
Energy: 1.0768159686087477
Energy: 1.1395539858022623
Energy: 1.0793009904954909
Energy: 1.186004084954357
Energy: 1.035776832508283
Energy: 1.1860040849522078
Energy: 1.0798400606513936
Energy: 1.1878494904158663
Energy: 1.0786662903548783
Energy: 1.1878494904165828
Energy: 1.115821075120095
Energy: 1.0780083804122809
Energy: 1.0781067896729057
Energy: 1.07800838041443
Energy: 1.234002654879351
Energy: 1.0774189576035966
Energy: 1.0594437389482498
Energy: 1.0774189576050295
Energy: 1.1906041837105714
Energy: 1.17843596820102
Energy: 1.1894399596966274
Energy: 1.178435968204602
Energy: 1.1777680553486503
Energy: 1.1342654382311297
Energy: 1.152776636361405
Energy: 1.1342654382282642
Energy: 1.0776368090888258
Energy: 1.0380681552726636
Energy: 1.0536227353178256
Energy: 1.0380681552604845
Energy: 1.1212779250215565
Energy: 1.092070822683653
Energy: 1.0589829442678125
Energy: 1.0920708226843696
Energy: 1.1166172663343503
Energy: 1.0927492076984253
Energy: 1.086780516259059
Energy: 1.0927492076955596
Energy: 1.1179358454997579
Energy: 1.091898825890644
Energy: 1.0546801922909441
Energy: 1.0918988258870617
Energy: 1.1764260047692532
Energy: 1.1184982618871073
Energy: 1.2346115499939114
Energy: 1.11849826188854
Energy: 1.1898980651065907
Energy: 1.177532426198035
Energy: 1.234429268803065
Energy: 1.1775324261958857
Energy: 1.185046101525919
Energy: 1.0778535398652285
Energy: 1.077996300122441
Energy: 1.0778535398623632
Energy: 1.1835750375263743
Energy: 1.0776409936306839
Energy: 1.075626333725104
Energy: 1.077640993632833
Energy: 1.0842486224830044
Energy: 1.1857419432919896
Energy: 1.0783772658073338
Energy: 1.1857419432927059
Energy: 1.1409085764155569
Energy: 1.1883710473412534
Energy: 1.0785683882505928
Energy: 1.1883710473441191
Energy: 1.0808590419891149
Energy: 1.0781861107580526
Energy: 1.1902363028919345
Energy: 1.0781861107559034
Energy: 1.0778025134820923
Energy: 1.0918967493812797
Energy: 1.115829191959051
Energy: 1.0918967493834286
Energy: 1.1412428268925179
Energy: 1.1386937635382364
Energy: 1.1384770351478826
Energy: 1.138693763539669
Energy: 1.1901822145729606
Energy: 1.1775372580813968
Energy: 1.1802117050133016
Energy: 1.1775372580828296
Energy: 1.0602604038276424
Energy: 1.0918290377636135
Energy: 1.1803627608915066
Energy: 1.091829037762897
Energy: 1.0595366344553923
Energy: 1.0915094013371194
Energy: 1.0784263176137983
Energy: 1.0915094013364028
Energy: 1.0525702063260254
Energy: 1.0557570669553513
Energy: 1.1176483683664913
Energy: 1.0557570669575007
Energy: 1.0590894466188543
Energy: 1.0917331110552515
Energy: 1.11640492041334
Energy: 1.0917331110574007
Energy: 1.0608729092953997
Energy: 1.092069295360491
Energy: 1.1166260211947845
Energy: 1.0920692953576252
Energy: 1.2368982810345672
Energy: 1.1791153557930873
Energy: 1.181768808693036
Energy: 1.1791153557930873

minimum gb energy = 1.035776832508283 eV
minimum distance =  2.4413201266017 Angstroms
sigma value = 53


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

Energy: 1.4561114914265285
Energy: 1.1350933924079532
Energy: 1.1374986363516013
Energy: 1.014630280353255
Energy: 1.124875716988662
Energy: 1.064564100955087
Energy: 1.126110588308067
Energy: 1.0645641009534375
Energy: 1.134833549834819
Energy: 1.1283802921614308
Energy: 1.1274818318269757
Energy: 1.1283802921564825
Energy: 1.125870888096556
Energy: 1.0664186564469724
Energy: 1.122576362406211
Energy: 1.0664186564420242
Energy: 1.1340489490788563
Energy: 1.0665122131122338
Energy: 1.0123751565355898
Energy: 1.0665122131188312
Energy: 1.1225697913854404
Energy: 1.0685127481070609
Energy: 1.0190131796811028
Energy: 1.0685127481054117
Energy: 1.2414197093976012
Energy: 1.1238673872577867
Energy: 1.1254025047706064
Energy: 1.1238673872577867
Energy: 1.2428633827758413
Energy: 1.0671616267448405
Energy: 1.1218066523189756
Energy: 1.0671616267514379
Energy: 1.129104426609596
Energy: 1.1253132141503879
Energy: 1.131734718310373
Energy: 1.1253132141536866
Energy: 1.122288476941137
Energy: 1.0665364293707666
Energy: 1.1292434519707844
Energy: 1.066536429377364
Energy: 1.127004921935188
Energy: 1.0716314255955497
Energy: 1.0223943980143981
Energy: 1.0716314255955497
Energy: 1.1299755752453982
Energy: 1.066072401985109
Energy: 1.0042164520054242
Energy: 1.066072401985109
Energy: 1.243463946969686
Energy: 1.0679679442763268
Energy: 1.1208455337372862
Energy: 1.0679679442845733

minimum gb energy = 1.0042164520054242 eV
minimum distance =  2.42106592195024 Angstroms
sigma value = 9


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

Energy: 1.411786692336818
Energy: 1.2382123725446181
Energy: 1.24007410129872
Energy: 1.1613349675094755
Energy: 1.0746866755134685
Energy: 1.0722491427263874
Energy: 1.2273268999236049
Energy: 1.0722491427257772
Energy: 1.0823265584919926
Energy: 1.0770392789843426
Energy: 1.2139443301253063
Energy: 1.0770392789867842
Energy: 1.0753251892336482
Energy: 1.0755865375969715
Energy: 1.2774180028668425
Energy: 1.075586537597582
Energy: 1.0735942982673852
Energy: 1.0724825195873702
Energy: 1.2767105624639858
Energy: 1.0724825195867598
Energy: 1.0721517526121227
Energy: 1.0721049033462497
Energy: 1.276784257522381
Energy: 1.0721049033499122
Energy: 1.2265801326943058
Energy: 1.21349715737357
Energy: 1.2272046692260485
Energy: 1.2134971573784534
Energy: 1.2281994639238205
Energy: 1.2127743000236157
Energy: 1.2128567998268491
Energy: 1.2127743000248365
Energy: 1.1088969154906785
Energy: 1.187470148620803
Energy: 1.1244835377199824
Energy: 1.1874701486232446
Energy: 1.0755186335720308
Energy: 1.1711920942955154
Energy: 1.216425396196576
Energy: 1.1711920942973466
Energy: 1.106084859099767
Energy: 1.1071625575981197
Energy: 1.148036509003327
Energy: 1.1071625575944568
Energy: 1.1218659741677472
Energy: 1.1090360239081636
Energy: 1.2793963743512349
Energy: 1.1090360239099948
Energy: 1.2281100154592468
Energy: 1.1066782189840216
Energy: 1.1281885782012533
Energy: 1.1066782189821904
Energy: 1.2272973917728236
Energy: 1.108039140498146
Energy: 1.1086364172192584
Energy: 1.1080391404975354
Energy: 1.2125104171537147
Energy: 1.1733783635385402
Energy: 1.1221893368417561
Energy: 1.1733783635379298
Energy: 1.1464878482961165
Energy: 1.1930952554875984
Energy: 1.123395512241592
Energy: 1.1930952554857672
Energy: 1.2166902636523345
Energy: 1.1955632066357735
Energy: 1.109380455449263
Energy: 1.1955632066315
Energy: 1.2145616758167364
Energy: 1.214732578443146
Energy: 1.2789130861567548
Energy: 1.2147325784461982
Energy: 1.2312882662027236
Energy: 1.0719336756651026
Energy: 1.1174516706865667
Energy: 1.0719336756632711
Energy: 1.322687165369442
Energy: 1.075106899755564
Energy: 1.0780373957368115
Energy: 1.075106899755564
Energy: 1.2320109485706257
Energy: 1.0739751667937905
Energy: 1.0730006030104047
Energy: 1.073975166796843
Energy: 1.276484227891173
Energy: 1.0719418623664816
Energy: 1.0724794203584738
Energy: 1.071941862370144
Energy: 1.2767645358729767
Energy: 1.0728888173958941
Energy: 1.0721208459598734
Energy: 1.0728888173971154
Energy: 1.2283591216553376
Energy: 1.2139314446464773
Energy: 1.2268867094618858
Energy: 1.2139314446428147
Energy: 1.2134911699397288
Energy: 1.2130234758323473
Energy: 1.2272000642530099
Energy: 1.2130234758311262
Energy: 1.122197280423257
Energy: 1.1958273525798382
Energy: 1.1074934202175235
Energy: 1.195827352579228
Energy: 1.2188094571546397
Energy: 1.1706954373197607
Energy: 1.0751221155726114
Energy: 1.1706954373215919
Energy: 1.1487221784896178
Energy: 1.1070818118483947
Energy: 1.107119643644302
Energy: 1.1070818118441217
Energy: 1.2791457649297187
Energy: 1.1779673531937593
Energy: 1.1255730018974817
Energy: 1.1779673531949801
Energy: 1.1292736418588145
Energy: 1.1069646241916355
Energy: 1.2289102770875713
Energy: 1.1069646241867517
Energy: 1.1110932010875063
Energy: 1.1080929203418397
Energy: 1.2146059378663256
Energy: 1.1080929203387873
Energy: 1.1174505723698147
Energy: 1.168452314739766
Energy: 1.2127986321479245
Energy: 1.168452314739766
Energy: 1.1244888062151759
Energy: 1.192436400153178
Energy: 1.1463189953985247
Energy: 1.1924364001556198
Energy: 1.1080471910563379
Energy: 1.19435379292893
Energy: 1.1540467368208187
Energy: 1.1943537929295407
Energy: 1.2795598001318935
Energy: 1.2141117391788625
Energy: 1.221261920660328
Energy: 1.2141117391831355

minimum gb energy = 1.0719336756632711 eV
minimum distance =  2.46012862432126 Angstroms
sigma value = 73


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

Energy: 1.501615166605599
Energy: 1.2029376587633949
Energy: 1.2038588279881088
Energy: 1.1173338700518152
Energy: 1.0824951544422359
Energy: 1.0759489061609357
Energy: 1.1729053067288753
Energy: 1.0759489061619043
Energy: 1.0829799176501684
Energy: 1.0803735604818148
Energy: 1.196887919287542
Energy: 1.080373560477941
Energy: 1.0794389700800542
Energy: 1.0792829085288418
Energy: 1.257602845420843
Energy: 1.0792829085250122
Energy: 1.0807538534774066
Energy: 1.0801008474618676
Energy: 1.270649309493957
Energy: 1.0801008474599307
Energy: 1.1322883478987418
Energy: 1.0798547256446518
Energy: 1.269857817568512
Energy: 1.0798547256494944
Energy: 1.1863049955655078
Energy: 1.1953921758404817
Energy: 1.2143384908610277
Energy: 1.1953921758414503
Energy: 1.1863769504378643
Energy: 1.1937954652718226
Energy: 1.1929017810264542
Energy: 1.1937954652718226
Energy: 1.1150734303288854
Energy: 1.2797263954705078
Energy: 1.1944144897871387
Energy: 1.279726395465665
Energy: 1.137293109909983
Energy: 1.1984183335123395
Energy: 1.1968400449045533
Energy: 1.1984183335104026
Energy: 1.126020046487855
Energy: 1.0523915791668117
Energy: 1.0741736193152804
Energy: 1.0523915791677803
Energy: 1.1206002455186135
Energy: 1.057046780983005
Energy: 1.2466458276892753
Energy: 1.0570467809839736
Energy: 1.1953655091841415
Energy: 1.1237132717792213
Energy: 1.1074340893919323
Energy: 1.1237132717811582
Energy: 1.1957362390998398
Energy: 1.1105687954926942
Energy: 1.1075201582798757
Energy: 1.1105687954965682
Energy: 1.2143526603397428
Energy: 1.1094266581230463
Energy: 1.1071641244703003
Energy: 1.1094266581211094
Energy: 1.2641632015498776
Energy: 1.1085227585051092
Energy: 1.1072122695526994
Energy: 1.1085227585109203
Energy: 1.270599305285355
Energy: 1.109431705008714
Energy: 1.1064983822894812
Energy: 1.109431705006777
Energy: 1.184971720452674
Energy: 1.1817439496793694
Energy: 1.1791214242892143
Energy: 1.181743949678401
Energy: 1.168167429230591
Energy: 1.146895988200519
Energy: 1.1853790366219765
Energy: 1.1468959881995504
Energy: 1.167478169033555
Energy: 1.1499488953935213
Energy: 1.1618141705152532
Energy: 1.1499488953954582
Energy: 1.1679029362417008
Energy: 1.1533076771711668
Energy: 1.1181904408723105
Energy: 1.1533076771731037
Energy: 1.2447594549863463
Energy: 1.1616026231932222
Energy: 1.1628581755846037
Energy: 1.1616026231922536

minimum gb energy = 1.0523915791668117 eV
minimum distance =  2.4318459130328 Angstroms
sigma value = 7


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

Energy: 1.7368333164451177
Energy: 1.2104544331240956
Energy: 1.2105391347418393
Energy: 1.091610394345562
Energy: 1.0790395784042588
Energy: 1.1370889990138509
Energy: 1.1721732538658287
Energy: 1.1370889990234385
Energy: 1.0753965150562925
Energy: 1.0768050100810922
Energy: 1.1758567211292592
Energy: 1.0768050100968434
Energy: 1.0770028270318226
Energy: 1.0791830200096306
Energy: 1.258685990275761
Energy: 1.0791830200144243
Energy: 1.0725403792911836
Energy: 1.0729081908129678
Energy: 1.2390581445137008
Energy: 1.072908190808236
Energy: 1.0813691292586471
Energy: 1.072848067089423
Energy: 1.2359055497500506
Energy: 1.0728480670955243
Energy: 1.1682774609089273
Energy: 1.0750040412598907
Energy: 1.0810941633890516
Energy: 1.075004041250303
Energy: 1.1693461037620771
Energy: 1.0719588611116144
Energy: 1.0699566057142424
Energy: 1.0719588611116144
Energy: 1.2603901300804892
Energy: 1.079105305493663
Energy: 1.078291887836064
Energy: 1.0791053054786586
Energy: 1.27794918148379
Energy: 1.2126658961621872
Energy: 1.0725250879280195
Energy: 1.2126658961505448
Energy: 1.1664521113229809
Energy: 1.15394222782944
Energy: 1.0900390532382949
Energy: 1.1539422278171128
Energy: 1.1629893971586047
Energy: 1.1580891029342397
Energy: 1.1664969208905742
Energy: 1.15808910293287
Energy: 1.1592094424558634
Energy: 1.140178344782075
Energy: 1.1570948371744179
Energy: 1.1401783447861844
Energy: 1.1665849781053201
Energy: 1.140044877875453
Energy: 1.0905773059381445
Energy: 1.140044877869974
Energy: 1.156772450428135
Energy: 1.1436657101473582
Energy: 1.0852902414476215
Energy: 1.143665710139825
Energy: 1.0906408986012328
Energy: 1.157959408877035
Energy: 1.1630570976904484
Energy: 1.15795940887635
Energy: 1.090792420439772
Energy: 1.1540523923605688
Energy: 1.1667249461286922
Energy: 1.154052392368787
Energy: 1.0727891188308316
Energy: 1.2116782555997332
Energy: 1.1832314847241021
Energy: 1.2116782555983636
Energy: 1.0769875946016076
Energy: 1.0793504067893551
Energy: 1.166463110015834
Energy: 1.079350406786616
Energy: 1.0712990226478558
Energy: 1.0719328600933988
Energy: 1.0954323762861233
Energy: 1.071932860089975
Energy: 1.0810608879508874
Energy: 1.0751394058377606
Energy: 1.2422127055075096
Energy: 1.075139405856936
Energy: 1.1689393967076005
Energy: 1.0724969258057997
Energy: 1.0812470946336123
Energy: 1.0724969258133328
Energy: 1.1686636175510832
Energy: 1.0728621446747921
Energy: 1.0724482914840863
Energy: 1.0728621446754767
Energy: 1.2583939992341924
Energy: 1.0792643626179468
Energy: 1.077307880044774
Energy: 1.0792643626076743
Energy: 1.2278738386683878
Energy: 1.077105488988383
Energy: 1.075502813743378
Energy: 1.0771054889815967
Energy: 1.2299827950926576
Energy: 1.1596418361397844
Energy: 1.078107780861467
Energy: 1.1596418361349903
Energy: 1.2103989634165662
Energy: 1.1680993143963478
Energy: 1.5086665382848388
Energy: 1.168099314400457
Energy: 1.1539753539495123
Energy: 1.1614449052660436
Energy: 1.1628415309697462
Energy: 1.1614449052653588
Energy: 1.1718795288682102
Energy: 1.1393216219900058
Energy: 1.1595236282417642
Energy: 1.1393216219893207
Energy: 1.1535961317972407
Energy: 1.2041127926658783
Energy: 1.0899193458656924
Energy: 1.204112792663139
Energy: 1.0921890512596524
Energy: 1.154572209090397
Energy: 1.1563985641284504
Energy: 1.1545722090794395

minimum gb energy = 1.0699566057142424 eV
minimum distance =  2.44299892556589 Angstroms
sigma value = 29


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

Energy: 1.0025896953936793
Energy: 1.1832812251187692
Energy: 1.1183311132878222
Energy: 1.0037897306303318
Energy: 1.0153951075924033
Energy: 1.0806549692603922
Energy: 1.0147649194871493
Energy: 1.0806549692603922
Energy: 1.0131792828151438
Energy: 1.0730939086789042
Energy: 1.0060795026522853
Energy: 1.0730939086789042
Energy: 1.007972615673222
Energy: 1.0141349611359969
Energy: 1.0147873740410007
Energy: 1.0141349611359969
Energy: 1.0110949324151006
Energy: 1.015962663221827
Energy: 1.005607424181773
Energy: 1.0159626632194947
Energy: 1.0141237206922489
Energy: 1.0777614606079975
Energy: 1.0063046168928196
Energy: 1.077761460605665
Energy: 1.0048686738506365
Energy: 1.0729237190595458
Energy: 1.0139482376932294
Energy: 1.0729237190595458
Energy: 1.0156152046903744
Energy: 1.0157950417227943
Energy: 1.0109483121262914
Energy: 1.0157950417251267
Energy: 1.013645572528724
Energy: 1.0151164397570327
Energy: 1.0114935871843116
Energy: 1.0151164397570327

minimum gb energy = 1.0025896953936793 eV
minimum distance =  2.40380218376814 Angstroms
sigma value = 5


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

Energy: 1.360256029413621
Energy: 0.9864155938076687
Energy: 1.1351697895718056
Energy: 0.9616448285380448
Energy: 1.1335011359772973
Energy: 0.9868642823094744
Energy: 1.1427404320484593
Energy: 0.9868642823088275
Energy: 1.1407412105131784
Energy: 1.0559718841750672
Energy: 1.1403531124695017
Energy: 1.0559718841776549
Energy: 1.0045717299312045
Energy: 0.9825143333266406
Energy: 1.1327109316387742
Energy: 0.9825143333266406
Energy: 1.1307204394853012
Energy: 0.9828712124875901
Energy: 1.1388005056171546
Energy: 0.9828712124875901
Energy: 0.9834911049056735
Energy: 0.9829505973339224
Energy: 1.1384478484628586
Energy: 0.9829505973371571
Energy: 0.9830100382938677
Energy: 0.9826643079682046
Energy: 1.1332899677096597
Energy: 0.9826643079694983
Energy: 0.9931233472809377
Energy: 0.9875121921246937
Energy: 1.2547079126255882
Energy: 0.9875121921246937
Energy: 1.01009599886317
Energy: 1.0117841630665574
Energy: 1.2625724734912709
Energy: 1.0117841630678512
Energy: 1.181066889944991
Energy: 0.9622085167329029
Energy: 0.9633858860255197
Energy: 0.9622085167303153
Energy: 1.0089053476287144
Energy: 0.9618418019835034
Energy: 0.9622616549795306
Energy: 0.9618418019828565
Energy: 1.262823435017104
Energy: 0.9598469347103138
Energy: 0.9604061377044039
Energy: 0.9598469347083729
Energy: 1.253541237827524
Energy: 0.9613070526125372
Energy: 0.9619664503751274
Energy: 0.9613070526131842
Energy: 0.9847414379530167
Energy: 1.0084085587704934
Energy: 1.1410719033509387
Energy: 1.008408558773081
Energy: 0.9844031345628771
Energy: 0.9825934373417972
Energy: 1.1402257018103887
Energy: 0.9825934373411502
Energy: 0.9886378112876678
Energy: 0.9841888811148767
Energy: 1.1335343439011107
Energy: 0.9841888811174643
Energy: 0.9833607348883284
Energy: 0.9830997567999438
Energy: 1.0045092494684262
Energy: 0.9830997567967092
Energy: 1.1394603894205884
Energy: 0.988673760844588
Energy: 1.0068865415251986
Energy: 0.9886737608465288
Energy: 1.142504192951699
Energy: 1.0581237825266674
Energy: 1.1421285151043434
Energy: 1.0581237825279612
Energy: 1.1338081757182081
Energy: 0.9824059214428797
Energy: 1.0027917235371704
Energy: 0.9824059214402919
Energy: 1.140312474563267
Energy: 0.9835780747769943
Energy: 1.1317295391242657
Energy: 0.9835780747763474
Energy: 1.138248122749586
Energy: 0.98255427501696
Energy: 0.9830565707049365
Energy: 0.9825542750201945
Energy: 1.1325777056534116
Energy: 0.9830668239723707
Energy: 0.9834113320067011
Energy: 0.9830668239697831
Energy: 1.2552462246177103
Energy: 0.9853389058515117
Energy: 0.9890137681950713
Energy: 0.9853389058553933
Energy: 1.263151170008407
Energy: 1.0085604391517287
Energy: 1.0085075592796606
Energy: 1.0085604391504348
Energy: 0.9621119163851749
Energy: 0.9626020814600221
Energy: 1.1813725894902907
Energy: 0.9626020814619629
Energy: 0.9627597725317929
Energy: 0.9625835141231243
Energy: 1.0103967913821867
Energy: 0.962583514125065
Energy: 0.9612666256605505
Energy: 0.9605911900726559
Energy: 1.0215462067521761
Energy: 0.9605911900739499
Energy: 0.9619022795971485
Energy: 0.9623690843676704
Energy: 1.2528937927630324
Energy: 0.9623690843599073
Energy: 1.1408514360966473
Energy: 1.0077032506785517
Energy: 1.0075903036768066
Energy: 1.0077032506804924
Energy: 1.1413132358817346
Energy: 0.9833670470992582
Energy: 0.9859883170801564
Energy: 0.9833670470992582
Energy: 1.1323978164848543
Energy: 0.9837469006516433
Energy: 0.9840133360998188
Energy: 0.9837469006548779
Energy: 1.0055748034080563
Energy: 0.9825990863670312
Energy: 0.9828202094580955
Energy: 0.9825990863657373

minimum gb energy = 0.9598469347083729 eV
minimum distance =  2.41243446089756 Angstroms
sigma value = 1


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

Energy: 1.448798667506217
Energy: 0.9330276283543575
Energy: 1.0952676627826918
Energy: 0.9021981074331511
Energy: 0.931330757120886
Energy: 0.9322417977687989
Energy: 1.1486317878426062
Energy: 0.9322417977643267
Energy: 1.147006316154418
Energy: 1.023138483339834
Energy: 1.1472342969549596
Energy: 1.023138483339834
Energy: 0.9527034016595425
Energy: 1.023368838843851
Energy: 1.136384460124191
Energy: 1.0233688388411677
Energy: 0.9307462785440727
Energy: 0.9286354576284076
Energy: 1.1415352843166668
Energy: 0.9286354576257242
Energy: 0.9288236456200442
Energy: 0.9284467010821399
Energy: 1.141420581714361
Energy: 0.9284467010901899
Energy: 0.9267870124274963
Energy: 0.9277742064882105
Energy: 1.1374491923381802
Energy: 0.9277742064899994
Energy: 0.9374290299228599
Energy: 0.9332379477010929
Energy: 1.313850355630634
Energy: 0.9332379476984096
Energy: 1.1403554026844842
Energy: 0.9689943889969933
Energy: 1.3139042392993197
Energy: 0.9689943890121991
Energy: 1.1466758435876783
Energy: 0.9351148675025418
Energy: 0.931818628577229
Energy: 0.9351148675034362
Energy: 1.1388176199183986
Energy: 0.927884465054543
Energy: 0.9266494384532947
Energy: 0.9278844650599098
Energy: 1.3117971354480915
Energy: 0.9294898805315401
Energy: 0.9292176616988421
Energy: 0.9294898805270678
Energy: 1.311952973706567
Energy: 0.9286008378609814
Energy: 0.9295055447048012
Energy: 0.9286008378672427
Energy: 1.1362279563371052
Energy: 1.0230493788568955
Energy: 1.1452425897883989
Energy: 1.0230493788542119
Energy: 0.9567393133142164
Energy: 1.0219953529076062
Energy: 1.1442370912998943
Energy: 1.0219953529022394
Energy: 0.9621673603244839
Energy: 0.9306141232605118
Energy: 1.1372384249605503
Energy: 0.9306141232712454
Energy: 0.9293848277822235
Energy: 0.9287865495832319
Energy: 1.1446264633598158
Energy: 0.928786549593071
Energy: 0.9354390918720424
Energy: 0.9332407225045855
Energy: 1.1383035641159407
Energy: 0.9332407225072689
Energy: 0.9270247351457442
Energy: 0.9275589308967377
Energy: 1.318664629920421
Energy: 0.9275589309003155
Energy: 0.9303488864844859
Energy: 0.9338801048206833
Energy: 1.3140199906243664
Energy: 0.9338801048215777
Energy: 1.14178638471859
Energy: 0.969070406047632
Energy: 1.1359250669260093
Energy: 0.9690704060449485
Energy: 1.1432717286046772
Energy: 0.9305726071254773
Energy: 0.933631998170138
Energy: 0.9305726071308441
Energy: 1.136680627702855
Energy: 0.9282893127514734
Energy: 0.9283497785458679
Energy: 0.9282893127622069
Energy: 1.3119989289780702
Energy: 0.9287642143095095
Energy: 0.9289187883100213
Energy: 0.9287642143104038

minimum gb energy = 0.9021981074331511 eV
minimum distance =  2.41427463853735 Angstroms
sigma value = 17


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

Energy: 1.5517009175156287
Energy: 0.9245914527088678
Energy: 1.1009693398653768
Energy: 0.9013646467834274
Energy: 0.9216422841146016
Energy: 0.9230352423356077
Energy: 1.062812988982606
Energy: 0.9230352423351051
Energy: 1.169956782793287
Energy: 0.9184059093641896
Energy: 1.0602079378853086
Energy: 0.9184059093603699
Energy: 1.1810610482586255
Energy: 0.9650393369701434
Energy: 1.0514849111655848
Energy: 0.9650393369701434
Energy: 1.0356655440597744
Energy: 0.90303281816315
Energy: 1.2034434666389584
Energy: 0.9030328181603355
Energy: 0.9040013652760648
Energy: 0.9028245305030854
Energy: 1.2095796339344866
Energy: 0.9028245305030854
Energy: 0.9036647336342519
Energy: 0.9035537885487887
Energy: 1.0518569597135485
Energy: 0.9035537885470798
Energy: 0.9060884485077186
Energy: 0.9031772849761888
Energy: 1.0408124128893814
Energy: 0.9031772849739773
Energy: 1.2004925093522427
Energy: 0.902604887416208
Energy: 1.1692896844387897
Energy: 0.902604887418922
Energy: 1.083183722532314
Energy: 0.9678876098041429
Energy: 1.0529913785190685
Energy: 0.9678876098057512
Energy: 1.1968493875957102
Energy: 0.9186909667273208
Energy: 0.9322566397270071
Energy: 0.9186909667200833
Energy: 1.205913667675394
Energy: 0.9189387216877309
Energy: 1.0524626585147219
Energy: 0.9189387216860222
Energy: 1.1941994745800073
Energy: 0.9187805828720393
Energy: 0.9194983389829641
Energy: 0.9187805828698278
Energy: 1.0781775463643264
Energy: 0.9194484706260455
Energy: 0.9197248256182688
Energy: 0.919448470623231
Energy: 1.177374635407447
Energy: 0.9223068117135058
Energy: 0.9273838243971292
Energy: 0.9223068117185317
Energy: 1.231546704914825
Energy: 0.9202664878102844
Energy: 0.9228309572097465
Energy: 0.9202664878113901
Energy: 0.9203326085600099
Energy: 0.9234705525764735
Energy: 1.1160911575686834
Energy: 0.9234705525758704
Energy: 0.91896377888252
Energy: 0.9191161690253493
Energy: 1.2011307811634886
Energy: 0.9191161690209265
Energy: 0.9223872737800206
Energy: 0.9239532447924639
Energy: 1.1667665201178317
Energy: 0.9239532447919612
Energy: 0.9210703535178526
Energy: 0.9192958177822409
Energy: 1.0405800901471913
Energy: 0.9192958177817384
Energy: 1.058325828438665
Energy: 0.9206824855823796
Energy: 1.0373167732025328
Energy: 0.9206824855817767
Energy: 1.0588392579435217
Energy: 0.9251435382966021
Energy: 1.1729227715529074
Energy: 0.9251435382926819
Energy: 1.0520656056611832
Energy: 0.9633422802248736
Energy: 1.1767226524846641
Energy: 0.963342280224371
Energy: 1.1063352092388146
Energy: 0.9046924306759468
Energy: 1.0357656792808914
Energy: 0.9046924306776556
Energy: 1.2056094505054284
Energy: 0.9025191333020762
Energy: 0.9027353534470208
Energy: 0.9025191333037851
Energy: 1.0523538260095169
Energy: 0.9033311642342663
Energy: 0.9046613181225035
Energy: 0.9033311642414031
Energy: 1.046993183650336
Energy: 0.9029671302887523
Energy: 0.9030689685518892
Energy: 0.902967130289858
Energy: 1.05417276690666
Energy: 0.9033603000999002
Energy: 1.2040232047767223
Energy: 0.903360300101006
Energy: 1.056956397872634
Energy: 0.9661203537582206
Energy: 1.0600373109651908
Energy: 0.9661203537571149
Energy: 0.9331855020925598
Energy: 0.9183518875641171
Energy: 1.1951573803158828
Energy: 0.9183518875663286
Energy: 1.051286183819138
Energy: 0.9187965412843427
Energy: 1.2095659240254475
Energy: 0.9187965412849458
Energy: 0.9193847740187051
Energy: 0.9192224258220315
Energy: 1.2111136695083786
Energy: 0.9192224258187144
Energy: 0.9183698737485408
Energy: 0.9190507650364209
Energy: 1.0794795810509588
Energy: 0.9190507650403411
Energy: 0.9308080003390292
Energy: 0.9248182771660537
Energy: 1.1818353599051488
Energy: 0.9248182771682651
Energy: 1.084719130192536
Energy: 0.9192568923314237
Energy: 1.2301179678943124
Energy: 0.9192568923292124
Energy: 1.3926738462360146
Energy: 0.921202212776066
Energy: 0.9202049239594996
Energy: 0.9212022127749603
Energy: 1.1981877050247902
Energy: 0.918796828471631
Energy: 0.9177043527751522
Energy: 0.9187968284711285
Energy: 1.1699233705162675
Energy: 0.9192071725310301
Energy: 0.9210540674471551
Energy: 0.9192071725277131

minimum gb energy = 0.9013646467834274 eV
minimum distance =  2.42050323920974 Angstroms
sigma value = 89


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

Energy: 1.6431565053872639
Energy: 0.8308384656464795
Energy: 1.023524320221819
Energy: 0.8255895112717788
Energy: 0.8322367894107305
Energy: 0.9036544602799883
Energy: 0.8377202660684955
Energy: 0.9036544602799883
Energy: 0.828947064750339
Energy: 0.9047004555585964
Energy: 0.8338860633175292
Energy: 0.9047004555585964
Energy: 0.8259157817994477
Energy: 0.8999609284113012
Energy: 0.8289570507940136
Energy: 0.8999609284113012
Energy: 0.8288012897885996
Energy: 0.8286662153304505
Energy: 0.8391206410190631
Energy: 0.828666215329004
Energy: 0.8307391522300197
Energy: 0.8272931284062194
Energy: 0.8381428382314533
Energy: 0.8272931284062194
Energy: 0.8284262853208385
Energy: 0.8263654933727685
Energy: 0.8301683823329141
Energy: 0.826365493374215
Energy: 0.8282285513353698
Energy: 0.8287196484646995
Energy: 0.8327672633686176
Energy: 0.8287196484646995
Energy: 0.8330013818934632
Energy: 0.8269790222787754
Energy: 0.8360852866805168
Energy: 0.8269790222787754
Energy: 0.8317697161320231
Energy: 0.8995232840153536
Energy: 0.8321302630322068
Energy: 0.8995232840153536
Energy: 0.8303090884603955
Energy: 0.8978957535432366
Energy: 0.8231511903291062
Energy: 0.8978957535432366
Energy: 0.8379505200515224
Energy: 0.8267686874706164
Energy: 0.8310887417463174
Energy: 0.8267686874706164
Energy: 0.839919832589947
Energy: 0.8322675402630496
Energy: 0.8283595624226197
Energy: 0.8322675402630496
Energy: 0.8296036648106567
Energy: 0.8260088715028736
Energy: 0.8263404076463702
Energy: 0.8260088715028736
Energy: 0.8397689460539621
Energy: 0.8290447531768325
Energy: 0.8323929025210945
Energy: 0.8290447531782791

minimum gb energy = 0.8231511903291062 eV
minimum distance =  2.44185985244358 Angstroms
sigma value = 13


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

Energy: 1.4421649079441248
Energy: 0.7878973568930117
Energy: 0.9978460762844589
Energy: 0.775615644993376
Energy: 0.9268089616003301
Energy: 0.7818083048102549
Energy: 0.9281756267058126
Energy: 0.7818083048157115
Energy: 0.794321666327935
Energy: 0.7796759049019416
Energy: 0.9303876256759795
Energy: 0.7796759049092171
Energy: 1.0941662048592824
Energy: 0.7793334914517001
Energy: 0.9308832798558279
Energy: 0.7793334914632197
Energy: 0.9352877594075854
Energy: 0.782041462063228
Energy: 0.9384167960395573
Energy: 0.7820414620747477
Energy: 0.9311399538010754
Energy: 0.7818823411295287
Energy: 0.9286257531766513
Energy: 0.7818823411246784
Energy: 0.9298429413669297
Energy: 0.7798875519046997
Energy: 0.9284845008233471
Energy: 0.7798875519077312
Energy: 0.9304465547005139
Energy: 0.7809578043035637
Energy: 0.9471204925372428
Energy: 0.7809578043053824
Energy: 0.779214957639756
Energy: 0.7787559632970718
Energy: 0.9378377248791238
Energy: 0.7787559633073787
Energy: 0.7795250481759713
Energy: 0.7790771169773936
Energy: 0.9336325718045738
Energy: 0.7790771169864881
Energy: 0.7835319328590247
Energy: 0.7805647499624151
Energy: 1.442545715612887
Energy: 0.7805647499545332
Energy: 0.927654038165134
Energy: 0.8211643965027232
Energy: 0.9340529809885079
Energy: 0.8211643964948412
Energy: 0.930701340551371
Energy: 0.8189559991221073
Energy: 0.9268889966047508
Energy: 0.8189559991215011
Energy: 0.9313533463112001
Energy: 0.8196296760582026
Energy: 1.0929583609510547
Energy: 0.8196296760715411
Energy: 0.9452751285715207
Energy: 0.7845735612445796
Energy: 0.9316264824056788
Energy: 0.7845735612209339
Energy: 0.9409182899810904
Energy: 0.7819174052496667
Energy: 0.7864466541667577
Energy: 0.7819174052423912
Energy: 1.0946629005005906
Energy: 0.7804486794263087
Energy: 0.7815724049731098
Energy: 0.7804486794354031
Energy: 0.7918918875381069
Energy: 0.780997893587769
Energy: 0.7837183647401925
Energy: 0.7809978935798871
Energy: 1.079351771748694
Energy: 0.778984997172077
Energy: 0.9258372509940089
Energy: 0.7789849971490376
Energy: 0.9321857671753373
Energy: 0.7790740101395005
Energy: 0.9407092464892534
Energy: 0.7790740101492012
Energy: 1.097873984338543
Energy: 0.7808099930283058
Energy: 0.9277471155851351
Energy: 0.7808099930258805
Energy: 0.9321839251936059
Energy: 0.7804963356528976
Energy: 0.9279838510760353
Energy: 0.7804963356589605
Energy: 0.926296505692757
Energy: 0.7813024909177819
Energy: 0.9297514981704392
Energy: 0.7813024909268764
Energy: 0.7855031252396398
Energy: 0.7787828430096022
Energy: 0.9318780264117776
Energy: 0.7787828430120275
Energy: 0.9265947548619758
Energy: 0.7792961793135211
Energy: 0.9438892031980497
Energy: 0.7792961792983636
Energy: 0.7803121394685268
Energy: 0.7803629995812622
Energy: 0.9404251424809092
Energy: 0.7803629995794433
Energy: 0.7801125479912331
Energy: 0.7793364789975875
Energy: 0.9310900972067312
Energy: 0.7793364790030441
Energy: 0.7812161763823087
Energy: 0.7790584330524641
Energy: 0.7911855853601127
Energy: 0.7790584330621649
Energy: 0.9264644649125557
Energy: 0.7797997885021053
Energy: 1.0814407589142092
Energy: 0.7797997885118061
Energy: 0.9417850616003272
Energy: 0.8194396543601931
Energy: 1.0964953057457119
Energy: 0.8194396543565554
Energy: 0.9318005114365496
Energy: 0.8211463960892681
Energy: 1.0984952533903194
Energy: 0.8211463960880554
Energy: 0.9402768135206047
Energy: 0.7811582460381276
Energy: 1.0949593387331833
Energy: 0.7811582460284268
Energy: 0.9450480628316172
Energy: 0.7802288871229385
Energy: 0.7802348909423822
Energy: 0.7802288871108676
Energy: 1.0970849316696205
Energy: 0.7797738692968522
Energy: 0.7799093237781414
Energy: 0.7797738692835137
Energy: 1.0641012433171568
Energy: 0.7796594606682112
Energy: 0.7796724613235261
Energy: 0.7796594606754867

minimum gb energy = 0.775615644993376 eV
minimum distance =  2.45288964672884 Angstroms
sigma value = 37


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

Energy: 1.2472882386536552
Energy: 0.7049502264432858
Energy: 0.7022300698624199
Energy: 0.7023908561792916
Energy: 1.2038738740339319
Energy: 0.7008930196924036
Energy: 0.9493300560667699
Energy: 0.7008930196913605
Energy: 1.1935143484514454
Energy: 0.698868021042478
Energy: 0.9516788883338415
Energy: 0.6988680210456074
Energy: 1.1924735054318005
Energy: 0.7771051298253778
Energy: 0.953173712846171
Energy: 0.7771051298243347
Energy: 0.9493124224520568
Energy: 0.777037232684573
Energy: 0.9506438163337713
Energy: 0.7770372326856162
Energy: 0.7080481917027184
Energy: 0.7017606206267623
Energy: 0.949853389814247
Energy: 0.7017606206267623
Energy: 0.7038199921295645
Energy: 0.6992072157831524
Energy: 1.202159984573312
Energy: 0.6992072157831524
Energy: 0.7068897486545668
Energy: 0.70153265798379
Energy: 1.1977368934446349
Energy: 0.7015326579858763
Energy: 0.7008542626375298
Energy: 0.6995748882644235
Energy: 1.1978990335187523
Energy: 0.6995748882644235
Energy: 0.6997826083638994
Energy: 0.7014225825817763
Energy: 1.1924250967545316
Energy: 0.7014225825817763
Energy: 0.7022300698770234
Energy: 0.7023908561772055
Energy: 1.2472882386536552
Energy: 0.7049502281834855
Energy: 0.9493300560636406
Energy: 0.7008930196934468
Energy: 1.2038738740349753
Energy: 0.7008930196924036
Energy: 0.951678888335928
Energy: 0.6988680210435211
Energy: 1.193514348449359
Energy: 0.6988680210445642
Energy: 0.953173712846171
Energy: 0.777105129826421
Energy: 1.1924735054307574
Energy: 0.7771051298232916
Energy: 0.9506438163681941
Energy: 0.777037232684573
Energy: 0.9493124224520568
Energy: 0.7770372326877025
Energy: 0.9498533898184196
Energy: 0.7017606206267623
Energy: 0.7080481917027184
Energy: 0.7017606206267623
Energy: 1.2021599845753985
Energy: 0.6992072157821092
Energy: 0.7038199921274781
Energy: 0.6992072157821092
Energy: 1.1977368934488073
Energy: 0.70153265798379
Energy: 0.7068897486545668
Energy: 0.70153265798379
Energy: 1.1978990335177095
Energy: 0.6995748882633803
Energy: 0.7008542626375298
Energy: 0.6995748882623372
Energy: 1.1924250967514025
Energy: 0.7014225825828192
Energy: 0.6997826083649423
Energy: 0.7014225825828192

minimum gb energy = 0.698868021042478 eV
minimum distance =  2.46052503224137 Angstroms
sigma value = 25


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

Energy: 1.5218274375486833
Energy: 0.6195933268002479
Energy: 0.8570632954883893
Energy: 0.6244491850725231
Energy: 1.0324218187784096
Energy: 0.6184380961662641
Energy: 0.8193799677073693
Energy: 0.6184380961678932
Energy: 1.367308775251507
Energy: 0.6189362565052762
Energy: 0.8230175785386397
Energy: 0.6189362565060906
Energy: 1.0299466137180244
Energy: 0.6209326501800321
Energy: 0.8253606695123138
Energy: 0.620932650178403
Energy: 1.0293831008947945
Energy: 0.6850302093460688
Energy: 1.198757006634359
Energy: 0.6850302093404042
Energy: 1.0192034134367778
Energy: 0.6805938525594142
Energy: 1.1964639254422345
Energy: 0.6805938525594142
Energy: 1.0216619203893662
Energy: 0.6852433386303586
Energy: 1.0295471878918712
Energy: 0.6852433386303586
Energy: 0.8303115435714483
Energy: 0.6210692100684404
Energy: 1.201227566668771
Energy: 0.6210692100684404
Energy: 0.8224843926785578
Energy: 0.6190040108520811
Energy: 1.1950045096080089
Energy: 0.6190040108528957
Energy: 0.8203144446569154
Energy: 0.6207945856467556
Energy: 1.1957515905066374
Energy: 0.6207945856475701
Energy: 0.6228207031783622
Energy: 0.6212397756150488
Energy: 1.2782881697224224
Energy: 0.6212397756142343
Energy: 0.6214393124391802
Energy: 0.6207905549260566
Energy: 1.19573960427505
Energy: 0.6207905549252422
Energy: 0.6212350437480242
Energy: 0.61903763491103
Energy: 1.0214273648384287
Energy: 0.61903763491103
Energy: 0.6251317827699302
Energy: 0.6189566619084339
Energy: 1.363491041029241
Energy: 0.6189566619059903
Energy: 0.8228818102748809
Energy: 0.618730239389247
Energy: 1.0291181723762173
Energy: 0.6187302393884324
Energy: 0.819558823453899
Energy: 0.6183479818181268
Energy: 1.3709197360715752
Energy: 0.6183479818173124
Energy: 1.0289414709292333
Energy: 0.6192605928999491
Energy: 1.3741661266956757
Energy: 0.6192605929015782
Energy: 0.8258118825535778
Energy: 0.6848219005239948
Energy: 1.031270371851265
Energy: 0.6848219005223657
Energy: 1.194308811592179
Energy: 0.6813796527661407
Energy: 1.0214905321907424
Energy: 0.6813796527645115
Energy: 1.0303171215225877
Energy: 0.6809828101199501
Energy: 1.0191333884961735
Energy: 0.6809828101166918
Energy: 1.2785142356659667
Energy: 0.6205011990082621
Energy: 0.8267983896745958
Energy: 0.6205011990115201
Energy: 1.0318705586329662
Energy: 0.6182807060012411
Energy: 0.6200659454740833
Energy: 0.6182807059979829
Energy: 1.1936050839789265
Energy: 0.6192753105836077
Energy: 0.819249804856652
Energy: 0.6192753105860515
Energy: 1.2015690997653203
Energy: 0.6191231300958121
Energy: 0.6208003277058901
Energy: 0.6191231300941831
Energy: 1.0296678242104327
Energy: 0.6186873218881073
Energy: 0.6192183969637667
Energy: 0.6186873218881073
Energy: 1.3702777120136571
Energy: 0.61900953068649
Energy: 0.6200477663935273
Energy: 0.619009530683232

minimum gb energy = 0.6182807059979829 eV
minimum distance =  2.46799503720989 Angstroms
sigma value = 41


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

Energy: 1.499910874482866
Energy: 0.5636157954909466
Energy: 0.8081237601341149
Energy: 0.5616021925482303
Energy: 1.203532121991266
Energy: 0.559904631465466
Energy: 0.7251736609310433
Energy: 0.5599046314681372
Energy: 1.4854930466339644
Energy: 0.5604192159018024
Energy: 0.7285133796714731
Energy: 0.5604192159031379
Energy: 1.2031244631969464
Energy: 0.5610129993318207
Energy: 0.9055071773490786
Energy: 0.5610129993311528
Energy: 1.200568552224982
Energy: 0.5588308673290836
Energy: 1.046178896796197
Energy: 0.5588308673270801
Energy: 1.1953347143327608
Energy: 0.7691242536004285
Energy: 1.0454242791748438
Energy: 0.769124253599093
Energy: 1.200070684028197
Energy: 0.6128041454593504
Energy: 1.200133470411064
Energy: 0.6128041454520047
Energy: 1.055170718060002
Energy: 0.6161216251300587
Energy: 1.04862374370179
Energy: 0.6161216251287231
Energy: 0.8912231293610661
Energy: 0.5640544481184872
Energy: 1.340806459158993
Energy: 0.5640544481231616
Energy: 0.891456085171356
Energy: 0.5592106977230452
Energy: 1.2021226108131144
Energy: 0.5592106977190385
Energy: 0.7367941212486359
Energy: 0.5614880666955268
Energy: 1.3537595593989034
Energy: 0.5614880666961946
Energy: 0.7263314308424718
Energy: 0.559597190594543
Energy: 1.201368329570286
Energy: 0.5595971905972142
Energy: 0.7269354047073485
Energy: 0.5610913907108941
Energy: 1.3401310622720564
Energy: 0.5610913907068874
Energy: 0.5650677824450192
Energy: 0.5618209363261671
Energy: 1.3488474700119177
Energy: 0.5618209363241637
Energy: 0.559564921201174
Energy: 0.5597062721762196
Energy: 1.2018641634217757
Energy: 0.5597062721728807
Energy: 0.5614785892025105
Energy: 0.5607971461656177
Energy: 1.4897036582708258
Energy: 0.5607971461662855
Energy: 0.7310113968823849
Energy: 0.56032882357341
Energy: 1.4924616845909264
Energy: 0.5603288235747454
Energy: 0.726811566717461
Energy: 0.5613791844641477
Energy: 1.1994915013189555
Energy: 0.5613791844628122
Energy: 0.7286977922863653
Energy: 0.5610740179165351
Energy: 1.1981839197795863
Energy: 0.5610740179165351
Energy: 1.0470810246686042
Energy: 0.5596539758311707
Energy: 1.196442016062023
Energy: 0.5596539758284996
Energy: 1.0513319617181625
Energy: 0.5598629154792244
Energy: 1.2026134906411097
Energy: 0.5598629154758854
Energy: 1.0466519983682114
Energy: 0.6165391935710175
Energy: 1.2012106788989112
Energy: 0.6165391935683463
Energy: 1.3403837111406354
Energy: 0.6103522680982599
Energy: 1.1928672193528576
Energy: 0.6103522680929176
Energy: 1.0477972178738284
Energy: 0.6167057491762021
Energy: 1.047298076098033
Energy: 0.6167057491795411
Energy: 1.339107939014686
Energy: 0.5596854533920748
Energy: 0.8930472187326928
Energy: 0.5596854534007558
Energy: 1.3422661567575205
Energy: 0.5596686156770861
Energy: 1.0446805350207988
Energy: 0.5596686156784217
Energy: 1.3462023113410941
Energy: 0.5614431241906045
Energy: 0.7295297189069662
Energy: 0.5614431241919401
Energy: 1.200831924858313
Energy: 0.5599967860855714
Energy: 0.7256755192591402
Energy: 0.5599967860875747
Energy: 1.345884440462644
Energy: 0.5620740875230532
Energy: 0.7339530286907388
Energy: 0.5620740875190464
Energy: 1.3432328448262392
Energy: 0.560949176136334
Energy: 0.5616085266887778
Energy: 0.5609491761309917
Energy: 1.1999156055799958
Energy: 0.5597707155439713
Energy: 0.5593353837500051
Energy: 0.5597707155473103
Energy: 1.495586632775244
Energy: 0.5609385004627757
Energy: 0.5643250310690769
Energy: 0.5609385004681181

minimum gb energy = 0.5588308673270801 eV
minimum distance =  2.47823952465336 Angstroms
sigma value = 15


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

Energy: 1.3324445779017293
Energy: 0.5197785733620289
Energy: 0.7680792533068785
Energy: 0.5172764251812126
Energy: 1.326817003425509
Energy: 0.5152952644446297
Energy: 0.6569783223790573
Energy: 0.5152952644446297
Energy: 1.5721328192856086
Energy: 0.5165298859641151
Energy: 0.6592560503849738
Energy: 0.5165298859635493
Energy: 1.328325501826218
Energy: 0.51804779553823
Energy: 0.9401722666468619
Energy: 0.5180477955410585
Energy: 1.324293084996379
Energy: 0.5141468867737213
Energy: 0.93208954602071
Energy: 0.51414688677259
Energy: 1.320998382835251
Energy: 0.5155180949523203
Energy: 0.9310734203246515
Energy: 0.5155180949562802
Energy: 1.064952035041925
Energy: 0.5214998036028674
Energy: 1.1920792873892465
Energy: 0.521499803599473
Energy: 1.196158373800422
Energy: 0.5644271898144115
Energy: 0.9319859375099003
Energy: 0.5644271898217658
Energy: 1.0626416975968418
Energy: 0.5588649056758739
Energy: 1.1896620882532225
Energy: 0.5588649056770052
Energy: 1.0612514077057913
Energy: 0.5603510693877581
Energy: 1.3268585838774138
Energy: 0.5603510694002036
Energy: 0.9402168771122643
Energy: 0.5216099526842229
Energy: 1.2008121994367047
Energy: 0.5216099526864858
Energy: 0.794779053273197
Energy: 0.51495303951345
Energy: 1.443781002838667
Energy: 0.5149530395168442
Energy: 0.9320715663452374
Energy: 0.5153729587450431
Energy: 1.445807988637849
Energy: 0.5153729587473059
Energy: 0.6656278077435803
Energy: 0.51777277007473
Energy: 1.19715001625406
Energy: 0.517772770069073
Energy: 0.6541143363604678
Energy: 0.5146520454148651
Energy: 1.3242359129059553
Energy: 0.5146520454176937
Energy: 0.6612037018481791
Energy: 0.516890663768443
Energy: 1.4467926931108503
Energy: 0.5168906637707058
Energy: 0.5209845974887081
Energy: 0.5171624832991022
Energy: 1.4520427562698592
Energy: 0.5171624832985364
Energy: 0.5153767228389295
Energy: 0.5147391409957833
Energy: 1.323902868139443
Energy: 0.514739140994652
Energy: 0.5194952806881852
Energy: 0.5166075065832318
Energy: 1.3234923700989731
Energy: 0.5166075065804033
Energy: 0.6635946621256334
Energy: 0.5173572223149493
Energy: 1.5749141831576905
Energy: 0.5173572223104236
Energy: 0.6545176036671222
Energy: 0.5145313908532197
Energy: 1.3240045928326167
Energy: 0.514531390852654
Energy: 0.6656338229761456
Energy: 0.5171014123714031
Energy: 1.326231361435248
Energy: 0.5171014123612202
Energy: 0.9322511271254881
Energy: 0.5145924503761877
Energy: 1.3183506395947664
Energy: 0.5145924503761877
Energy: 0.9310749315925569
Energy: 0.5150873014922152
Energy: 1.3252036320548
Energy: 0.5150873015018321
Energy: 0.9386876567767023
Energy: 0.5244851431848444
Energy: 1.0685968052904469
Energy: 0.5244851431910671
Energy: 1.1920201746329526
Energy: 0.7103727558788897
Energy: 1.326765729311077
Energy: 0.7103727558749295
Energy: 0.930517429594833
Energy: 0.5594201971195021
Energy: 1.1911168059303914
Energy: 0.559420197123462
Energy: 1.1968689518217484
Energy: 0.564212372929313
Energy: 1.0684621253669961
Energy: 0.5642123729287473
Energy: 1.1930845648679071
Energy: 0.5210291196138714
Energy: 1.1910268991984425
Energy: 0.5210291196019915
Energy: 1.1920049954106577
Energy: 0.5152719010612117
Energy: 0.9322382032991358
Energy: 0.5152719010561204
Energy: 1.3236645113306929
Energy: 0.5147630938055056
Energy: 0.7945473602514063
Energy: 0.5147630938038085
Energy: 1.1962109456588301
Energy: 0.5169747733606731
Energy: 0.9400718521269962
Energy: 0.5169747733601074
Energy: 1.4465792566242384
Energy: 0.5157726956742358
Energy: 0.6574044930679909
Energy: 0.5157726956748016
Energy: 1.4422268047112758
Energy: 0.5157347455703264
Energy: 0.6569828976693014
Energy: 0.5157347455646691
Energy: 1.4564697778563591
Energy: 0.518684019330322
Energy: 0.5202701386630872
Energy: 0.518684019330322
Energy: 1.325414788801395
Energy: 0.5156389441330543
Energy: 0.5162446112266895
Energy: 0.5156389441330543
Energy: 1.5698804354656763
Energy: 0.5163332198363575
Energy: 0.5176116984123518
Energy: 0.5163332198290033

minimum gb energy = 0.51414688677259 eV
minimum distance =  2.48103161461733 Angstroms
sigma value = 85


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

Energy: 1.4100704632381742
Energy: 0.45776974443924084
Energy: 0.4609235015856502
Energy: 0.4469077311542739
Energy: 1.3981687644127676
Energy: 0.45535371214767567
Energy: 0.5816057477873887
Energy: 0.4553537121516009
Energy: 1.3937032389888053
Energy: 0.45532045022545115
Energy: 0.5824109337944017
Energy: 0.4553204502249605
Energy: 1.1623268589881162
Energy: 0.4567005454195759
Energy: 0.8242658194291007
Energy: 0.45670054541614147
Energy: 1.3961618809791436
Energy: 0.45492248351931486
Energy: 0.8242241979760068
Energy: 0.45492248351882425
Energy: 1.166046215746663
Energy: 0.45612949665352326
Energy: 0.8255374196395822
Energy: 0.4561294966456731
Energy: 1.1699349730843835
Energy: 0.4574500140691787
Energy: 1.0591907105630811
Energy: 0.4574500140618191
Energy: 1.286753375265146
Energy: 0.4572190120793684
Energy: 0.8188829707887618
Energy: 0.4572190120778965
Energy: 1.1711654419023358
Energy: 0.45603185590781614
Energy: 1.054929669620204
Energy: 0.4560318559087974
Energy: 1.1700515904170892
Energy: 0.7977620540534043
Energy: 1.2794385326305424
Energy: 0.7977620540519323
Energy: 1.0612531522279318
Energy: 0.5359841667317665
Energy: 1.0520748040377468
Energy: 0.5359841667317665
Energy: 0.9424523778119193
Energy: 0.45675548371956903
Energy: 1.280387085267814
Energy: 0.45675548368424296
Energy: 1.0544274212542186
Energy: 0.455624614143173
Energy: 1.280672762472213
Energy: 0.455624614143173
Energy: 0.8317593450674946
Energy: 0.456758103703979
Energy: 1.0549356357799098
Energy: 0.4567581037064322
Energy: 0.6982722404735624
Energy: 0.4551044949926812
Energy: 1.3955675893283614
Energy: 0.4551044949941531
Energy: 0.8288825077986475
Energy: 0.4562773573143101
Energy: 1.282201945036831
Energy: 0.4562773573143101
Energy: 0.5875573019025367
Energy: 0.45666127375580406
Energy: 1.2849209210722694
Energy: 0.45666127375825727
Energy: 0.578561079047032
Energy: 0.45601661207123706
Energy: 1.39521320760433
Energy: 0.45601661206784716
Energy: 0.583714391347215
Energy: 0.456427596993618
Energy: 1.3954095771454602
Energy: 0.45642759699312735
Energy: 0.4597470571069343
Energy: 0.4558867671455296
Energy: 1.395714243858036
Energy: 0.4558867671445483
Energy: 0.4556017610904791
Energy: 0.4551085140009785
Energy: 1.3961508448838584
Energy: 0.45510851399999724
Energy: 0.4575566548030398
Energy: 0.45697749011294253
Energy: 1.3908345560189956
Energy: 0.4569774901104894
Energy: 0.5855529196254847
Energy: 0.45596444121281665
Energy: 1.4022041161743304
Energy: 0.45596444121428853
Energy: 0.5798796591864313
Energy: 0.45508675943770094
Energy: 1.3972443261606988
Energy: 0.45508675943721033
Energy: 0.5856609348572184
Energy: 0.457434411721896
Energy: 1.162144930083635
Energy: 0.45743441172140537
Energy: 0.8245552930402447
Energy: 0.45569104159861723
Energy: 1.39224592444619
Energy: 0.45569104159861723
Energy: 0.8239941881726502
Energy: 0.4553113721258303
Energy: 1.392415833300174
Energy: 0.455311372123377
Energy: 0.8237906443873755
Energy: 0.4574369439614381
Energy: 1.164456350550516
Energy: 0.4574369439589849
Energy: 1.058118516386174
Energy: 0.4552834684709969
Energy: 1.3964115639967478
Energy: 0.4552834684700156
Energy: 1.0555316286467438
Energy: 0.7944310955734986
Energy: 1.1672480095181663
Energy: 0.7944310955710454
Energy: 1.1722550893407155
Energy: 0.5362908319262226
Energy: 0.9390178705318267
Energy: 0.5362908319237694
Energy: 1.057460641101787
Energy: 0.5361819189318939
Energy: 1.1714979805210215
Energy: 0.5361819189333658
Energy: 1.2811356401415865
Energy: 0.45651921236947196
Energy: 0.9383909282365496
Energy: 0.456519212368
Energy: 1.397173964145172
Energy: 0.4553616839097393
Energy: 0.9393460203505865
Energy: 0.45536168392053333
Energy: 1.0489968386714073
Energy: 0.4572193518005737
Energy: 0.8236522226262387
Energy: 0.4572193518040082
Energy: 1.3981875121016991
Energy: 0.4550508257366279
Energy: 0.8238920969032328
Energy: 0.4550508257371185
Energy: 1.3967291305915817
Energy: 0.4561006219670647
Energy: 0.8245848953912929
Energy: 0.4561006219641208
Energy: 1.278361205465976
Energy: 0.4570133517602556
Energy: 0.5846786904251945
Energy: 0.45701335175485863
Energy: 1.3971120107557193
Energy: 0.45513270097255326
Energy: 0.5794482861625895
Energy: 0.4551327009705907
Energy: 1.3949090072262256
Energy: 0.45634381053896117
Energy: 0.5857157542372672
Energy: 0.4563438105409237
Energy: 1.2767492790858719
Energy: 0.456614305359643
Energy: 0.4569063757184946
Energy: 0.456614305359643
Energy: 1.3957414615174288
Energy: 0.4549620513464474
Energy: 0.4551981208506183
Energy: 0.4549620513464474
Energy: 1.3967200320661342
Energy: 0.4561088373947852
Energy: 0.45734078493656044
Energy: 0.4561088373903694

minimum gb energy = 0.4469077311542739 eV
minimum distance =  2.48153740747056 Angstroms
sigma value = 113


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

Energy: 0.02141440293882841
Energy: 0.3696244599577898
Energy: 1.2179063439801587
Energy: 0.022119942325677457
Energy: 0.9462427776579443
Energy: 0.10891809254217594
Energy: 0.947495339519797
Energy: 0.10891809253957759
Energy: 0.0223491596552457
Energy: 0.10753587231547622
Energy: 0.9465640175251502
Energy: 0.10753587231509905
Energy: 0.023160245149470588
Energy: 0.10848961969685036
Energy: 0.9492699244562471
Energy: 0.10848961969316238
Energy: 0.947497670894374
Energy: 0.10687973762347837
Energy: 0.950775974472256
Energy: 0.10687973762054476
Energy: 0.029611174810765428
Energy: 0.10735669959550423
Energy: 0.9467355410694694
Energy: 0.10735669960065901

minimum gb energy = 0.02141440293882841 eV
minimum distance =  2.73142014372797 Angstroms
sigma value = 1