Model name: model_name=MEAM_LAMMPS_LeeShimBaskes_2003_Pt__MO_534993486058_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.917371571063995
cohesive_energy=5.770453839794827
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.14132509310734e-19, 3.08380549805784e-19, 3.8430609831440997e-19, 4.49251930350234e-19, 5.0637593605887e-19, 5.573812292022599e-19, 6.03317235475674e-19, 6.4488731042143805e-19, 6.8258652661945795e-19, 7.16788191225456e-19, 7.477758895036499e-19, 7.757771305360679e-19, 8.009729602823519e-19, 8.235187898759999e-19, 8.435411912710979e-19, 8.61150714655392e-19, 8.764402862736539e-19, 8.89493219310852e-19, 9.0038321389215e-19, 9.09175959259542e-19, 9.15929133771852e-19, 9.20694007081368e-19, 9.235218488403779e-19, 9.24455917818e-19, 9.234321269488739e-19, 9.20075566900644e-19, 9.13894369446672e-19, 9.04282911819306e-19, 8.905041927669059e-19, 8.71654584667896e-19, 8.46610961701842e-19, 8.139826345504319e-19, 7.720296393891419e-19, 7.185585964060259e-19, 6.50784922611192e-19, 5.651565924070619e-19, 4.57083369737226e-19, 3.20577920520426e-19, 1.4776778964783957e-19, -7.18573015995732e-20, -3.5247245077346394e-19, -7.1353737483507e-19, -1.182138792394122e-18, -1.79677700796564e-18, -2.6132301988857e-18, -3.71447028649926e-18, -5.2271813772567e-18, -7.35149135451096e-18, -1.041594255883008e-17, -1.498552655842782e-17, -2.20893694706214e-17, -3.3741839912039996e-17, -5.4270208688155195e-17, -9.422352719254979e-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: 0.02321289063463141
Energy: 0.7441724198395807
Energy: 0.7435901316230141
Energy: 1.2260912290784098
Energy: 1.2269924790306015
Energy: 0.4835987610013651
Energy: 0.02502845233836098
Energy: 0.13517149680239043
Energy: 1.2110316171379298
Energy: 0.6630162779306288
Energy: 1.064603569851577
Energy: 0.7439816326007253
Energy: 0.02424780553471532
Energy: 0.13778917659797577
Energy: 0.026355090803905575
Energy: 1.0691101837254924
Energy: 1.337979103019286
Energy: 1.0686274379543037
Energy: 0.9630102379289195
Energy: 0.13509334564357428
Energy: 0.13691569869289258
Energy: 0.02651947995481079
Energy: 0.7440558172607268
Energy: 1.060650600304361
Energy: 1.2259083075436206
Energy: 1.2271321928703727
Energy: 0.1354780371992085
Energy: 0.02431515867674206
Energy: 0.47755939064316544
Energy: 1.2133750140137838
Energy: 0.6690449555939609
Energy: 0.7424514101557801
Energy: 0.7443537836430892
Energy: 0.024041980186145093
Energy: 0.1358999964601472
Energy: 0.023786309394009844
Energy: 1.0701203325568471
Energy: 1.3396715231194403
Energy: 1.0683127604011071
Energy: 0.9620942640214081
Energy: 0.1349334694103538
Energy: 0.136472683464293

minimum gb energy = 0.02321289063463141 eV
minimum distance =  2.74577209449082 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.725882335809416
Energy: 2.105202656046745
Energy: 1.9380432238154424
Energy: 1.983170916735998
Energy: 1.938861555605836
Energy: 1.9181660097807216
Energy: 1.939148881244469
Energy: 1.5912140721776866
Energy: 1.8831304994417666
Energy: 1.7672600255429602
Energy: 1.878468777780136
Energy: 1.9007811682486884
Energy: 1.8187118421957913
Energy: 1.8181720134380244
Energy: 1.7882781529168825
Energy: 1.839441297714917
Energy: 1.770131800434892
Energy: 1.8468531691603907
Energy: 1.9283408387104721
Energy: 1.7909081531194333
Energy: 1.826893896022991
Energy: 1.8421684203511028
Energy: 1.842143908356734
Energy: 1.7659922064007572
Energy: 1.775205272530982
Energy: 1.8232003721347598
Energy: 1.8454242233755398
Energy: 1.878182337975847
Energy: 1.828640412341682
Energy: 1.9751841993443477
Energy: 1.724754739021992
Energy: 1.871730879816649
Energy: 1.766113761253292
Energy: 1.8373154642651406
Energy: 1.9375308407864797
Energy: 1.8615937722768983
Energy: 1.895606781099272
Energy: 1.7231898398099912
Energy: 1.753110643128652
Energy: 1.8117626890254879
Energy: 1.8326928794090105
Energy: 1.9538257405337802
Energy: 1.9062183764015925
Energy: 1.8303793710922192
Energy: 1.7644254823824872
Energy: 1.802745871001387
Energy: 1.837088536562598
Energy: 1.8777886396998413
Energy: 1.9941416803707217
Energy: 1.6030960352343122
Energy: 1.8345594819372666
Energy: 1.7938870222753607
Energy: 1.7814590762299816
Energy: 1.8265041423690462
Energy: 1.853092154157847
Energy: 1.8379819447339345
Energy: 1.7530534772459199
Energy: 1.8824627724180942
Energy: 1.7274301647316914
Energy: 1.9164941675127778
Energy: 1.9178921075775033
Energy: 1.7789529266925383
Energy: 1.8518816073169417
Energy: 1.7297177996150293
Energy: 1.8775986118162746
Energy: 1.8655892729101349
Energy: 1.8968201686068404
Energy: 1.8487648801191168
Energy: 1.7450376987912315
Energy: 1.862976311757432
Energy: 1.5821609800523522
Energy: 1.8611347367328086
Energy: 1.931886294288176
Energy: 1.9626171315994692
Energy: 1.8389056307253182
Energy: 1.867628411755411
Energy: 1.7937737695876244
Energy: 1.6832772611600675
Energy: 1.8381977025640488
Energy: 1.826106983846736
Energy: 1.8964444416535784
Energy: 1.926511106225487
Energy: 1.7004849242850515
Energy: 1.7524789748897058
Energy: 1.7155368568319516
Energy: 1.8240734656479751
Energy: 1.7962935546058554
Energy: 1.865993961462072
Energy: 1.8406900745518415
Energy: 1.7356655325473869
Energy: 1.7730735483381685
Energy: 1.685394039228367
Energy: 2.0179599350318913
Energy: 1.8409608699725524
Energy: 1.8138947829648358
Energy: 1.803310568455397
Energy: 1.8415850036482226
Energy: 1.8300902327150403
Energy: 1.8163982093380562
Energy: 1.9111753128524909
Energy: 1.7698317757596191
Energy: 1.7926779597860685
Energy: 1.8281599338571968
Energy: 1.8372754250210808
Energy: 1.8697822937342818
Energy: 1.847027375753534
Energy: 1.8952849174513002
Energy: 1.7494961655670336
Energy: 1.7968155370738894
Energy: 1.867718153205028
Energy: 1.7803159705952343
Energy: 1.8682554715609705
Energy: 1.6514115107713419
Energy: 1.8268448491728753
Energy: 1.746791447090576
Energy: 1.7544341461975224
Energy: 1.8048826861624723
Energy: 1.7999812424122865
Energy: 1.8476637014636128
Energy: 1.9146279613345136
Energy: 1.8963652967385674
Energy: 1.6580088182797388
Energy: 1.789832361219661
Energy: 1.872425166604637
Energy: 1.832904180389732
Energy: 1.9658427075623726
Energy: 1.876471745880953
Energy: 1.8983690934994795
Energy: 1.6479334736098359
Energy: 1.7430727075236687
Energy: 1.8631388675729095
Energy: 1.633115229485886
Energy: 1.9072430018250859
Energy: 1.8213525621511357
Energy: 1.9517766384986357
Energy: 1.7929201382248257
Energy: 1.7834905492327002
Energy: 1.7804574481820405
Energy: 1.8626701226471472
Energy: 1.9583736689170936
Energy: 1.7682831522148403
Energy: 1.8165049313166588
Energy: 1.7693019212826988
Energy: 1.786012406346808
Energy: 1.8047196563773953
Energy: 1.8625564950469753
Energy: 1.806964619385816
Energy: 1.6969205846072326
Energy: 1.8070427613733244
Energy: 1.8010239343906342
Energy: 1.9487416251359517
Energy: 1.9113237095592326
Energy: 1.7729802413492317
Energy: 1.7705448998345557
Energy: 1.623647502395161
Energy: 1.8194684885739743
Energy: 1.9335249730090254
Energy: 1.9406299183602616
Energy: 1.8848686111895006
Energy: 1.834699459835022
Energy: 1.8035320427665524
Energy: 1.7328374747649549
Energy: 1.9977224791571087
Energy: 1.9113176039011095
Energy: 1.963337760596099
Energy: 1.9329717610781219
Energy: 1.7477055912348376
Energy: 1.9253323445012576
Energy: 1.5724130689562161
Energy: 1.8628109420643995
Energy: 1.777293934451432
Energy: 1.8333267149869312
Energy: 1.9221452113597606
Energy: 1.8849785654178155
Energy: 1.787121728180796
Energy: 1.6361590853878003
Energy: 1.8880691538682361
Energy: 1.8115349330059114
Energy: 1.8445369918714674
Energy: 1.847536212940927
Energy: 1.8369656735990392
Energy: 1.8293567691237302
Energy: 1.8015635600496538
Energy: 1.8421011603831186
Energy: 1.7639341773569526
Energy: 1.763687280685234
Energy: 1.8088455800395273
Energy: 1.869841546036547
Energy: 1.8938772173816478
Energy: 1.650969467363342
Energy: 1.8783454587001625
Energy: 1.656755258929293
Energy: 1.8076274430020043
Energy: 1.7956486485832128
Energy: 1.8280687611810442
Energy: 1.94421896512144
Energy: 1.819166709887697
Energy: 1.8880370394113724
Energy: 1.7061144807332909
Energy: 1.7566143107257406
Energy: 1.820295929346603
Energy: 1.8327679626089923
Energy: 1.9141838451869246
Energy: 1.8705405136098994
Energy: 1.8463027384599193
Energy: 1.7663175878975916
Energy: 1.782285427933312
Energy: 1.8219951154240512
Energy: 1.8857511624246186
Energy: 1.9967255650844924
Energy: 1.6215611763791624
Energy: 1.8620841481064963
Energy: 1.7405769116052714
Energy: 1.8006252612544325
Energy: 1.8082739127994198
Energy: 1.8795040744843403
Energy: 1.929530686105566
Energy: 1.7253766860885005
Energy: 1.8676851936211845
Energy: 1.7183843981468507
Energy: 1.9205940247193372
Energy: 1.9222406672396493
Energy: 1.7566361702073674
Energy: 1.8416448377640853
Energy: 1.7467084818664582
Energy: 1.9183085800069894
Energy: 1.8805583136549402
Energy: 1.9269051652428648
Energy: 1.9124692395120715
Energy: 1.7460977788207093
Energy: 1.8962669777751555
Energy: 1.591622941778398
Energy: 1.8555567637291692
Energy: 1.9467557914171296
Energy: 1.935663048114049
Energy: 1.8035921953435123
Energy: 1.862668543734605
Energy: 1.8244999691416375
Energy: 1.679172671666178
Energy: 1.7815720507251502
Energy: 1.8238080626050583
Energy: 1.9156794358193179
Energy: 1.941852004667821
Energy: 1.7265788964277842
Energy: 1.7513202049945156
Energy: 1.7255561208284154
Energy: 1.8380523351435312
Energy: 1.856297876476889
Energy: 1.8889524530001174
Energy: 1.843922978883749
Energy: 1.7753024764549323
Energy: 1.754332295710988
Energy: 1.673247199304061
Energy: 2.0032698089015306
Energy: 1.8704783121275914
Energy: 1.8192000843202303
Energy: 1.8331935364306586
Energy: 1.850492505886923
Energy: 1.830542375895813
Energy: 1.775866632617817
Energy: 1.9250691493411947
Energy: 1.7314952326090898
Energy: 1.8232002343457934
Energy: 1.8054410905585938
Energy: 1.772680790312326
Energy: 1.8665579691835625
Energy: 1.842678386518379
Energy: 1.9589392547067033
Energy: 1.7674502325557735
Energy: 1.7688986928390404
Energy: 1.8785055333427052
Energy: 1.7312050275853463
Energy: 1.877249355339333
Energy: 1.6266086676568106
Energy: 1.832597275850882
Energy: 1.7272612439149677
Energy: 1.7627332288437763
Energy: 1.7678301744440523
Energy: 1.7979179161724081
Energy: 1.8677226111764667
Energy: 1.8977985483838442
Energy: 1.8674200682313136
Energy: 1.655769752684116
Energy: 1.7843498137974494
Energy: 1.86277585219865
Energy: 1.8099976755714977
Energy: 1.9621998565465322
Energy: 1.8864706955856705
Energy: 1.8997398742490426
Energy: 1.7412839920068357
Energy: 1.7350276942416978
Energy: 1.8571767254190032
Energy: 1.8702921855082828
Energy: 1.9419253037244744
Energy: 1.8293423265746893
Energy: 1.983682887156479
Energy: 1.7670106042437959
Energy: 1.799121185678456
Energy: 1.8015217837576014
Energy: 1.869138804126714
Energy: 1.9818598520518107
Energy: 1.7979389616114976
Energy: 1.8270120356324897
Energy: 1.820384665806392
Energy: 1.790936132646775
Energy: 1.8160756014765793
Energy: 1.9044814867986015
Energy: 1.81207704630237
Energy: 1.6923864287338346
Energy: 1.8143981702740795
Energy: 1.7819091150192583
Energy: 1.8962123859860316
Energy: 1.9180985365650915
Energy: 1.817028304319587
Energy: 1.7838852121576383
Energy: 1.6104221219924146
Energy: 1.8137266308507483
Energy: 1.9252622011578249
Energy: 1.9876419570141737
Energy: 1.8257774566650868
Energy: 1.832263911892307
Energy: 1.7981962030834129
Energy: 1.728015930385388
Energy: 1.9016782674180248
Energy: 1.8910614316461283
Energy: 1.980203744985727
Energy: 1.888046528291125
Energy: 1.7991498494862683
Energy: 1.8673365335391339

minimum gb energy = 1.5724130689562161 eV
minimum distance =  2.42633367910999 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.576201049306753
Energy: 1.9761684676652973
Energy: 1.842942337072972
Energy: 2.1753090436688476
Energy: 2.0165648263472433
Energy: 1.8233798055691173
Energy: 1.707220155887262
Energy: 1.5943578638548395
Energy: 1.83418376390928
Energy: 1.906417997311192
Energy: 2.045203614826037
Energy: 1.9087749139801797
Energy: 1.7937273506538371
Energy: 1.7205620014256966
Energy: 1.642646614982173
Energy: 1.9373522232438969
Energy: 1.8123468978870565
Energy: 1.8726347342153336
Energy: 1.9347638446698736
Energy: 1.8447551355937035
Energy: 1.769820746657387
Energy: 1.7315206544574882
Energy: 1.9097155606136071
Energy: 1.6597673555172978
Energy: 1.7168377416941836
Energy: 1.684877406759337
Energy: 1.7934648860077922
Energy: 1.9347874010524986
Energy: 1.8645045835124512
Energy: 1.8718047335124661
Energy: 1.5592287503123319
Energy: 1.6801708708140783
Energy: 1.8767465187519456
Energy: 1.8435531928095337
Energy: 2.141807624893932
Energy: 1.849885652124505
Energy: 1.8607149043227318
Energy: 1.4959339320864844
Energy: 1.5996447993390535
Energy: 1.7508561858230796
Energy: 1.6965734065318043
Energy: 2.024130856539176
Energy: 1.887605458800874
Energy: 1.745539068077251
Energy: 1.6396488005262635
Energy: 1.70530678448581
Energy: 1.6847770542702132
Energy: 1.8120064678370302
Energy: 1.9121328524340337
Energy: 1.5938040425784699
Energy: 1.8639819185148392
Energy: 1.5585985381680627
Energy: 1.7911942202297655
Energy: 1.794208414825151
Energy: 1.8107768134623448
Energy: 1.822183194039715
Energy: 1.5102203968262229
Energy: 1.8568589943346803
Energy: 1.851133202296842
Energy: 2.0315883266897075
Energy: 1.9739900103517838
Energy: 1.762145466180757
Energy: 1.7814956612556418
Energy: 1.6447886099388958
Energy: 1.6915395028080031
Energy: 2.0319014241819353
Energy: 2.058994653306736
Energy: 1.8785464790248545
Energy: 1.6801881378063062
Energy: 1.7017967004446275
Energy: 1.5661829196610157
Energy: 1.7432425138118075
Energy: 1.9294260310956828
Energy: 2.181112305199578
Energy: 1.9968382935049822
Energy: 1.7097222360257738
Energy: 1.719974530996154
Energy: 1.4915355226698472
Energy: 1.8652320833518483
Energy: 1.8704919663396795
Energy: 1.9795053368193025
Energy: 2.036886238962444
Energy: 1.6874820120651286
Energy: 1.6946098526948092
Energy: 1.640463174411522
Energy: 1.842812951248103
Energy: 1.6485453107627341
Energy: 1.8406387210289548
Energy: 1.8995916040891918
Energy: 1.870475157410624
Energy: 1.7545633212123597
Energy: 1.680767957414796
Energy: 1.9091199263649354
Energy: 1.662706803472447
Energy: 1.7193211120289957
Energy: 1.766684065851327
Energy: 1.8349141370075595
Energy: 1.9447760810624446
Energy: 1.8942008978741691
Energy: 1.7869031588624538
Energy: 1.514210056102504
Energy: 1.5539577983728814
Energy: 1.7703477573246131
Energy: 1.863137195194076
Energy: 2.1384357101510223
Energy: 1.9279987122179914
Energy: 1.7634977162980554
Energy: 1.5152893108442569
Energy: 1.6310268379290793
Energy: 1.7628218459069835
Energy: 1.8046689146928472
Energy: 2.002057321534808
Energy: 1.9173332192751977
Energy: 1.7582290134885428
Energy: 1.6404539652428065
Energy: 1.6890859268549412
Energy: 1.672689885381479
Energy: 1.7916572737658785
Energy: 2.21287708826318
Energy: 1.5932688909267125
Energy: 1.8464484050955217
Energy: 1.4964108282359434
Energy: 1.750480309932589
Energy: 1.786240531480754
Energy: 1.7514481119726188
Energy: 1.8582656686610997
Energy: 1.5086764463906528
Energy: 1.832583262523829
Energy: 1.8888432164316244
Energy: 1.9511890247871846
Energy: 1.9364273040850772
Energy: 1.7590324500065897
Energy: 1.7447996637157324
Energy: 1.6291220161040327
Energy: 1.7699008215899918
Energy: 1.946156594663623
Energy: 2.15908963639452
Energy: 1.8708002486408852
Energy: 1.6577956355679566
Energy: 1.7163234645199557
Energy: 1.583950063340936
Energy: 1.7012324775974883
Energy: 1.970965058339787
Energy: 2.0590551868544815
Energy: 1.8375685929173737
Energy: 1.6220308201554354
Energy: 1.6571839380316093
Energy: 1.4948947609534902
Energy: 1.8167284900883505
Energy: 1.8675924330301652
Energy: 2.0247066356679264
Energy: 2.0345088725495044
Energy: 1.6452133760711691
Energy: 1.7518954616057467
Energy: 1.6402824262941742
Energy: 1.8804570987255536
Energy: 1.6798512003278034
Energy: 1.8290879887739162
Energy: 1.8619203681447314
Energy: 1.7975954005363475
Energy: 1.7232040786279743
Energy: 1.6462218973594456
Energy: 1.8423185130869288
Energy: 1.661803153734364
Energy: 1.6922020047659294
Energy: 1.785345440241431
Energy: 1.8570301128675932
Energy: 1.925355802044313
Energy: 1.9084817143771908
Energy: 1.8493624964379283
Energy: 1.4962755128906422
Energy: 1.6664766705655167
Energy: 1.7650542811776575
Energy: 1.8656918556006978
Energy: 1.9706993814253302
Energy: 1.903676097659751
Energy: 1.8409828998340898
Energy: 1.6005970642019138
Energy: 1.679592753899693
Energy: 1.8373287849504678
Energy: 1.8353559295576498
Energy: 2.013640626428198
Energy: 1.936043264106075
Energy: 1.8098764572314605
Energy: 1.643865325540976
Energy: 1.6893249985431011
Energy: 1.7119888879875325
Energy: 1.7916188252077219
Energy: 1.993007848757345
Energy: 1.889925660788141
Energy: 1.8520627974016792
Energy: 1.6664132995292131
Energy: 1.6750423195251305
Energy: 1.7376726009677783
Energy: 1.8379277408304202
Energy: 1.9233688988981814
Energy: 1.517411590819578
Energy: 1.8253752644613206
Energy: 1.7528651633158072
Energy: 1.9489545806300483
Energy: 1.852098039112884
Energy: 1.8790458684146276
Energy: 1.7996245685766714
Energy: 1.6399656047952804
Energy: 1.8272121417572122
Energy: 1.8874043377264846
Energy: 2.1841786242507033
Energy: 1.929327489705454
Energy: 1.690801217218632
Energy: 1.6895724460131332
Energy: 1.495310236717182
Energy: 1.828377280163582
Energy: 1.9641820607741385
Energy: 2.0967349607571277
Energy: 1.817330290721797
Energy: 1.647950000175682
Energy: 1.7521022230525671
Energy: 1.580889564420764
Energy: 1.7463623014763368
Energy: 1.8698797755261254
Energy: 2.0532759265513767
Energy: 2.007522171649464
Energy: 1.616374999601127
Energy: 1.683788519740724
Energy: 1.6491653299682265
Energy: 1.8230796905305218
Energy: 1.7314000911758094
Energy: 1.8328906636537714
Energy: 1.8654524600901277
Energy: 1.7915342735245934
Energy: 1.7267879896931742
Energy: 1.641468172618082
Energy: 1.9686946433352825
Energy: 1.6627871223368227
Energy: 1.7362168775320257
Energy: 1.7864607193165118
Energy: 1.8597031611599386
Energy: 1.8956447010557347
Energy: 1.7073927433401184
Energy: 1.947852843440422
Energy: 1.4965316344357285
Energy: 1.681435121587393
Energy: 1.7640746622996326
Energy: 1.7804132474111993
Energy: 1.962205357285429
Energy: 1.9019499547822298
Energy: 1.9938203455250478
Energy: 1.6069917000498346
Energy: 1.6941853438066088
Energy: 1.8903933266047148
Energy: 1.8423664944234892
Energy: 2.2330100960374923
Energy: 1.880424472025493
Energy: 1.8669939557983102
Energy: 1.618559707157785
Energy: 1.6635991529098892
Energy: 1.6506635272889998
Energy: 1.7849907622584993
Energy: 1.9998759432514799
Energy: 1.874499807687861
Energy: 1.8556127174374142
Energy: 1.6766535820007586
Energy: 1.6655578324747493
Energy: 1.713626910725554
Energy: 1.8409458892382013
Energy: 2.126413229048019
Energy: 1.5060732120957643
Energy: 1.8524575377093195
Energy: 1.7045335768713286
Energy: 1.8609262328426535
Energy: 1.8402087013460464
Energy: 1.8807249940007482
Energy: 1.8239427815989784
Energy: 1.6367517712080892
Energy: 1.7859526569918418
Energy: 1.7230738545837228
Energy: 2.129124824872136
Energy: 1.926544259114317
Energy: 1.806741373319568
Energy: 1.702915301771681
Energy: 1.4913742051309753
Energy: 1.8632003851117762
Energy: 1.9808295912974259
Energy: 2.0805382150094758
Energy: 1.9791086736506704
Energy: 1.550232739611546
Energy: 1.6940346926016299

minimum gb energy = 1.4913742051309753 eV
minimum distance =  2.49612105465859 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.7938513237791545
Energy: 2.0186386741913944
Energy: 1.7827328564884168
Energy: 1.9656499290893632
Energy: 1.8165302069921827
Energy: 1.7907661135240225
Energy: 1.8680638412001396
Energy: 1.682290194319835
Energy: 1.7887976614550847
Energy: 1.720722556899594
Energy: 1.789562156393965
Energy: 1.8263400110248094
Energy: 1.8183901469824635
Energy: 1.8652343900292032
Energy: 1.6941927740700569
Energy: 1.854232670828834
Energy: 1.6705026402910128
Energy: 1.834843866931014
Energy: 1.8821882581204672
Energy: 1.8359817839892043
Energy: 1.8237065235678624
Energy: 1.7175222678818578
Energy: 1.8565046512860501
Energy: 1.7237703801674682
Energy: 1.8755737196506224
Energy: 1.820662160002966
Energy: 1.7373581668268048
Energy: 1.8117854452487845
Energy: 1.7707281339437044
Energy: 1.8777608351480166
Energy: 1.7957016814971556
Energy: 1.8432188590604432
Energy: 1.7854677840089033
Energy: 1.7597506901513835
Energy: 1.8401145768723486
Energy: 1.6752830973856863
Energy: 1.8409333180766767
Energy: 1.781720659998606
Energy: 1.764879035207273
Energy: 1.7096788203534337
Energy: 1.780752103388087
Energy: 1.7512796825413464
Energy: 1.7389617087065374
Energy: 1.899828380109019
Energy: 1.7998400153807215
Energy: 1.8277104609263366
Energy: 1.8120812621243856
Energy: 1.7611611156070937
Energy: 1.84273726992128
Energy: 1.7755338449678963
Energy: 1.796606393823356
Energy: 1.7536476070001616
Energy: 1.8176890585013836
Energy: 1.7806692572493812
Energy: 1.813459216078129
Energy: 1.8447675295008525
Energy: 1.7251279785380282
Energy: 1.7964812694576366
Energy: 1.663814481994209
Energy: 1.8142471427705213
Energy: 1.875737200489831
Energy: 1.7528781320818334
Energy: 1.8642059563442899
Energy: 1.732597788044626
Energy: 1.8125274192098115
Energy: 1.7144130273265537
Energy: 1.817464773086117
Energy: 1.8579718825408122
Energy: 1.7817427948192655
Energy: 1.8744492298422135
Energy: 1.8090059591250345
Energy: 1.9241931906694238
Energy: 1.7950266605267502
Energy: 1.8331018848597413
Energy: 1.86287126754266
Energy: 1.7533289358894366
Energy: 1.8875104188270317
Energy: 1.7483861016786626
Energy: 1.8788058654839566
Energy: 1.6940541989442628
Energy: 1.8499220209823435
Energy: 1.6818893722146886
Energy: 1.7546223553156446
Energy: 1.841681026595457
Energy: 1.7277973334126686
Energy: 1.867230893033497
Energy: 1.7935590284797736
Energy: 1.83787308571268
Energy: 1.8190443551025473
Energy: 1.8017506928417342
Energy: 1.802305366920854
Energy: 1.7531127176558783
Energy: 1.782930528050571
Energy: 1.833425073416149
Energy: 1.8543345803848588
Energy: 1.7927072414391458
Energy: 1.841544649821917
Energy: 1.8259391016309636
Energy: 1.6775115038081696
Energy: 1.8785075452425304
Energy: 1.778177287866725
Energy: 1.877397850003283
Energy: 1.835540974255649
Energy: 1.7426444499155758
Energy: 1.8686006673083324
Energy: 1.7281980777397845
Energy: 1.8569796441814905
Energy: 1.7593720073891248
Energy: 1.8092299442654751
Energy: 1.8284571633338405
Energy: 1.8357319687311466
Energy: 1.8109676187459938
Energy: 1.7183145848107704
Energy: 2.0449082564537115
Energy: 1.7958145329527095
Energy: 1.8306854928825032
Energy: 1.891968196580227
Energy: 1.8278108658998427
Energy: 2.0056537755359374
Energy: 1.8047939510743314
Energy: 1.780899143058524
Energy: 1.6914241554285252
Energy: 1.8884178903674247
Energy: 1.8758704671831394
Energy: 1.7785173085611221
Energy: 1.8333000987732466
Energy: 1.7297002544859008
Energy: 1.851990519085821
Energy: 1.7260540668779047
Energy: 1.8847483109026046
Energy: 2.0220588523737466
Energy: 1.7872972236104239
Energy: 1.8259632741025755
Energy: 1.722659151592028
Energy: 1.7797011263405944
Energy: 1.8146519225343887
Energy: 1.8596310779927208
Energy: 1.8709482518761165
Energy: 1.8862333321511322
Energy: 1.889159138557329
Energy: 1.7056040421306717
Energy: 1.8811597963619064
Energy: 1.6750762089796225
Energy: 1.8590983115485349
Energy: 1.8804910639696086
Energy: 1.6880876820169322
Energy: 1.8757795445033627
Energy: 1.7286250656778808
Energy: 1.8354276253160877
Energy: 1.8006531948408757
Energy: 1.9250079131245803
Energy: 1.7482535474918461
Energy: 1.7493329183106996
Energy: 1.7368200047265503
Energy: 1.7712446967432465
Energy: 2.085190728698341
Energy: 1.8715306980994795
Energy: 1.8526230847432246
Energy: 1.8358197971360983
Energy: 1.786877731733027
Energy: 2.0046658796415078
Energy: 1.771258093577833
Energy: 1.844921365384155
Energy: 1.8219210818097795
Energy: 1.9062636266041144
Energy: 1.7684777461567631
Energy: 1.7770426042870746
Energy: 1.8300459076022586
Energy: 1.7659384744916602
Energy: 1.8233350743980505
Energy: 1.7636295515132974
Energy: 1.8529159496940917
Energy: 1.9075779679008893
Energy: 1.787400611069361
Energy: 1.8995480116556083
Energy: 1.8071629871762929
Energy: 1.8003669352014353
Energy: 1.7770950809485915
Energy: 1.8278975167890943
Energy: 1.8147159227456024
Energy: 1.7873568899365124
Energy: 1.8475217203588548
Energy: 1.706387086607965
Energy: 1.8110454817122268
Energy: 1.715803910718627
Energy: 1.8253137986646606
Energy: 1.7895827730808764
Energy: 1.800315658233357
Energy: 1.8914574210488782
Energy: 1.731321174833708
Energy: 1.8667648024227168
Energy: 1.6604977986233416
Energy: 1.8996537999463952
Energy: 1.7544882546996403
Energy: 1.7799538092508607
Energy: 1.869651742476575
Energy: 1.8299482929790742
Energy: 1.7628086566337688
Energy: 1.80266800886266
Energy: 1.8364706932072297
Energy: 1.8411806168787697
Energy: 1.794787425700957
Energy: 1.9194206976333954
Energy: 1.810990678160804
Energy: 1.8477519460908096
Energy: 1.7820478789701153
Energy: 1.8681015080483048
Energy: 1.8534786495679136
Energy: 1.7711716368724946
Energy: 1.864527449330798
Energy: 1.7339282127167006
Energy: 1.810794852429801
Energy: 1.7681010075391783
Energy: 1.8329200913344765
Energy: 1.894123636992404
Energy: 1.7486294294064073
Energy: 1.7951120386500368
Energy: 1.7050287538576816
Energy: 1.846868153815024
Energy: 1.822764070750846
Energy: 1.8277337164374856
Energy: 1.8025904814553009
Energy: 1.7515147878738802
Energy: 1.7979969184778335
Energy: 1.6752634510899918
Energy: 1.810002553182345
Energy: 1.8276986947435232
Energy: 1.8535156362124083
Energy: 1.7986331596107779
Energy: 1.7319334182782473
Energy: 1.770973958174336
Energy: 1.7254106357585322
Energy: 1.8983376623933652
Energy: 1.6374402497468172
Energy: 1.9541564627273584
Energy: 1.7828919417041151
Energy: 1.7870002204696132
Energy: 1.8841939684521047
Energy: 1.8077502515003396
Energy: 1.8213885113017179
Energy: 1.816040282285765
Energy: 1.8533200621777575
Energy: 1.8208826281455308
Energy: 1.8948400918912
Energy: 1.9223167610181808
Energy: 1.8345266741100499
Energy: 1.9162837165354747
Energy: 1.765185302012856
Energy: 1.8971045661483883
Energy: 1.7746136678793571
Energy: 1.8214142491728293
Energy: 1.872685094748019

minimum gb energy = 1.6374402497468172 eV
minimum distance =  2.43397464492513 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.5245380793044112
Energy: 1.8250091155572774
Energy: 1.922213880779367
Energy: 1.8900696944047684
Energy: 1.962243867644689
Energy: 1.8222358727121506
Energy: 1.6547529419342388
Energy: 1.602333948198503
Energy: 1.8576224281046543
Energy: 1.7349775613260612
Energy: 1.6434605729776102
Energy: 1.6418615027018535
Energy: 1.5627427509955094
Energy: 1.8081779932280662
Energy: 1.8858432024171725
Energy: 1.744423672614748
Energy: 1.6047650877844877
Energy: 1.5902041774566609
Energy: 1.515687903714431
Energy: 1.6069363632903162
Energy: 1.918860808962018
Energy: 1.5667633337627773
Energy: 1.7995327491607478
Energy: 1.6765535766562076
Energy: 1.6069113176596912
Energy: 1.6091094799480072
Energy: 1.74771937997987
Energy: 1.830927289926174
Energy: 1.5650849585471116
Energy: 1.6719623757638336
Energy: 1.656788758224364
Energy: 1.8243153664741452
Energy: 1.8997317266730145
Energy: 1.8351852561868502
Energy: 1.7634490087125698
Energy: 1.5271444768755438
Energy: 1.6223046257500564
Energy: 1.5676823809664886
Energy: 1.7810723889738471
Energy: 1.6540610627884975
Energy: 1.828251922336456
Energy: 1.9380154372979688
Energy: 1.8744041576590285
Energy: 2.0914074548348083
Energy: 1.9767063432008636
Energy: 1.8031743811576615
Energy: 1.6738994968052279
Energy: 1.5608054603845356
Energy: 1.9187867094439208
Energy: 1.5230848056906259
Energy: 1.9024883575075329
Energy: 1.9614844119899997
Energy: 1.8715654499894632
Energy: 1.7239927411245273
Energy: 1.8959198931809116
Energy: 1.8754008280167767
Energy: 1.5230217443881393
Energy: 1.8684050947763187
Energy: 1.929811613581867
Energy: 1.6792114934935354
Energy: 1.7115818401911884
Energy: 1.8497849314561325
Energy: 1.9471645297559044
Energy: 1.87659298429145
Energy: 1.9681166333851536
Energy: 1.7661197373138613
Energy: 1.5120561888628032
Energy: 1.5579711456702352
Energy: 1.6665142916246494
Energy: 1.863758654051244
Energy: 1.606929589079507
Energy: 1.6402945856524045
Energy: 1.5989488021654974
Energy: 1.4549061608479361
Energy: 1.6012528171064282
Energy: 1.576802048284321
Energy: 2.1834741047139894
Energy: 1.565639386882738
Energy: 1.6787966816379847
Energy: 1.6075333013207516
Energy: 1.77796195863446
Energy: 1.7214937208809815
Energy: 1.8099045825295321
Energy: 1.7637608300760186
Energy: 1.5163053515381162
Energy: 1.664223404903951
Energy: 1.7473761409017599
Energy: 1.773713732494912
Energy: 1.569686433164369
Energy: 1.9041523649027638
Energy: 1.6890476254273046
Energy: 1.8493637443839084
Energy: 1.8471096882762919
Energy: 1.5462954760123417
Energy: 1.7629457727269442
Energy: 1.7212447544948755
Energy: 1.5616195840727896
Energy: 1.8926581728021294
Energy: 1.653167795190501
Energy: 1.6694992056002833
Energy: 1.693381619063793
Energy: 1.9026082533223008
Energy: 1.6838592877362002
Energy: 1.5260389968279378
Energy: 1.9232404755484493
Energy: 1.5094035505853387
Energy: 1.8716172856317794
Energy: 1.8724399966048695
Energy: 1.7633696086206923
Energy: 1.9467096886338995
Energy: 1.8216825524267772
Energy: 1.6550799227853308
Energy: 1.6058102559302048
Energy: 1.8567414708143728
Energy: 1.7394799818763822
Energy: 1.6661737372045062
Energy: 1.651132003926124
Energy: 1.6895925890743755
Energy: 1.8075119183900146
Energy: 1.8619252466124636
Energy: 1.7440656010767264
Energy: 1.6030027144571215
Energy: 1.545773123608562
Energy: 1.5157731991897714
Energy: 1.6083829506400598
Energy: 1.9188363107833886
Energy: 1.608413925434913
Energy: 1.7981388550094959
Energy: 1.6770582200830813
Energy: 1.607430472810062
Energy: 1.6100954946545745
Energy: 1.7490585673573407
Energy: 1.750280324942319
Energy: 1.565569634247969
Energy: 1.5265389266110077
Energy: 1.6565226960307033
Energy: 1.8163992425557183
Energy: 1.8944044467142194
Energy: 1.834322141013901
Energy: 1.894345371935574
Energy: 1.5262234196439435
Energy: 1.6216152611847539
Energy: 1.566327321317894
Energy: 1.7458452517949987
Energy: 1.65355972999363
Energy: 1.4861704575208985
Energy: 1.938506290586143
Energy: 1.8717938072686664
Energy: 2.0943875741423983
Energy: 1.979017847507182
Energy: 1.803221210144922
Energy: 1.664507782715372
Energy: 1.5879787168376212
Energy: 1.8527784711551332
Energy: 1.5228346821834295
Energy: 1.9024271709462832
Energy: 1.9624317314206352
Energy: 1.8646492888568729
Energy: 1.722379534664063
Energy: 1.8956297412659053
Energy: 1.875414978237014
Energy: 1.5231683552765845
Energy: 1.8681559300189878
Energy: 1.92954246336017
Energy: 1.4939713022776753
Energy: 1.723131751413998
Energy: 1.8500486081354954
Energy: 1.9594153275318122
Energy: 1.87755306247752
Energy: 1.970193489522949
Energy: 1.7870204049550755
Energy: 1.5118991646980975
Energy: 1.5487578526112846
Energy: 1.6601406998529278
Energy: 1.8794603424238718
Energy: 1.6064261295514504
Energy: 1.642656895948434
Energy: 1.6476346595027647
Energy: 1.4560198634377777
Energy: 1.688181055161815
Energy: 1.6782159514073565
Energy: 2.1829690801360195
Energy: 1.5659699341314877
Energy: 1.678581646583609
Energy: 1.6072469557647695
Energy: 1.778325796224346
Energy: 1.7430924381507125
Energy: 1.8087949065014761
Energy: 1.7640924942875473
Energy: 1.5322018845658665
Energy: 1.6656226416863773
Energy: 1.7480672501574335
Energy: 1.774746981472288
Energy: 1.5711795414085477
Energy: 1.9035914598490453
Energy: 1.688796775933589
Energy: 1.847434425663584
Energy: 1.8470535608067589
Energy: 1.5475788469402845
Energy: 1.7647291985076508
Energy: 1.686887067207779
Energy: 1.5595367338279518
Energy: 1.882348375467988
Energy: 1.6533946586451682
Energy: 1.67789245611045
Energy: 1.702454167038387
Energy: 1.7839834650386097
Energy: 1.6793147553636307
Energy: 1.5255366121992582
Energy: 1.9176897095226266

minimum gb energy = 1.4549061608479361 eV
minimum distance =  2.49871907577433 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.933523338203864
Energy: 2.059574835162343
Energy: 1.9488530062030818
Energy: 2.0417742378171493
Energy: 1.9045237278152714
Energy: 1.8108836242269077
Energy: 1.9812168857911572
Energy: 1.9990156013655702
Energy: 1.9723340552245336
Energy: 1.9766768390930285
Energy: 1.973852042412041
Energy: 1.9417714623311029
Energy: 1.9347062783199624
Energy: 2.0365369904636146
Energy: 1.9549642584531282
Energy: 1.7488889463200148
Energy: 1.8423384868804782
Energy: 1.9080960104193871
Energy: 1.9039232631934333
Energy: 1.908140739663517
Energy: 1.86576108119982
Energy: 1.8349438113863656
Energy: 1.9504118809091056
Energy: 1.6463999253773673
Energy: 1.8458949415037094
Energy: 1.7209652040141474
Energy: 1.6674448561650237
Energy: 1.965122444547956
Energy: 1.7129119087134936
Energy: 1.7087115315421155
Energy: 1.9053718783359674
Energy: 1.6506265989215059
Energy: 1.9289821813170294
Energy: 1.9981946719201977
Energy: 1.7776400250821758
Energy: 1.6217719783390259
Energy: 1.6789079125288733
Energy: 1.8376643298340467
Energy: 2.0153260372945976
Energy: 1.9847731204005528
Energy: 1.8902904391989601
Energy: 1.6997637627486404
Energy: 1.9068682054258306
Energy: 2.023731598488548
Energy: 1.7425339970787093
Energy: 1.7719539732840068
Energy: 1.5863455711491314
Energy: 1.585745404670353
Energy: 1.9152357930635944
Energy: 1.8172044869821509
Energy: 1.6799929438367078
Energy: 1.8730159108530593
Energy: 1.8529497796912233
Energy: 1.831657133994013
Energy: 1.7576568584767611
Energy: 1.7245877695176195
Energy: 1.7506019903912093
Energy: 1.8782241250209843
Energy: 1.8872926277078383
Energy: 1.858434566978563
Energy: 2.060354013124792
Energy: 2.064382210234353
Energy: 1.992765060714291
Energy: 1.8485749528676845
Energy: 1.8167190138923663
Energy: 1.6972414822885014
Energy: 1.9541893947131377
Energy: 1.8312583284903927
Energy: 1.833490442273979
Energy: 1.929501511543158
Energy: 1.871431195186254
Energy: 1.9874402370975093
Energy: 1.8004639925647332
Energy: 2.1604395473008333
Energy: 1.9808600627218416
Energy: 1.9479124758514452
Energy: 1.9849713959929163
Energy: 1.8761484518894245
Energy: 2.151511003817196
Energy: 2.1386817259689375
Energy: 2.0582487484912675
Energy: 1.9661401951080726
Energy: 1.9766723780987048
Energy: 2.039773623487378
Energy: 1.987023311677372
Energy: 1.9788472558058685
Energy: 1.9570721700777236
Energy: 1.921412074647194
Energy: 1.8673902830057394
Energy: 1.762032529521993
Energy: 1.9375263540464618
Energy: 1.9232119344007839
Energy: 2.102234913114286
Energy: 1.9005945323586588
Energy: 1.921820424671352
Energy: 1.8095675762211691
Energy: 1.9361310401524372
Energy: 1.962260561770175
Energy: 1.9366883672783726
Energy: 1.767330380265472
Energy: 1.7503341983102196
Energy: 1.855471519335063
Energy: 1.9119609200461691
Energy: 1.9143111136227853
Energy: 1.9381978255462784
Energy: 2.074855132272324
Energy: 1.8396840947639579
Energy: 1.6622312146425189
Energy: 1.9253958662697104
Energy: 1.7747828735453413
Energy: 1.8226317352316794
Energy: 2.0459349655762336
Energy: 1.7176744893040288
Energy: 1.8745585799678088
Energy: 1.8342798245445646
Energy: 1.7584877895423572
Energy: 2.0109780147465397
Energy: 1.8689637973126867
Energy: 1.8075194508736603
Energy: 1.5590900864017752
Energy: 1.6650659912346781
Energy: 1.9258134499833943
Energy: 2.0553740264021405
Energy: 2.0840409085706253
Energy: 1.831138014053148
Energy: 1.8635771544493764
Energy: 1.6217117824819203
Energy: 1.8021823608210181
Energy: 1.8560727017702037
Energy: 1.7783144254329548
Energy: 1.6049438693420204
Energy: 1.6365160831172343
Energy: 1.7356802756859875
Energy: 1.8980116888157108
Energy: 1.8921591623956906
Energy: 1.7822305125622717
Energy: 1.7450957835718997
Energy: 1.7160765943351164
Energy: 1.724508521889067
Energy: 1.9126295885503306
Energy: 1.6984928664961934
Energy: 1.9331765878259437
Energy: 1.916183362933407
Energy: 1.8615868080809446
Energy: 1.9689918227909136
Energy: 1.8755649358155486
Energy: 1.9852314805956872
Energy: 1.8655981086872793
Energy: 1.8142239043446666
Energy: 1.6823384166524449
Energy: 1.8140743579879204
Energy: 1.8601976011847148
Energy: 1.905932994036793
Energy: 1.9708375851309086
Energy: 1.9319922299492605
Energy: 1.9543751164961303
Energy: 1.9505312714831942
Energy: 2.018044296662729
Energy: 1.812748781168295
Energy: 1.9652508504810844
Energy: 1.9621399219760942
Energy: 1.8700603675305145
Energy: 2.0030992305300694
Energy: 2.0314379200724124
Energy: 2.060061553586178
Energy: 1.9794947942378367
Energy: 1.9478275181307718
Energy: 1.9270462589990152
Energy: 1.9230265996863485
Energy: 2.1284109757289675
Energy: 1.9159318687692384
Energy: 1.902413693905092
Energy: 1.8172856743006447
Energy: 1.9003019528738467
Energy: 1.9617704601951664

minimum gb energy = 1.5590900864017752 eV
minimum distance =  2.43824704866528 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.989878675940642
Energy: 2.144932202522956
Energy: 1.932199510138875
Energy: 2.062487565806988
Energy: 2.113849537485736
Energy: 1.9087395490466563
Energy: 2.074239282315686
Energy: 1.9651272200196093
Energy: 2.092285571828273
Energy: 2.0094834136835105
Energy: 2.083127452386614
Energy: 2.0643943724859857
Energy: 1.9613271767466298
Energy: 2.1513462834027934
Energy: 2.0430087686463576
Energy: 1.9972116237796584
Energy: 1.9010673817657593
Energy: 1.9225632612023256
Energy: 1.980662966579457
Energy: 1.9281882106595285
Energy: 1.9980840154683506
Energy: 1.9442163490099515
Energy: 2.09074775542868
Energy: 1.8868033306391847
Energy: 1.9549143997268876
Energy: 1.9232266429242073
Energy: 1.8432891689343243
Energy: 2.081616836275341
Energy: 1.7776052072676445
Energy: 1.946241821958335
Energy: 1.9914335302156452
Energy: 2.015949067977082
Energy: 1.9304639664320324
Energy: 1.9446630464501033
Energy: 1.9310827437826839
Energy: 1.8096589614891574
Energy: 1.9157864511094962
Energy: 1.8484723490131605
Energy: 1.9321583546714138
Energy: 1.8754873559111986
Energy: 1.8662371418408081
Energy: 1.896659907530271
Energy: 1.943238908158785
Energy: 1.802213583861541
Energy: 1.9342252035092589
Energy: 1.868850459192956
Energy: 1.8876213924585905
Energy: 1.9736522838814465
Energy: 2.0600159658157677
Energy: 1.9205151554526985
Energy: 1.7003626733622288
Energy: 1.866121255099254
Energy: 1.8836445524070304
Energy: 1.9407062315359815
Energy: 1.8940276860323457
Energy: 1.724457463828498
Energy: 1.8429921128300635
Energy: 1.9706311695240468
Energy: 1.8671497712157337
Energy: 1.9074493626204627
Energy: 1.8205879386348844
Energy: 1.8178210004025903
Energy: 1.956995714634894
Energy: 1.807973987173736
Energy: 1.8491610694413463
Energy: 1.9115013585114744
Energy: 2.0056570193800902
Energy: 1.955515697233218
Energy: 1.9391823643992268
Energy: 1.7864847187070279
Energy: 1.8240425264887867
Energy: 1.7621018127403756
Energy: 1.91447601001608
Energy: 1.984041757173763
Energy: 1.9773557069121495
Energy: 1.7387150602093913
Energy: 1.7765361422783792
Energy: 1.9975895707901985
Energy: 1.8017140632973276
Energy: 1.8506523354308593
Energy: 1.7800980425804
Energy: 1.7931691101247387
Energy: 1.833483701811498
Energy: 1.8836432835611143
Energy: 1.9860115744610813
Energy: 1.7304906764782964
Energy: 1.8128983280249837
Energy: 1.924305767675224
Energy: 1.9122737902934313
Energy: 1.854315181112718
Energy: 1.837859817112422
Energy: 1.8436651828276942
Energy: 1.8127062171505814
Energy: 1.9629790067442585
Energy: 1.9647181189385523
Energy: 1.966173877262094
Energy: 1.9162926068475075
Energy: 1.8672472297243863
Energy: 1.7815108565671414
Energy: 1.9126777623012654
Energy: 1.8033529262565604
Energy: 1.968893053617066
Energy: 1.926939942061624
Energy: 1.861559370454794
Energy: 1.922697678312042
Energy: 1.7532387561634515
Energy: 1.891372573451268
Energy: 1.959370641630281
Energy: 1.9739586834885043
Energy: 2.0182466479313836
Energy: 1.8930642928891706
Energy: 1.8626206368893687
Energy: 1.9862785013401925
Energy: 2.0097334378045257
Energy: 1.8541227117951005
Energy: 1.8907144144801946
Energy: 1.8648914737713043
Energy: 1.8874287982115836
Energy: 2.139734268217795
Energy: 1.9000370997353808
Energy: 1.9268169068861094
Energy: 1.8752795892716525
Energy: 1.8936436900520428
Energy: 1.7977389591451447
Energy: 1.8782956028090303
Energy: 1.9790423004723812
Energy: 1.92440938610821
Energy: 1.9887661321981158
Energy: 1.9581511243555494
Energy: 1.995886624872146
Energy: 2.0088069488471034
Energy: 2.0400983147889273
Energy: 2.065558185108569
Energy: 1.9118821904341636
Energy: 2.0771478376885364
Energy: 1.8796696266145072
Energy: 2.018587095288699
Energy: 2.0450261290969123
Energy: 1.932815977696498
Energy: 2.062515260191689
Energy: 1.9881626805206716
Energy: 2.089354274976927
Energy: 1.9838690710078877
Energy: 2.0306721473555873
Energy: 1.9367400516889823
Energy: 1.9428669298310461
Energy: 2.076752403668774
Energy: 1.9395941325544908
Energy: 2.1079709164508937
Energy: 2.0199903094461247
Energy: 2.000679020876757
Energy: 2.019521458348497
Energy: 1.9611029331564926
Energy: 2.080224456981604
Energy: 1.943966034143155
Energy: 2.0716218388652465
Energy: 1.913670857259892
Energy: 2.057328320075144
Energy: 2.0737030769511584
Energy: 1.9186699091519326
Energy: 2.046148217990083
Energy: 1.9485133917398998
Energy: 2.061433313216473
Energy: 2.011652623770984
Energy: 2.126704540404768
Energy: 2.040141270466656
Energy: 1.976195197250991
Energy: 2.0820696735100634
Energy: 1.9808155703723656
Energy: 1.9653092167997386
Energy: 1.921290134253258
Energy: 1.9355549441000879
Energy: 1.9003049670613952
Energy: 1.9475673436224301
Energy: 2.000471796677741
Energy: 2.001770036256085
Energy: 2.091820931889323
Energy: 1.8824583875186254
Energy: 1.9604024988929005
Energy: 1.9077765220822929
Energy: 1.842700063022273
Energy: 2.0927399891220673
Energy: 1.7743477630326179
Energy: 2.022420079160584
Energy: 1.9953696439222206
Energy: 2.0153245653526373
Energy: 1.9945169381157544
Energy: 1.9709402944901084
Energy: 1.943301875548882
Energy: 1.810316027226322
Energy: 1.882670276716251
Energy: 1.8738283684037902
Energy: 2.0119511744143175
Energy: 1.8728209583694173
Energy: 1.8416734298772894
Energy: 1.9099477932465958
Energy: 1.9378872984959254
Energy: 1.8449614211947558
Energy: 1.9302853610187642
Energy: 1.9441619375395873
Energy: 1.950040837474204
Energy: 1.9604922626466572
Energy: 1.908815391066612
Energy: 1.9239462502867486
Energy: 1.685435452790992
Energy: 1.829515813761227
Energy: 1.9199555888347262
Energy: 1.9455536659251964
Energy: 1.8495432613555949
Energy: 1.8835744571972657
Energy: 1.879247364873461
Energy: 1.8826057319843585
Energy: 1.893766764312737
Energy: 1.8949908112394536
Energy: 1.8105580203190557
Energy: 1.8470134269612788
Energy: 1.9756011873595893
Energy: 1.862089867629932
Energy: 1.8435577031145596
Energy: 1.9174899181215825
Energy: 1.8623436295044695
Energy: 1.9482365057747533
Energy: 1.9314140468028413
Energy: 1.7996218124908614
Energy: 1.835402125585487
Energy: 1.8159890971732158
Energy: 1.8821667437666905
Energy: 1.8674401418345452
Energy: 1.9933688871308355
Energy: 1.8785184896603384
Energy: 1.740242364336803
Energy: 1.8764398334551282
Energy: 1.8144872807679033
Energy: 1.8477914071965271
Energy: 1.8400630839624406
Energy: 1.7911825071814935
Energy: 1.8273002303815833
Energy: 2.0204959992490337
Energy: 1.954754907600526
Energy: 1.6585099694909295
Energy: 1.826946305800353
Energy: 1.827285248545723
Energy: 1.9335993378341974
Energy: 1.8554976967908223
Energy: 1.739238820745235
Energy: 1.8724881370675481
Energy: 1.8144542618006965
Energy: 1.9860228635417247
Energy: 1.8647723494314612
Energy: 1.9839361388432142
Energy: 1.93366361069502
Energy: 1.9482553877086113
Energy: 1.7769320457638271
Energy: 1.9016399101880976
Energy: 1.8364823111601454
Energy: 1.9495251886834366
Energy: 1.8995546549886804
Energy: 1.865308204869215
Energy: 1.8516861526322994
Energy: 1.7580268991680157
Energy: 1.904368077111059
Energy: 1.965955702681446
Energy: 1.9457369107401994
Energy: 1.943429320085213
Energy: 1.8802419150777152
Energy: 1.841508700927918
Energy: 1.9647630879043683
Energy: 2.0466463873789698
Energy: 1.853472546024663
Energy: 1.8811635612026936
Energy: 1.8599459413981594
Energy: 1.8077846234692125
Energy: 2.1157243444763147
Energy: 1.95448331658515
Energy: 1.9697689304410353
Energy: 1.8733258484076292
Energy: 1.8828363339853726
Energy: 1.9173025543308022
Energy: 1.8702258861578862
Energy: 1.9089550952175773
Energy: 1.9201788362259986
Energy: 1.981170348683024
Energy: 1.9743625124734803
Energy: 2.0829679131577525
Energy: 2.0578705809151927
Energy: 1.9956409988917294
Energy: 2.0162564896515778
Energy: 1.9346816109789553
Energy: 2.0016531553530523
Energy: 1.8594228529207857
Energy: 2.01808415189001
Energy: 2.0741941911007293
Energy: 1.9057936840615601
Energy: 2.0518119427921797
Energy: 1.9776877485566502
Energy: 2.08048957286582
Energy: 1.9801477400399008
Energy: 1.9942938745633645
Energy: 1.983095584951428
Energy: 1.923437644666135
Energy: 2.087261030489343
Energy: 2.030056494860432
Energy: 2.1564060126371984
Energy: 2.0208281198913953
Energy: 2.0717107788554547
Energy: 1.97703245917633
Energy: 1.969273265705939
Energy: 2.1606550601226178
Energy: 1.9697446243458723
Energy: 2.0909438534045472
Energy: 1.943250474191953
Energy: 2.043747525316865
Energy: 2.0776545077051054
Energy: 1.935650919934039
Energy: 2.07781496279832

minimum gb energy = 1.6585099694909295 eV
minimum distance =  2.43057925410784 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.6303174819301716
Energy: 1.8712058238784695
Energy: 1.5605439567700257
Energy: 1.6163330277397359
Energy: 1.6176666327772835
Energy: 1.5604537168528794
Energy: 1.6347036759281826
Energy: 1.6573457919607442
Energy: 1.8181664651587763
Energy: 1.5930036245384778
Energy: 1.569133584241585
Energy: 1.56826474783765
Energy: 1.5931212913115929
Energy: 1.940004153909578
Energy: 1.70524898509288
Energy: 1.8801645439733161
Energy: 1.645490379728891
Energy: 1.6482185190902983
Energy: 1.5779825173693451
Energy: 1.595188206399728
Energy: 1.6437567637582058
Energy: 1.7028502179422376
Energy: 1.8868205592889595
Energy: 1.6178286332356944
Energy: 1.6208652148506992
Energy: 1.6214642765650547
Energy: 1.6159766095089518
Energy: 1.6583631327692534
Energy: 1.7140593831083213
Energy: 2.0503885723943833
Energy: 1.5576731713726892
Energy: 1.9500016718858244
Energy: 1.5716983305268277
Energy: 1.5555710586556177
Energy: 1.9558602544093986
Energy: 1.6314685628382253
Energy: 1.900380656846962
Energy: 1.561621486198265
Energy: 1.6178331074665886
Energy: 1.6182686767281382
Energy: 1.5602832873373114
Energy: 1.6590876037225817
Energy: 1.6314807266211724
Energy: 1.8186207620913803
Energy: 1.5982820730374718
Energy: 1.552447504507436
Energy: 1.5943531472393673
Energy: 1.5960760828896847
Energy: 1.9568405833109022
Energy: 1.6344911423731963
Energy: 1.8843248460681068
Energy: 1.5970121509034856
Energy: 1.564639452870769
Energy: 1.5640302123092111
Energy: 1.5976447346304399
Energy: 2.0095053819081574
Energy: 1.6322200479397904
Energy: 1.8841207844148942
Energy: 1.5624377206567728
Energy: 1.6182582694097938
Energy: 1.618980649275575
Energy: 1.6136838672977525
Energy: 1.6588794774780635
Energy: 1.7133443677535398
Energy: 2.020291315839305
Energy: 1.5523796921186606
Energy: 1.9504161214345521
Energy: 2.083604211976741
Energy: 1.55584026924591
Energy: 1.953645011789209
Energy: 1.6336857246290013
Energy: 1.8795805203374991
Energy: 1.5629750807462601
Energy: 1.6195237611836864
Energy: 1.6202635166926342
Energy: 1.615035002200084
Energy: 1.657811806036524
Energy: 1.7040138923361694
Energy: 1.8785238293295141
Energy: 1.5966359431901516
Energy: 1.5507254818854903
Energy: 1.5648470013483988
Energy: 1.5943789061395655
Energy: 2.0097871662981674
Energy: 1.6355308762292478
Energy: 1.9548027749363897
Energy: 1.5972989946750424
Energy: 1.5836937752165512
Energy: 1.566116418950477
Energy: 1.5967969583091683
Energy: 1.9390680020520523
Energy: 1.6304115670069603
Energy: 1.8109884879015137
Energy: 1.5609963237369167
Energy: 1.6174161635415367
Energy: 1.6180987749952571
Energy: 1.5609204173316757
Energy: 1.6359116712398747
Energy: 1.7145691638262945
Energy: 2.053138691388183
Energy: 1.5590796027643297
Energy: 1.5703238601954825
Energy: 1.5695079713857962
Energy: 1.5939859320561367
Energy: 1.954485649134138
Energy: 1.703162422122035
Energy: 1.8837278619521889
Energy: 1.6472670556096318
Energy: 1.6470025472567957
Energy: 1.5878841072849563
Energy: 1.6445059847361418
Energy: 1.6428050145947644
Energy: 1.702916842208245
Energy: 1.8876651045421349
Energy: 1.6468628618080274
Energy: 1.6471495225678678
Energy: 1.588358309663491
Energy: 1.6440421549250361
Energy: 1.643048203359465
Energy: 1.6972858115502298
Energy: 2.052399253495901
Energy: 1.5934685951403365
Energy: 1.569021072506435
Energy: 1.5700187988979593
Energy: 1.5930184031281056
Energy: 1.9391566088118475
Energy: 1.6302191337039051
Energy: 1.8760274604742524
Energy: 1.5607302969214252
Energy: 1.6168662877038802
Energy: 1.6172835775342995
Energy: 1.5600898645883374
Energy: 1.636127915991785
Energy: 1.7260657398776507
Energy: 1.8180665466325918
Energy: 1.593337846242857
Energy: 1.5667190676250087
Energy: 1.5957647972253746
Energy: 1.5943331860520324
Energy: 1.9421512411350685

minimum gb energy = 1.5507254818854903 eV
minimum distance =  2.45987896831797 Angstroms
sigma value = 23