Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001_Cu__MO_380822813353_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.6148132324218762
cohesive_energy=3.540081929549165
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 2.2204e-16 eV

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

Energy: 0.013691801593076888
Energy: 0.014292073811508401
Energy: 0.7408558833446681
Energy: 0.014292073811508401
Energy: 0.014292073812100833
Energy: 0.7482396380941556
Energy: 0.014292073811508401
Energy: 0.748239638094748
Energy: 0.7408558833464802
Energy: 0.014292073811508401
Energy: 0.013691801593076888
Energy: 0.014292073811508401
Energy: 0.014292073811508401
Energy: 0.748239638094748
Energy: 0.014292073812100833
Energy: 0.748239638094748

minimum gb energy = 0.013691801593076888 eV
minimum distance =  2.44175942682323 Angstroms
sigma value = 1


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

Energy: 0.8755490947197316
Energy: 0.8589174580798474
Energy: 0.8040039411910225
Energy: 0.8589174580783259
Energy: 0.833363137944822
Energy: 0.8576399302173477
Energy: 0.8262467778334536
Energy: 0.85763993021963
Energy: 0.7805710183941363
Energy: 0.8432990858068015
Energy: 0.8479900063951177
Energy: 0.8432990858068015
Energy: 0.8113544715101003
Energy: 0.8723535451737743
Energy: 0.8088765265315181
Energy: 0.872353545174535
Energy: 0.8136088185409545
Energy: 0.861224346321138
Energy: 0.8178120187013956
Energy: 0.8612243463203773
Energy: 0.7927513062448437
Energy: 0.8509078580621549
Energy: 0.7763356356511604
Energy: 0.8509078580659587
Energy: 0.8360230729794544
Energy: 0.8427387834053657
Energy: 0.7941372224993717
Energy: 0.8427387834053657
Energy: 0.7430346271670009
Energy: 0.8598768055746399
Energy: 0.7690652786822161
Energy: 0.8598768055769221
Energy: 0.8117151334047652
Energy: 0.8266003919822044
Energy: 0.824742305327314
Energy: 0.8266003919799221
Energy: 0.7700375945977453
Energy: 0.8429444428660346
Energy: 0.7327835025079039
Energy: 0.8429444428637524
Energy: 0.8172627841545231
Energy: 0.8564336976695882
Energy: 0.8090776360903168
Energy: 0.8564336976726313
Energy: 0.8022729550655305
Energy: 0.8599529472145856
Energy: 0.784651848032489
Energy: 0.8599529472161072
Energy: 0.8244254311154788
Energy: 0.8423640599008303
Energy: 0.8359858906089761
Energy: 0.8423640599000695
Energy: 0.8285988065894637
Energy: 0.850906563601049
Energy: 0.7981255058813245
Energy: 0.850906563601049
Energy: 0.8179457625783159
Energy: 0.8588660061984654
Energy: 0.8239952726933454
Energy: 0.8588660061984654
Energy: 0.818320477884004
Energy: 0.8592169451516718
Energy: 0.8239340356372903
Energy: 0.8592169451509111
Energy: 0.8478051994275589
Energy: 0.843299833870411
Energy: 0.7712209244055493
Energy: 0.843299833868924
Energy: 0.8260676557690533
Energy: 0.8435113981169811
Energy: 0.8339866705150184
Energy: 0.8435113981192633
Energy: 0.780801436275185
Energy: 0.8594358636071276
Energy: 0.7837116945731583
Energy: 0.8594358636078884
Energy: 0.8265242319918051
Energy: 0.8271164630873138
Energy: 0.8149313922234033
Energy: 0.8271164630865531
Energy: 0.7725572054050539
Energy: 0.8430285935337073
Energy: 0.7507527932956041
Energy: 0.8430285935329466
Energy: 0.809488397881611
Energy: 0.8713446761612635
Energy: 0.8183200395412716
Energy: 0.871344676159742
Energy: 0.8176873531867045
Energy: 0.8608136107520885
Energy: 0.7776469424391339
Energy: 0.8608136107536101
Energy: 0.7998422427338728
Energy: 0.8441403886333863
Energy: 0.7929564014222122
Energy: 0.844140388634147
Energy: 0.7941879150348461
Energy: 0.8505948286132724
Energy: 0.8361351706258305
Energy: 0.8505948286147939
Energy: 0.8155638161845258
Energy: 0.8601278020803426
Energy: 0.7775573145349189
Energy: 0.8601278020788211
Energy: 0.8181152310046336
Energy: 0.8514990658687539
Energy: 0.8111200865502944
Energy: 0.8514990658695146
Energy: 0.7718180431222788
Energy: 0.8426447061593465
Energy: 0.8534309462530651
Energy: 0.8426447061585857
Energy: 0.8327748515071884
Energy: 0.8550404749003266
Energy: 0.8170394854268445
Energy: 0.8550404749010874
Energy: 0.8729549617183859
Energy: 0.8593480921600003
Energy: 0.8026856142898222
Energy: 0.8593480921584787
Energy: 0.8360063148677351
Energy: 0.8526852626718586
Energy: 0.824208321634207
Energy: 0.8526852626741409
Energy: 0.8003247605920758
Energy: 0.8437869893950035
Energy: 0.828285839789238
Energy: 0.8437869893934821
Energy: 0.8134972412469824
Energy: 0.8716203636254508
Energy: 0.8086865812780868
Energy: 0.8716203636269724

minimum gb energy = 0.7327835025079039 eV
minimum distance =  2.25856472689532 Angstroms
sigma value = 1


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

Energy: 0.9258825019741621
Energy: 0.9185891948469681
Energy: 0.8444290781541641
Energy: 0.9185891948573768
Energy: 0.8512499205477674
Energy: 0.9017552068833018
Energy: 0.8548570767981535
Energy: 0.9017552068789649
Energy: 0.8106656174090794
Energy: 0.9178020952696998
Energy: 0.8543670279540228
Energy: 0.9178020952696998
Energy: 0.8119781256732242
Energy: 0.8684768999042207
Energy: 0.8199714963878687
Energy: 0.8684768999042207
Energy: 0.8121634752208069
Energy: 0.8938907439312527
Energy: 0.8352460994839042
Energy: 0.8938907439303853
Energy: 0.8620213978144549
Energy: 0.893839580657171
Energy: 0.8013208436034954
Energy: 0.893839580659773
Energy: 0.8496955369743796
Energy: 0.8691379578620099
Energy: 0.8311916487838541
Energy: 0.8691379578602749
Energy: 0.7620261680515931
Energy: 0.9176112948216872
Energy: 0.8012861435824195
Energy: 0.9176112948225545
Energy: 0.8242727108117549
Energy: 0.8778911888063259
Energy: 0.8548686150500763
Energy: 0.8778911888097956
Energy: 0.8116601922010647
Energy: 0.9178502685923778
Energy: 0.8183804420387866
Energy: 0.9178502685889083
Energy: 0.8495192301723589
Energy: 0.8826200460775061
Energy: 0.8518592188285997
Energy: 0.8826200460844452
Energy: 0.7921002676310235
Energy: 0.9045393657605969
Energy: 0.8593503438117639
Energy: 0.90453936575626
Energy: 0.877247713866079
Energy: 0.8931940979666814
Energy: 0.8237625388913427
Energy: 0.8931940979675487
Energy: 0.8772467817980835
Energy: 0.8932248782564308
Energy: 0.858239457181885
Energy: 0.8932248782494915
Energy: 0.792097517358733
Energy: 0.9044512959589223
Energy: 0.8592729784463327
Energy: 0.904451295951983
Energy: 0.8495622321189379
Energy: 0.8824786034521314
Energy: 0.8433965078975415
Energy: 0.8824786034460594
Energy: 0.8116644523313258
Energy: 0.9176097324705241
Energy: 0.8170179648890711
Energy: 0.9176097324731264
Energy: 0.8243104862776282
Energy: 0.8779081874827661
Energy: 0.8549241787333357
Energy: 0.8779081874827661
Energy: 0.7620037963548236
Energy: 0.9176624072516542
Energy: 0.8066697162354681
Energy: 0.9176624072568585
Energy: 0.8496429939598567
Energy: 0.8691463579773764
Energy: 0.8248822659835585
Energy: 0.869146357976509
Energy: 0.8619938939651174
Energy: 0.8939995154243933
Energy: 0.8301140743749237
Energy: 0.8939995154243933
Energy: 0.8121619183466189
Energy: 0.8938864687410245
Energy: 0.8388165255525328
Energy: 0.8938864687427593
Energy: 0.8120651615617145
Energy: 0.8684244631930658
Energy: 0.8453069856149742
Energy: 0.8684244631991375
Energy: 0.8107199929734845
Energy: 0.9173809540740309
Energy: 0.8512451639879401
Energy: 0.9173809540766329
Energy: 0.8511213572277888
Energy: 0.9017668290523624
Energy: 0.8546192933875109
Energy: 0.9017668290488928
Energy: 0.9258825019741621
Energy: 0.9185891948469681
Energy: 0.8695263322171225
Energy: 0.9185891948573768
Energy: 0.8512499205460325
Energy: 0.9017552068833018
Energy: 0.8548570767981535
Energy: 0.9017552068798323
Energy: 0.8106656174073444
Energy: 0.9178020952696998
Energy: 0.8543670279540228
Energy: 0.9178020952696998
Energy: 0.8119781256697547
Energy: 0.8684768999042207
Energy: 0.8180762526613116
Energy: 0.8684768999042207

minimum gb energy = 0.7620037963548236 eV
minimum distance =  2.23671559609477 Angstroms
sigma value = 25


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

Energy: 0.9411777820285567
Energy: 0.9614003767309823
Energy: 0.917630824930817
Energy: 0.961400376729974
Energy: 0.8914583522460306
Energy: 0.9020126143237821
Energy: 0.8991615475742947
Energy: 0.9020126143207571
Energy: 0.8541277142240644
Energy: 0.990277246362969
Energy: 0.9004329731447571
Energy: 0.9902772463649856
Energy: 0.8820268342883592
Energy: 0.9353275581401349
Energy: 0.8538060121877238
Energy: 0.9353275581411433
Energy: 0.875641962944622
Energy: 0.9519035999372027
Energy: 0.8352439906723851
Energy: 0.9519035999382109
Energy: 0.9194743909637315
Energy: 0.9903324379228411
Energy: 0.8900565849473673
Energy: 0.9903324379218327
Energy: 0.8643870369593788
Energy: 0.8831342831132611
Energy: 0.8867867146633079
Energy: 0.8831342831485068
Energy: 0.9068549526757872
Energy: 0.9527579823034836
Energy: 0.8379680804393947
Energy: 0.9527579823055004
Energy: 0.8868465223225357
Energy: 0.9384085839750943
Energy: 0.8646161490520123
Energy: 0.9384085839750943
Energy: 0.9060202070458235
Energy: 0.9902200935618165
Energy: 0.8792123435808613
Energy: 0.9902200935587916
Energy: 0.8878730963383533
Energy: 0.9521533761530768
Energy: 0.864543456178264
Energy: 0.952153376154085
Energy: 0.8543370398031038
Energy: 0.9600642744684559
Energy: 0.8640330328915748
Energy: 0.9600642744674476
Energy: 0.9003350210465563
Energy: 0.9767855849461831
Energy: 0.8513334750449197
Energy: 0.9767855849461831
Energy: 0.9203252215207371
Energy: 0.8645451468582313
Energy: 0.9032409607622156
Energy: 0.8645451468572228
Energy: 0.8279465326066767
Energy: 0.9528588504185111
Energy: 0.8367641184533379
Energy: 0.9528588504195196
Energy: 0.8640387130539305
Energy: 0.9100004390432601
Energy: 0.8501966140940548
Energy: 0.9100004390462851
Energy: 0.8133388282241629
Energy: 0.989855998640194
Energy: 0.8126995711285188
Energy: 0.9898559986391855
Energy: 0.8530972823416683
Energy: 0.95318641538847
Energy: 0.8527575943628906
Energy: 0.9531864153874618
Energy: 0.8831678902537129
Energy: 0.959105390155363
Energy: 0.8544485050894048
Energy: 0.9591053901563713
Energy: 0.8510125019807256
Energy: 0.9901683844905426
Energy: 0.8989777798103918
Energy: 0.9901683844935676
Energy: 0.8906770207949382
Energy: 0.9077684791597453
Energy: 0.9004523940593594
Energy: 0.9077684791587369
Energy: 0.9408618477490527
Energy: 0.9608078295645442
Energy: 0.9154938607694542
Energy: 0.9608078295635359
Energy: 0.8877967575949035
Energy: 0.9575123140176252
Energy: 0.8987128003745298
Energy: 0.957512314016617
Energy: 0.8382241142980167
Energy: 0.9907201402093487
Energy: 0.9060130865981046
Energy: 0.9907201402083405
Energy: 0.8639822783670945
Energy: 0.935198655773119
Energy: 0.8522847345615067
Energy: 0.9351986557771523

minimum gb energy = 0.8126995711285188 eV
minimum distance =  2.24141463657594 Angstroms
sigma value = 9


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

Energy: 0.9371884762955658
Energy: 0.9365488492541858
Energy: 0.9282731013822404
Energy: 0.9365488492565642
Energy: 0.9292381802391022
Energy: 0.9881013237528758
Energy: 0.9241907444466889
Energy: 0.9881013237552817
Energy: 0.8349990924391487
Energy: 0.9380373046004732
Energy: 0.921557638462344
Energy: 0.9380373045992703
Energy: 0.9457533003343447
Energy: 1.0141945339000353
Energy: 0.8664343845989706
Energy: 1.0141945339012384
Energy: 0.9946372603596197
Energy: 0.9866908556620808
Energy: 0.9126733566501426
Energy: 0.9866908556620808
Energy: 0.8253201095422484
Energy: 0.9418266392554191
Energy: 0.8672444932457397
Energy: 0.9418266392554191
Energy: 0.944782684659005
Energy: 0.8665538627292105
Energy: 0.8673461904005969
Energy: 0.8665538627268047
Energy: 0.9029102459457449
Energy: 0.9418062017137714
Energy: 0.8588258112623218
Energy: 0.9418062017149742
Energy: 0.9452944505171265
Energy: 0.9877941195061055
Energy: 0.9250013003618535
Energy: 0.9877941195109169
Energy: 0.9428956793395655
Energy: 0.9372106957388133
Energy: 0.866414545509986
Energy: 0.9372106957376106
Energy: 0.8837171023547896
Energy: 0.9773172208714097
Energy: 0.9214209033479956
Energy: 0.9773172208726126
Energy: 0.9462549464044647
Energy: 0.974839488811482
Energy: 0.8664733328340303
Energy: 0.9748394888090763
Energy: 0.8252916224841279
Energy: 0.936897112816931
Energy: 0.8480203613075679
Energy: 0.9368971128205394
Energy: 0.9313106134664628
Energy: 0.941345995706806
Energy: 0.9245557628052338
Energy: 0.9413459957056032
Energy: 0.8253075359485891
Energy: 0.936861279915536
Energy: 0.8640532357212651
Energy: 0.9368612799131304
Energy: 0.9462789885033942
Energy: 0.9748502461999158
Energy: 0.8665051758681526
Energy: 0.9748502461999158
Energy: 0.8837240596934633
Energy: 0.9773171261508193
Energy: 0.8796081366167668
Energy: 0.9773171261520223
Energy: 0.9428712046226339
Energy: 0.9369291960521038
Energy: 0.866371317475891
Energy: 0.9369291960521038
Energy: 0.945190356239155
Energy: 0.9877522837580576
Energy: 0.8900932566647467
Energy: 0.9877522837568548
Energy: 0.9029202742678271
Energy: 0.941739731405313
Energy: 0.8588152358990971
Energy: 0.9417397314029072
Energy: 0.9449963918517587
Energy: 0.8665391926436833
Energy: 0.8673603138225161
Energy: 0.8665391926400747

minimum gb energy = 0.8252916224841279 eV
minimum distance =  2.3304143767821 Angstroms
sigma value = 25


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

Energy: 0.9008563722584935
Energy: 1.05894842254889
Energy: 0.9952619194756184
Energy: 1.05894842254889
Energy: 0.877351862275485
Energy: 0.9938719561097862
Energy: 0.8597062478220248
Energy: 0.9938719561112737
Energy: 0.8602064158291188
Energy: 1.0766325666089922
Energy: 0.8595505823929764
Energy: 1.0766325666075045
Energy: 0.9006636199272201
Energy: 1.050572949665536
Energy: 0.9613661773378774
Energy: 1.0505729496670237
Energy: 0.9628435980260485
Energy: 0.8777454288636805
Energy: 0.8595619950900696
Energy: 0.8777454288636805
Energy: 0.8633789715959704
Energy: 1.075781302273098
Energy: 0.8616164063025925
Energy: 1.0757813022745855
Energy: 0.9261052253043413
Energy: 0.9864942815523394
Energy: 0.8597242502224595
Energy: 0.9864942815523394
Energy: 0.9641161768987309
Energy: 1.009214947940752
Energy: 0.9045265770289073
Energy: 1.009214947937777
Energy: 0.8595440126335796
Energy: 0.9942809789750955
Energy: 0.8788207942735611
Energy: 0.9942809789765831
Energy: 1.0148798312154497
Energy: 1.0239931639570108
Energy: 0.8615574268647169
Energy: 1.0239931639555233
Energy: 0.9052843508157511
Energy: 1.0564861003894412
Energy: 1.0558013332775327
Energy: 1.0564861003894412
Energy: 0.8602319400807096
Energy: 0.9673947366528654
Energy: 1.0128329476901994
Energy: 0.9673947366528654
Energy: 0.9526590460200428
Energy: 1.0785053156688205
Energy: 0.8597403833684442
Energy: 1.0785053156673328
Energy: 0.8597506550929468
Energy: 0.8721462282517178
Energy: 0.9006771032407962
Energy: 0.8721462282502304
Energy: 0.8598960170950691
Energy: 1.0488225924122743
Energy: 0.9617919835755949
Energy: 1.048822592413762
Energy: 0.8767119235665244
Energy: 0.9435674772624575
Energy: 0.8631583789254105
Energy: 0.9435674772624575
Energy: 0.8598930685376568
Energy: 0.9445202470649994
Energy: 1.0158239400709523
Energy: 0.9445202470649994

minimum gb energy = 0.8595440126335796 eV
minimum distance =  2.30990461587066 Angstroms
sigma value = 17


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

Energy: 0.982474542157086
Energy: 0.9819757076743337
Energy: 1.0858125953685456
Energy: 0.9819757076760187
Energy: 1.0001143684366265
Energy: 0.9499065699241259
Energy: 0.8875751228626457
Energy: 0.9499065699215985
Energy: 0.9742648312263338
Energy: 0.9709656306669124
Energy: 0.8873362273783596
Energy: 0.9709656306652275
Energy: 0.889078634232518
Energy: 0.9821087929330299
Energy: 0.9487400554479865
Energy: 0.9821087929338724
Energy: 1.015507148332508
Energy: 0.9960704095909607
Energy: 0.9300216135790501
Energy: 0.9960704095926456
Energy: 0.9060145012893581
Energy: 0.9298824214692357
Energy: 0.9699462297482951
Energy: 0.9298824214717633
Energy: 0.891814372205796
Energy: 0.9883839400909068
Energy: 0.8877248308450478
Energy: 0.9883839400909068
Energy: 0.9628501781778726
Energy: 0.9823357814855426
Energy: 0.9039956134988884
Energy: 0.982335781486385
Energy: 0.9087190920251118
Energy: 1.020419206056702
Energy: 1.008668760801264
Energy: 1.020419206056702
Energy: 1.0711026819232348
Energy: 0.9693122942611738
Energy: 0.8876326395273894
Energy: 0.9693122942620163
Energy: 0.8918434324521378
Energy: 0.9827334486722754
Energy: 0.9773558084949584
Energy: 0.9827334486731178
Energy: 0.9043170614513345
Energy: 0.9867939040506564
Energy: 0.9041077473489545
Energy: 0.9867939040481288
Energy: 0.9929529464766214
Energy: 0.981944251114293
Energy: 0.9841097005677346
Energy: 0.9819442511126079
Energy: 0.8874587333365337
Energy: 1.040971292146035
Energy: 0.9880109193134143
Energy: 1.0409712921443501
Energy: 0.968647066102847
Energy: 0.9898572420316184
Energy: 0.9073747038398721
Energy: 0.9898572420299333
Energy: 0.9811580907659185
Energy: 0.9825344628155865
Energy: 0.9628368777302521
Energy: 0.982534462818114
Energy: 0.8879009602207633
Energy: 1.017879951411884
Energy: 1.0809799744803024
Energy: 1.017879951411884
Energy: 0.9744567346955201
Energy: 0.970133370455303
Energy: 0.9059300616690281
Energy: 0.9701333704578305
Energy: 0.9148263338085159
Energy: 1.0214508391612396
Energy: 0.9498610780839695
Energy: 1.0214508391612396
Energy: 0.8882191025625622
Energy: 0.9820857895660381
Energy: 0.8893019142886571
Energy: 0.9820857895685655
Energy: 0.9257061759002992
Energy: 0.9707106016311596
Energy: 0.9741296679323487
Energy: 0.9707106016294748
Energy: 0.8880373929861527
Energy: 1.0247846462449712
Energy: 1.0694276669036968
Energy: 1.0247846462466563
Energy: 0.9941773634297212
Energy: 0.9825543839582191
Energy: 0.8875708251288337
Energy: 0.9825543839556917
Energy: 0.9044127741641066
Energy: 0.9886096794063921
Energy: 0.9902632147193493
Energy: 0.988609679408077
Energy: 0.9044212334810204
Energy: 0.9706393939624819
Energy: 0.9895087296497584
Energy: 0.9706393939650094
Energy: 0.9912315402888129
Energy: 0.9825202582491881
Energy: 0.8885165597819302
Energy: 0.9825202582508731
Energy: 0.8882965369113659
Energy: 1.0231055830239204
Energy: 1.1072064314064598
Energy: 1.023105583024763
Energy: 0.9696151792886678
Energy: 0.9293673576073487
Energy: 0.9751186809098793
Energy: 0.9293673576056636
Energy: 1.060959703343895
Energy: 0.9823821102899433
Energy: 0.8917768814774334
Energy: 0.9823821102899433
Energy: 0.903967370458229
Energy: 1.0205902204053041
Energy: 0.9742543357144966
Energy: 1.020590220403619

minimum gb energy = 0.8873362273783596 eV
minimum distance =  2.21426900130631 Angstroms
sigma value = 53


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

Energy: 0.854756284547556
Energy: 0.8539813991678112
Energy: 1.0487545124507998
Energy: 0.8539813991697508
Energy: 1.0132879263983612
Energy: 0.9186637031987875
Energy: 0.8870551169053073
Energy: 0.918663703200727
Energy: 0.8550650352976986
Energy: 0.8538328498109388
Energy: 0.979181656853457
Energy: 0.8538328498128784
Energy: 0.8552228977537841
Energy: 0.8538254981014922
Energy: 0.9235620412173366
Energy: 0.8538254981034318
Energy: 1.0135165173100293
Energy: 0.91862295750343
Energy: 0.9429811411478135
Energy: 0.9186229575053696
Energy: 0.854756284547556
Energy: 0.8539813991716902
Energy: 1.076161735428594
Energy: 0.8539813991736298
Energy: 1.0132879264003007
Energy: 0.9186637031987875
Energy: 0.9236347968503716
Energy: 0.918663703200727
Energy: 0.8550650352957592
Energy: 0.8538328498109388
Energy: 0.979181656853457
Energy: 0.8538328498109388
Energy: 0.8552228977518446
Energy: 0.8538254981034318
Energy: 0.9618768397262446
Energy: 0.8538254981053713
Energy: 1.013516517311969
Energy: 0.91862295750343
Energy: 0.9784906690258475
Energy: 0.9186229575053696
Energy: 0.854756284547556
Energy: 0.8539813991678112
Energy: 1.0761617363843545
Energy: 0.8539813991697508
Energy: 1.0132879264003007
Energy: 0.9186637031987875
Energy: 0.9618105858223781
Energy: 0.918663703200727
Energy: 0.8550650352996382
Energy: 0.8538328498128784
Energy: 0.9791816568553966
Energy: 0.8538328498128784

minimum gb energy = 0.8538254981014922 eV
minimum distance =  2.28701590310885 Angstroms
sigma value = 9


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

Energy: 0.9472147782548493
Energy: 1.061535452403181
Energy: 1.1364096662976881
Energy: 1.0615354524046168
Energy: 1.0343696681753287
Energy: 0.9797783180974853
Energy: 0.9456160509831767
Energy: 0.9797783180982031
Energy: 0.9179895443599999
Energy: 0.9316184503037328
Energy: 0.9320187634416057
Energy: 0.9316184503044507
Energy: 0.997724468871381
Energy: 1.0959989865619364
Energy: 0.9457217402280772
Energy: 1.095998986563372
Energy: 1.0264146728184
Energy: 0.9838740884619213
Energy: 0.936221577899616
Energy: 0.9838740884626392
Energy: 0.9319856716052736
Energy: 0.9308606241003886
Energy: 0.9915754913988001
Energy: 0.9308606241011065
Energy: 1.159864383502998
Energy: 0.9776428596499573
Energy: 0.9427184551882601
Energy: 0.9776428596463681
Energy: 0.9284563732327066
Energy: 1.0800686845730625
Energy: 1.0132889713078914
Energy: 1.0800686845759337
Energy: 0.9198993040127007
Energy: 1.1109792256977002
Energy: 0.9416858216111296
Energy: 1.1109792256962645
Energy: 0.9191606683825686
Energy: 0.9747723585286145
Energy: 0.9333833242106057
Energy: 0.9747723585293324
Energy: 0.9301479521132302
Energy: 1.1024827299696232
Energy: 1.1235096091529537
Energy: 1.1024827299696232
Energy: 1.0349040261894065
Energy: 1.0750322998396864
Energy: 0.9234447657477657
Energy: 1.0750322998396864
Energy: 0.9201944077277538
Energy: 1.0024743034642958
Energy: 1.0830195822754258
Energy: 1.0024743034642958
Energy: 1.002206692057031
Energy: 1.1141923126379338
Energy: 0.9527953691991267
Energy: 1.1141923126393694
Energy: 0.9310647785451456
Energy: 1.0408441732925495
Energy: 1.0143148699190858
Energy: 1.0408441732939853
Energy: 0.9235887917927035
Energy: 1.111208119629161
Energy: 0.9964787156687418
Energy: 1.1112081196284431
Energy: 0.9751126936717934
Energy: 1.0410256084508533
Energy: 0.930660873224321
Energy: 1.0410256084530067
Energy: 0.933559715991938
Energy: 0.9776602947820042
Energy: 1.0256666332622215
Energy: 0.97766029478344
Energy: 1.0205660432064756
Energy: 1.0030550379284924
Energy: 0.9339161106109639
Energy: 1.00305503792921
Energy: 0.9225059142519189
Energy: 0.9906823485376292
Energy: 0.9915512297967
Energy: 0.9906823485376292
Energy: 1.0053872002985351
Energy: 1.0973282741675665
Energy: 0.9996638887402706
Energy: 1.0973282741639774
Energy: 0.9988034291382255
Energy: 1.025677167208053
Energy: 0.9191559893597582
Energy: 1.0256771672073353
Energy: 0.941830586878589
Energy: 1.0448948723743616
Energy: 0.9199290007181127
Energy: 1.0448948723736438
Energy: 1.0829748435452162
Energy: 0.9942859687143198
Energy: 0.9278755516465819
Energy: 0.9942859687143198
Energy: 0.9432225305797571
Energy: 1.0781330357468664
Energy: 1.1144710559454407
Energy: 1.078133035748302
Energy: 0.9548905826736059
Energy: 0.9314965329287295
Energy: 0.9181442507544982
Energy: 0.9314965329287295
Energy: 0.9856912311630398
Energy: 1.0453705418822186
Energy: 0.9972683471126025
Energy: 1.0453705418815007
Energy: 0.9625547972247633
Energy: 1.095754339267236
Energy: 0.9977410616756809
Energy: 1.0957543392658005
Energy: 0.9672161088261241
Energy: 0.9312999580926303
Energy: 0.9173811102075803
Energy: 0.9312999580919125
Energy: 0.9443191469018455
Energy: 1.078108122532123
Energy: 1.1114969545122626
Energy: 1.0781081225285336
Energy: 1.0935890293619617
Energy: 0.9940563997295393
Energy: 0.9271766123580859
Energy: 0.9940563997281036
Energy: 0.946779199798991
Energy: 0.980708029810087
Energy: 0.9186496723039695
Energy: 0.9807080298122406
Energy: 0.9468389051804051
Energy: 1.0268298635093733
Energy: 0.9181945485152585
Energy: 1.0268298635079376
Energy: 0.9970143737467719
Energy: 1.0971555822112995
Energy: 0.9976951679894742
Energy: 1.0971555822112995
Energy: 0.9330912684580931
Energy: 1.0871833420209391
Energy: 1.1603953172558998
Energy: 1.0871833420223749

minimum gb energy = 0.9173811102075803 eV
minimum distance =  2.23687654889978 Angstroms
sigma value = 73


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

Energy: 0.9393805760614683
Energy: 0.9379972720929997
Energy: 1.1363083333523072
Energy: 0.9379972720929997
Energy: 0.9589671792017661
Energy: 1.0266404627585979
Energy: 0.9502161334481248
Energy: 1.026640462757459
Energy: 0.9389364906841667
Energy: 0.9432575924782248
Energy: 0.9355958000955901
Energy: 0.9432575924782248
Energy: 0.9162841183909862
Energy: 1.0274923914521148
Energy: 0.950812607333489
Energy: 1.027492391450976
Energy: 0.9151242832751284
Energy: 1.004627464969909
Energy: 0.9328233425747301
Energy: 1.0046274649710478
Energy: 0.9406756041022081
Energy: 0.9551771881132878
Energy: 1.0912831033103374
Energy: 0.9551771881132878
Energy: 1.1700275639299824
Energy: 1.1288318213828925
Energy: 0.948309756335759
Energy: 1.1288318213840056
Energy: 0.9164573822450689
Energy: 0.9383102611894534
Energy: 1.120306956306689
Energy: 0.9383102611883144
Energy: 1.1064492718334558
Energy: 0.9396259543915256
Energy: 0.9455967058025433
Energy: 0.9396259543926645
Energy: 0.9392284340645944
Energy: 0.990993860002272
Energy: 0.9390785873734602
Energy: 0.990993860002272
Energy: 0.9141011095138076
Energy: 0.9394090862059463
Energy: 1.102595865373497
Energy: 0.9394090862059463
Energy: 1.0400629764733356
Energy: 1.0249128460956807
Energy: 0.9165716690609774
Energy: 1.0249128460968195
Energy: 0.937310275573157
Energy: 0.9957766009548081
Energy: 1.0358191363036686
Energy: 0.9957766009548081
Energy: 1.1384976475553392
Energy: 0.9968058006786235
Energy: 0.9405605663842056
Energy: 0.9968058006797624
Energy: 0.9250732772303134
Energy: 0.9893057070232192
Energy: 1.0391500519428114
Energy: 0.9893057070448593
Energy: 1.102555257214166
Energy: 0.9385270061069226
Energy: 0.9165089846243003
Energy: 0.9385270061069226
Energy: 0.9485632195390387
Energy: 0.9487028484351292
Energy: 0.9391211149570915
Energy: 0.9487028484351292
Energy: 0.9520687166854999
Energy: 0.9412435119467687
Energy: 0.9393186099993663
Energy: 0.9412435119467687
Energy: 0.9317994738280128
Energy: 0.9379308349467356
Energy: 0.9143806279566846
Energy: 0.9379308349455967
Energy: 0.9500167964593127
Energy: 0.9881301914777568
Energy: 1.1694603925054186
Energy: 0.9881301914800348
Energy: 1.147045797969603
Energy: 0.9431771502744792
Energy: 0.9391712793473772
Energy: 0.9431771502744792
Energy: 0.9511216498096912
Energy: 1.0085642924115497
Energy: 1.037073870134135
Energy: 1.0085642924126887

minimum gb energy = 0.9141011095138076 eV
minimum distance =  2.25214392881526 Angstroms
sigma value = 7


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

Energy: 0.9648337427665167
Energy: 0.9637968974264235
Energy: 1.1472558337151402
Energy: 0.9637968974223968
Energy: 1.1293545942492813
Energy: 1.0090096529865569
Energy: 0.9523707924640786
Energy: 1.0090096529881676
Energy: 0.9303912661868399
Energy: 0.9637479805662161
Energy: 0.9496744762816992
Energy: 0.9637479805718536
Energy: 0.9485290372698887
Energy: 1.0259912577867816
Energy: 0.952118890445224
Energy: 1.0259912577883923
Energy: 0.9307621655646163
Energy: 1.0030306852945614
Energy: 0.9584029143880815
Energy: 1.0030306852921451
Energy: 0.9323560252422466
Energy: 0.9657079494522557
Energy: 1.0926044495995213
Energy: 0.9657079494466183
Energy: 1.05295692318201
Energy: 1.0473961351206071
Energy: 0.9575814021689891
Energy: 1.0473961351206071
Energy: 0.9322905114233258
Energy: 0.9645265622544879
Energy: 1.131982341969252
Energy: 0.9645265622456288
Energy: 1.0493670763766458
Energy: 1.0077430586037923
Energy: 0.9478461732592036
Energy: 1.0077430586037923
Energy: 0.93445329234565
Energy: 1.028619294095273
Energy: 1.0321531012525051
Energy: 1.0286192940984946
Energy: 0.9565110707639294
Energy: 1.089140007698644
Energy: 0.9560511445710047
Energy: 1.0891400077018656
Energy: 0.9774069404935287
Energy: 1.0032693464320095
Energy: 0.9531863502565014
Energy: 1.0032693464336202
Energy: 0.9742921826648272
Energy: 0.9673756316178698
Energy: 0.9552138458255733
Energy: 0.9673756316114268
Energy: 0.9571938913666035
Energy: 0.9522504483955407
Energy: 0.952425570085482
Energy: 0.9522504483874871
Energy: 0.9366496551734641
Energy: 1.0958397837861773
Energy: 1.0544797575362836
Energy: 1.0958397837813452
Energy: 1.1633417625497489
Energy: 0.95141593642618
Energy: 0.9457699544830337
Energy: 0.9514159364173211
Energy: 0.9365638962670404
Energy: 1.0059468735644854
Energy: 1.0520546046254076
Energy: 1.005946873554821
Energy: 0.9519385757454951
Energy: 1.0735445599352396
Energy: 0.9532176705273078
Energy: 1.0735445599360451
Energy: 0.9369271026852484
Energy: 0.9656380157282464
Energy: 0.9555433875013556
Energy: 0.965638015727441
Energy: 0.9349045312269944
Energy: 1.0025000164954192
Energy: 0.9534673588483783
Energy: 1.002500016504278
Energy: 0.9557902934550625
Energy: 1.0898857757938112
Energy: 0.9479799789912575
Energy: 1.089885775795422
Energy: 0.9336335555431975
Energy: 0.964000541613987
Energy: 1.0321959497223514
Energy: 0.9640005416131816
Energy: 1.1186414539804628
Energy: 1.007761080709429
Energy: 0.9520455563953605
Energy: 1.0077610807045967
Energy: 0.9674532458062605
Energy: 0.9647893851592106
Energy: 1.0932989782041806
Energy: 0.9647893851600159
Energy: 0.9724322607720506
Energy: 1.0030528319574046
Energy: 0.9525122909833181
Energy: 1.0030528319493508
Energy: 0.9487929367655448
Energy: 0.9645803013423597
Energy: 0.9615260348932337
Energy: 0.9645803013431652
Energy: 0.9307842399047155
Energy: 1.0285211108900356
Energy: 0.9545378150507557
Energy: 1.0285211108900356
Energy: 0.9481502803745305
Energy: 1.0057167881482398
Energy: 0.9521190491790416
Energy: 1.0057167881466291
Energy: 0.92972421966309
Energy: 0.9641840250627116
Energy: 1.0199737384006418
Energy: 0.9641840250522419
Energy: 0.9659341589241266
Energy: 0.9719591716859667
Energy: 0.952414368296981
Energy: 0.9719591716948256
Energy: 0.9297248307132283
Energy: 0.9642912596480497
Energy: 1.0839840694842742
Energy: 0.9642912596561034

minimum gb energy = 0.92972421966309 eV
minimum distance =  2.24109238579536 Angstroms
sigma value = 29


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

Energy: 0.9432649895835439
Energy: 0.8983351824178889
Energy: 0.9736305108904992
Energy: 0.8983351824165174
Energy: 0.8931174856109426
Energy: 0.9451150511586532
Energy: 0.923560183043097
Energy: 0.9451150511594949
Energy: 0.9074910670170422
Energy: 0.9912329258745892
Energy: 0.9852807036867386
Energy: 0.9912329258737477
Energy: 0.9450055893700966
Energy: 0.892836501995204
Energy: 0.9229294448250684
Energy: 0.892836501994643
Energy: 0.9437193832566024
Energy: 0.948332936026104
Energy: 0.9911289064882592
Energy: 0.9483329360271949
Energy: 0.899029623364686
Energy: 0.9854112903271063
Energy: 0.8990654498922253
Energy: 0.9854112903257659
Energy: 0.9010253325109631
Energy: 0.9482861607324802
Energy: 0.943866766705522
Energy: 0.9482861607332906
Energy: 0.9228863911617036
Energy: 0.8930476480069802
Energy: 0.9446002840871054
Energy: 0.8930476480072608
Energy: 0.9852682683670734
Energy: 0.9912048370440866
Energy: 0.9074678163016431
Energy: 0.9912048370451776

minimum gb energy = 0.892836501994643 eV
minimum distance =  2.28492078800409 Angstroms
sigma value = 5


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

Energy: 0.9254397701220862
Energy: 0.9151745947040676
Energy: 1.0193709513865228
Energy: 0.9151745947086323
Energy: 0.8823230008774174
Energy: 0.9594154945255919
Energy: 0.8618998102568924
Energy: 0.9594154945309173
Energy: 0.8719456732226119
Energy: 0.9037516666729063
Energy: 1.0276945796539079
Energy: 0.9037516666660594
Energy: 0.869294223744135
Energy: 0.9483198486894913
Energy: 0.8963181169356685
Energy: 0.9483198486834051
Energy: 0.8850587852910716
Energy: 0.9570349642447448
Energy: 1.0213124640973912
Energy: 0.9570349642417018
Energy: 0.891627573298163
Energy: 0.919944141485194
Energy: 0.8777192495393059
Energy: 0.9199441414867155
Energy: 0.8851390707545714
Energy: 0.9654762524945331
Energy: 0.8957032012763627
Energy: 0.9654762524922509
Energy: 0.8819906662675495
Energy: 0.9216797030515723
Energy: 0.8704495565919034
Energy: 0.9216797030530939
Energy: 0.9044309212800163
Energy: 0.9543531876263864
Energy: 0.880444729477456
Energy: 0.9543531876324725
Energy: 0.9007601967911362
Energy: 0.9542473236304694
Energy: 0.8701575430941054
Energy: 0.9542473236395985
Energy: 0.8607635146218617
Energy: 0.9205798652920323
Energy: 0.8683201801292373
Energy: 0.92057986528975
Energy: 0.8686911439880448
Energy: 0.9193429382198881
Energy: 1.0157310809069848
Energy: 0.9193429382206489
Energy: 0.8999129197959828
Energy: 0.9184784366832164
Energy: 0.9192973949889129
Energy: 0.9184784366839772
Energy: 0.8852380323310894
Energy: 0.9187214104607601
Energy: 0.9114730794901835
Energy: 0.9187214104584778
Energy: 1.1130201534872601
Energy: 0.9500718711541734
Energy: 0.8677735321374129
Energy: 0.9500718711526519
Energy: 0.8979133133581175
Energy: 0.8981456407308136
Energy: 1.0201745341079727
Energy: 0.8981456407285314
Energy: 1.0240492421458678
Energy: 0.9546282798550586
Energy: 0.8615694972246857
Energy: 0.9546282798573409
Energy: 0.8921307652579867
Energy: 0.9184899655143711
Energy: 0.9566377200503129
Energy: 0.9184899655189357
Energy: 0.8872726909882758
Energy: 0.9662513736609204
Energy: 0.8792613251296423
Energy: 0.9662513736593988
Energy: 0.8683899141410408
Energy: 0.9561885445426079
Energy: 0.9049390624279219
Energy: 0.9561885445388042
Energy: 0.8557300895542784
Energy: 1.0167705236869007
Energy: 0.8976265672388862
Energy: 1.0167705236838576
Energy: 0.8890455100394445
Energy: 0.9564917842049722
Energy: 0.908938241808505
Energy: 0.9564917842049722
Energy: 0.8666819312338927
Energy: 0.9207610529773401
Energy: 0.8579983749701979
Energy: 0.9207610529727757
Energy: 1.0006237842418064
Energy: 0.9259070605482846
Energy: 0.8685175671074099
Energy: 0.9259070605482846
Energy: 0.9984868614761547
Energy: 0.9082684690841724
Energy: 0.8620987586275982
Energy: 0.9082684690864546
Energy: 0.9063869039617909
Energy: 0.9190500934202214
Energy: 0.8854273906483423
Energy: 0.9190500934263074
Energy: 0.8696136131355491
Energy: 0.9382160221736853
Energy: 0.9445682732566909
Energy: 0.9382160221691208
Energy: 0.894532806032339
Energy: 0.9545625839809376
Energy: 0.896463749930214
Energy: 0.9545625839763731
Energy: 0.8695452224035399
Energy: 0.9566738919202358
Energy: 0.9586641168190928
Energy: 0.9566738919217573
Energy: 1.0276501450860642
Energy: 0.9181958645535813
Energy: 0.8911471726284464
Energy: 0.918195864557385
Energy: 0.8743759230534326
Energy: 0.9050922721284708
Energy: 0.9542425369457164
Energy: 0.905092272130753
Energy: 1.0219726437853092
Energy: 0.9328259552316653
Energy: 0.8685649750035186
Energy: 0.9328259552263747
Energy: 0.895822350530807
Energy: 1.0181147503376733
Energy: 0.8575193398335842
Energy: 1.0181147503315873

minimum gb energy = 0.8557300895542784 eV
minimum distance =  2.25065846532498 Angstroms
sigma value = 1


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

Energy: 0.8803322378801387
Energy: 0.8795358782197108
Energy: 0.8530230867300495
Energy: 0.879535878218659
Energy: 0.8812539423932338
Energy: 0.893878963263298
Energy: 0.8378194850966743
Energy: 0.893878963263298
Energy: 0.8166054191323007
Energy: 0.8799657825335945
Energy: 1.1146862641755424
Energy: 0.8799657825335945
Energy: 0.8442109270299878
Energy: 0.9279451890618285
Energy: 0.8366411212638801
Energy: 0.9279451890597248
Energy: 0.8159958090792319
Energy: 0.9652228987722571
Energy: 1.0024532279937022
Energy: 0.9652228987712052
Energy: 0.815466942883741
Energy: 0.8823411170244679
Energy: 0.8368450432790864
Energy: 0.8823411170234161
Energy: 0.8159897044029449
Energy: 0.9643396208708468
Energy: 0.8504154593974237
Energy: 0.9643396208676911
Energy: 0.8166148780772075
Energy: 0.8824686857756151
Energy: 0.8720617712745019
Energy: 0.8824686857745633
Energy: 0.8791272113564005
Energy: 0.8807408149252282
Energy: 0.8764151201936328
Energy: 0.8807408149241762
Energy: 0.8791328239939744
Energy: 0.8806813813910935
Energy: 0.8715877124133989
Energy: 0.8806813813879381
Energy: 0.8166165752765178
Energy: 0.8823998970313989
Energy: 0.8765200117219982
Energy: 0.882399897030347
Energy: 0.8161783376847557
Energy: 0.9643210830314295
Energy: 0.852291238490772
Energy: 0.9643210830335333
Energy: 0.8155070461164821
Energy: 0.8825275408728588
Energy: 0.8368294934165725
Energy: 0.8825275408739106
Energy: 0.8160504728347593
Energy: 0.9651622887356879
Energy: 0.982073242354425
Energy: 0.9651622887325323
Energy: 0.8436855126030651
Energy: 0.9279655367375911
Energy: 0.8366191496033687
Energy: 0.9279655367375911
Energy: 0.8166039611108263
Energy: 0.8797483480951581
Energy: 0.9032311612529887
Energy: 0.87974834809621
Energy: 0.8811711617755467
Energy: 0.8937751075509643
Energy: 0.8377081247031174
Energy: 0.8937751075520162
Energy: 0.8803322378811905
Energy: 0.8795358782197108
Energy: 0.9894395366018531
Energy: 0.879535878218659
Energy: 0.88125394239113
Energy: 0.893878963263298
Energy: 0.8378194850966743
Energy: 0.893878963263298
Energy: 0.8166054191344043
Energy: 0.8799657825335945
Energy: 1.1146862641755424
Energy: 0.8799657825335945
Energy: 0.844210927028936
Energy: 0.9279451890618285
Energy: 0.8366411212638801
Energy: 0.9279451890597248
Energy: 0.8159958090802837
Energy: 0.9652228987722571
Energy: 1.0024532279937022
Energy: 0.9652228987712052
Energy: 0.8154669428826891
Energy: 0.8823411170244679
Energy: 0.8368450432790864
Energy: 0.8823411170234161
Energy: 0.815989704401893
Energy: 0.9643396208708468
Energy: 0.8504154593963719
Energy: 0.9643396208676911

minimum gb energy = 0.8154669428826891 eV
minimum distance =  2.26563496873526 Angstroms
sigma value = 17


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

Energy: 0.8722965089935917
Energy: 0.8717068365427671
Energy: 0.9807416372229885
Energy: 0.8717068365453676
Energy: 0.9757183138287293
Energy: 0.859013814895213
Energy: 0.8341824603743743
Energy: 0.8590138148958631
Energy: 0.8316818856196885
Energy: 0.8558212387698381
Energy: 1.0262891528879565
Energy: 0.8558212387704882
Energy: 0.8598792630786171
Energy: 0.8313062965057237
Energy: 0.8270466689615567
Energy: 0.8313062965057237
Energy: 0.8210132885034417
Energy: 0.9253483290934281
Energy: 0.8475453340491277
Energy: 0.925348329097329
Energy: 0.8148649566387165
Energy: 0.8441291019033174
Energy: 0.8458125520436551
Energy: 0.8441291019026672
Energy: 0.834942233992357
Energy: 0.9054997134941012
Energy: 0.8906617675152063
Energy: 0.9054997134889
Energy: 0.8186685518309458
Energy: 0.8936565025751134
Energy: 0.816901365636459
Energy: 0.8936565025705625
Energy: 0.8695430821360974
Energy: 1.0059793489802107
Energy: 0.8663040318580897
Energy: 1.0059793489782602
Energy: 0.866765567163926
Energy: 0.8971613461952561
Energy: 0.8349399423523307
Energy: 0.8971613461959062
Energy: 0.8317603089457662
Energy: 0.8725219123322165
Energy: 0.8168483530064825
Energy: 0.872521912329616
Energy: 0.8346461654714344
Energy: 0.9001881792853835
Energy: 0.8244360691253477
Energy: 0.9001881792860337
Energy: 0.8129158334601937
Energy: 0.887895721792133
Energy: 0.8273287302157509
Energy: 0.8878957217914829
Energy: 0.8216284670213575
Energy: 0.9243362883223059
Energy: 0.8717525168041813
Energy: 0.9243362883242563
Energy: 0.8173774464937711
Energy: 0.8353295621577161
Energy: 0.878694628203239
Energy: 0.835329562156416
Energy: 0.8315913785243112
Energy: 0.8570836281419374
Energy: 0.8483412924203887
Energy: 0.8570836281445381
Energy: 0.836850693563523
Energy: 0.8368575286368256
Energy: 0.8271913449123686
Energy: 0.8368575286348752
Energy: 0.8274846595735756
Energy: 0.8719742829885837
Energy: 0.8311999171949166
Energy: 0.8719742829866334
Energy: 0.959026961908626
Energy: 0.9022652679916342
Energy: 0.8338073450325691
Energy: 0.9022652679916342
Energy: 0.8448840659626878
Energy: 0.8557838806155043
Energy: 0.8673338264201034
Energy: 0.8557838806207052
Energy: 0.8319562884244112
Energy: 0.8490446103960347
Energy: 0.8289246353772599
Energy: 0.8490446103908335
Energy: 0.8281153451280201
Energy: 0.8722426619514829
Energy: 0.9372727504202872
Energy: 0.8722426619527832
Energy: 0.8484820036889144
Energy: 0.8421377471541299
Energy: 0.8458777058294434
Energy: 0.8421377471547801
Energy: 0.8321199371689936
Energy: 0.9071408837187114
Energy: 0.9767174260350205
Energy: 0.9071408837154606
Energy: 0.8445868721525491
Energy: 0.8724851472137077
Energy: 0.8279732546706634
Energy: 0.8724851472169585
Energy: 0.8269899275401856
Energy: 0.9265663987937157
Energy: 0.8369726990759392
Energy: 0.9265663987950161
Energy: 0.9625458621539522
Energy: 0.8874948220554665
Energy: 0.8328259643146203
Energy: 0.8874948220561166
Energy: 0.8821572121626733
Energy: 0.985937151980957
Energy: 0.8167897112243032
Energy: 0.9859371519816071
Energy: 0.885978451586131
Energy: 0.9241878046939619
Energy: 0.8225807316088288
Energy: 0.9241878046920116
Energy: 0.8268594223628556
Energy: 0.8868511773528573
Energy: 0.8484209474265595
Energy: 0.8868511773580584
Energy: 0.8279916468590057
Energy: 0.9240844226037028
Energy: 0.8389828704555434
Energy: 0.9240844226063032
Energy: 0.8162096512654136
Energy: 0.8703453249191238
Energy: 0.8295308843835668
Energy: 0.8703453249269254
Energy: 0.8328619041821904
Energy: 0.8975621294471955
Energy: 0.9893756391823874
Energy: 0.8975621294497961
Energy: 0.8635511370555753
Energy: 1.004840783927493
Energy: 0.8464604342561883
Energy: 1.0048407839261928
Energy: 0.8221745702276056
Energy: 0.8728868253341976
Energy: 0.8571177676627589
Energy: 0.872886825331597
Energy: 0.8957214411945085
Energy: 0.9067867255183316
Energy: 0.8340935956081902
Energy: 0.9067867255183316
Energy: 0.8458419601695769
Energy: 0.8494992950335222
Energy: 0.815833086457332
Energy: 0.849499295042565
Energy: 0.8390078085298205
Energy: 0.92655382721743
Energy: 0.8283039063672661
Energy: 0.9265538272193803

minimum gb energy = 0.8129158334601937 eV
minimum distance =  2.25104538117829 Angstroms
sigma value = 89


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

Energy: 0.9577159732678631
Energy: 0.7967725534571374
Energy: 0.9133496506257625
Energy: 0.7967725534571374
Energy: 0.9273519775946847
Energy: 0.7968901936127294
Energy: 0.7847800105734309
Energy: 0.7968901936127294
Energy: 0.8024595118306803
Energy: 0.92662235184353
Energy: 1.09243002848307
Energy: 0.92662235184353
Energy: 0.8029396653691806
Energy: 0.8408205912759098
Energy: 0.8031612017224274
Energy: 0.8408205912759098
Energy: 0.7692051691260507
Energy: 0.8419537509983647
Energy: 0.8151202225271077
Energy: 0.8419537509983647
Energy: 0.7704545261484291
Energy: 0.7693559946031622
Energy: 0.7726372191324689
Energy: 0.7693559946048634
Energy: 0.78544529535212
Energy: 0.9300772913819018
Energy: 0.7801639845067024
Energy: 0.9300772913819018
Energy: 0.76899778183399
Energy: 0.9260972266834434
Energy: 0.8025826751054246
Energy: 0.9260972266800412
Energy: 0.7976068648199335
Energy: 0.8418287825283981
Energy: 0.8866315872722177
Energy: 0.841828782526697
Energy: 0.8405585758246235
Energy: 0.8391620493814337
Energy: 0.7712710305075631
Energy: 0.8391620493814337
Energy: 0.9502807518455679
Energy: 0.8055164140273188
Energy: 0.7692626906018997
Energy: 0.8055164140290199
Energy: 0.9337958348569299
Energy: 0.9273194673475884
Energy: 0.7775027525138539
Energy: 0.9273194673475884
Energy: 0.7976801146320611
Energy: 0.770891380947103
Energy: 0.764818592006663
Energy: 0.770891380947103
Energy: 0.7970791234171238
Energy: 0.8401400068081224
Energy: 0.7971659287992038
Energy: 0.8401400068081224
Energy: 0.7569822727397316
Energy: 0.7709045117088017
Energy: 0.7981452996540538
Energy: 0.7709045117105027

minimum gb energy = 0.7569822727397316 eV
minimum distance =  2.27675109485911 Angstroms
sigma value = 13


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

Energy: 0.7733124722683613
Energy: 0.7366624344754649
Energy: 0.9045836821648386
Energy: 0.7366624344733259
Energy: 0.8772748715200361
Energy: 0.7606950387447855
Energy: 0.7272712944949516
Energy: 0.7606950387355167
Energy: 0.7378596636824013
Energy: 0.7369962144625611
Energy: 0.8830975402998364
Energy: 0.7369962144554313
Energy: 0.7408837381359482
Energy: 0.7608587273008388
Energy: 0.7230246798967764
Energy: 0.7608587273029778
Energy: 0.7463648859234007
Energy: 0.7931550712388782
Energy: 0.7409716558909366
Energy: 0.7931550712431561
Energy: 0.7285275956453867
Energy: 0.7615470034602103
Energy: 0.7497560074882789
Energy: 0.7615470034545063
Energy: 0.7459614054994267
Energy: 0.7960178170435355
Energy: 0.8580975514078931
Energy: 0.7960178170314145
Energy: 0.7127630647429345
Energy: 0.7610990049333352
Energy: 0.7498488751340677
Energy: 0.7610990049269183
Energy: 0.7466764250897169
Energy: 0.7957318825496017
Energy: 0.8666223607018774
Energy: 0.7957318825510277
Energy: 0.8728680243498672
Energy: 0.8149366148779762
Energy: 0.7232009457485945
Energy: 0.814936614879402
Energy: 0.7460512117266501
Energy: 0.8160084161303263
Energy: 0.7240455423427916
Energy: 0.8160084161360303
Energy: 0.7573681249420194
Energy: 0.8150444051657766
Energy: 0.7227572574812552
Energy: 0.8150444051629246
Energy: 0.7818415559179079
Energy: 0.754659169278302
Energy: 0.7251934050007188
Energy: 0.7546591692697461
Energy: 0.9702265804216996
Energy: 0.8151964578480879
Energy: 0.7230436901204716
Energy: 0.815196457850227
Energy: 0.7378772846139594
Energy: 0.7367486351454671
Energy: 0.725673485503494
Energy: 0.7367486351390502
Energy: 0.756856680556615
Energy: 0.8154986369786313
Energy: 0.7263990540067272
Energy: 0.8154986369772053
Energy: 0.7451690653405578
Energy: 0.7358006886665954
Energy: 0.7268193919837489
Energy: 0.7358006886765772
Energy: 0.7461352428865498
Energy: 0.7931415677011464
Energy: 0.7580805420822765
Energy: 0.7931415676961553
Energy: 0.7452528371640239
Energy: 0.7544977529754077
Energy: 0.7581470778427502
Energy: 0.7544977529732687
Energy: 0.745218961140171
Energy: 0.7540506024042143
Energy: 0.7581510464370788
Energy: 0.7540506024134832
Energy: 0.7461730929909699
Energy: 0.793107689952623
Energy: 0.7582511285619348
Energy: 0.7931076899611792
Energy: 0.7451393879964521
Energy: 0.7358668732660627
Energy: 0.7269728829676697
Energy: 0.7358668732803226
Energy: 0.757101595667924
Energy: 0.8154616325971162
Energy: 0.7266634177417791
Energy: 0.8154616325978292
Energy: 0.7376820958857333
Energy: 0.7368318382414721
Energy: 0.7266020770610953
Energy: 0.7368318382379072
Energy: 0.9705103394150103
Energy: 0.8151773640828145
Energy: 0.7229001508701551
Energy: 0.8151773640899446
Energy: 0.7818882197057894
Energy: 0.7547091130882873
Energy: 0.724481160475618
Energy: 0.7547091130875743
Energy: 0.7568563771916283
Energy: 0.8149515510814799
Energy: 0.7227706928022027
Energy: 0.8149515510772017
Energy: 0.7459767971794713
Energy: 0.8160301633071564
Energy: 0.7251729556167734
Energy: 0.8160301633021655
Energy: 0.8730005570807887
Energy: 0.8148106001445118
Energy: 0.7232077506855095
Energy: 0.8148106001416598
Energy: 0.7463439793745417
Energy: 0.7957156398216154
Energy: 0.8524105304309839
Energy: 0.7957156398144853
Energy: 0.7130071598398053
Energy: 0.7612971069527242
Energy: 0.7497746391434986
Energy: 0.7612971069520112
Energy: 0.7457747208607551
Energy: 0.7958364674798274
Energy: 0.9722038735554376
Energy: 0.7958364674912353
Energy: 0.7288637618842344
Energy: 0.7614738917080309
Energy: 0.7497902936422453
Energy: 0.761473891705892
Energy: 0.7463337431994902
Energy: 0.7930842906641112
Energy: 0.7437696702099513
Energy: 0.7930842906691022
Energy: 0.7422773479497957
Energy: 0.760841709690165
Energy: 0.7230529363043994
Energy: 0.7608417096844611

minimum gb energy = 0.7127630647429345 eV
minimum distance =  2.28978781606278 Angstroms
sigma value = 37


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

Energy: 0.7141623014839372
Energy: 0.7136631983829261
Energy: 0.8566245305473169
Energy: 0.7136631983829261
Energy: 0.6970074994411535
Energy: 0.7133180420988957
Energy: 0.6685767268818702
Energy: 0.7133180420988957
Energy: 0.6782864666940606
Energy: 0.8040101641101148
Energy: 0.6538599602557227
Energy: 0.8040101641101148
Energy: 0.6624719295507232
Energy: 0.7133549325153316
Energy: 0.6685313602732267
Energy: 0.7133549325153316
Energy: 0.667205124792154
Energy: 0.7131872359439102
Energy: 0.6623891173386984
Energy: 0.7131872359451369
Energy: 0.6534112335622863
Energy: 0.7133213227333799
Energy: 0.6641359469219897
Energy: 0.7133213227346067
Energy: 0.6964076489077351
Energy: 0.7562350772726663
Energy: 0.8832403126410352
Energy: 0.7562350772714396
Energy: 0.662311387896782
Energy: 0.7138511735242902
Energy: 0.7165154218877281
Energy: 0.7138511735230635
Energy: 0.667415188737759
Energy: 0.7133010627002107
Energy: 0.8822017764376271
Energy: 0.7133010627002107
Energy: 0.9480140030559914
Energy: 0.7913190858855531
Energy: 0.6642575856417542
Energy: 0.7913190858855531
Energy: 0.6963024635768735
Energy: 0.7561398305618164
Energy: 0.6633007714709204
Energy: 0.7561398305642698
Energy: 0.938255368297861
Energy: 0.7135324688812305
Energy: 0.6682943372639076
Energy: 0.7135324688824294
Energy: 0.6616241720596042
Energy: 0.7133580792419768
Energy: 0.6535390251254624
Energy: 0.7133580792432036
Energy: 0.8895816144266074
Energy: 0.8306595331276015
Energy: 0.6630862840572841
Energy: 0.8306595331288283
Energy: 0.7131465341417424
Energy: 0.7565378709607511
Energy: 0.6641290395459849
Energy: 0.7565378709607511
Energy: 0.7135413615657479
Energy: 0.7143027006938414
Energy: 0.6684868263610988
Energy: 0.7143027006938414
Energy: 0.6616826578833227
Energy: 0.7920916099754075
Energy: 0.6585039778132082
Energy: 0.7920916099741807
Energy: 0.6626663724765562
Energy: 0.7566490677391763
Energy: 0.6624525739787203
Energy: 0.7566490677404029
Energy: 0.6686162750298066
Energy: 0.714565173744566
Energy: 0.6621781217876568
Energy: 0.714565173744566
Energy: 0.6624157288337829
Energy: 0.7139328296298043
Energy: 0.6616425597373949
Energy: 0.7139328296298043

minimum gb energy = 0.6534112335622863 eV
minimum distance =  2.29828878241732 Angstroms
sigma value = 25


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

Energy: 0.6645304502703816
Energy: 0.6184531901910078
Energy: 0.5880683752048065
Energy: 0.61845319019005
Energy: 0.7994437206193473
Energy: 0.6380681255470054
Energy: 0.6218969094011829
Energy: 0.6380681255479633
Energy: 0.61606627231492
Energy: 0.6157127605211195
Energy: 0.5855422717026736
Energy: 0.6157127605201616
Energy: 0.6188346536126857
Energy: 0.6383181050970147
Energy: 0.6220355912709413
Energy: 0.6383181050960569
Energy: 0.620783234164863
Energy: 0.6381042077852661
Energy: 0.5927145297649847
Energy: 0.6381042077833504
Energy: 0.5899165619068623
Energy: 0.6390190647232059
Energy: 0.6218407081693075
Energy: 0.6390190647232059
Energy: 0.6212394310677294
Energy: 0.615946502842611
Energy: 0.6193272204800654
Energy: 0.6159465028416531
Energy: 0.5856427298736963
Energy: 0.6637378618040726
Energy: 0.6171482932449646
Energy: 0.6637378618031146
Energy: 0.6207755736442035
Energy: 0.6381676848636441
Energy: 0.8004665888553544
Energy: 0.6381676848655596
Energy: 0.5898361759329437
Energy: 0.6163469807416954
Energy: 0.6653279229420883
Energy: 0.6163469807416954
Energy: 0.6214194506901957
Energy: 0.6158860672499684
Energy: 0.9484281812477355
Energy: 0.6158860672499684
Energy: 0.8264158821702243
Energy: 0.6666263446526652
Energy: 0.6173626043604402
Energy: 0.6666263446536231
Energy: 0.620809690918976
Energy: 0.6385405139379837
Energy: 0.7684397732292791
Energy: 0.638540513936068
Energy: 0.8285707966405621
Energy: 0.6159404772846914
Energy: 0.6221344297122822
Energy: 0.6159404772837335
Energy: 0.6214329820136749
Energy: 0.61580771254991
Energy: 0.5900762057753717
Energy: 0.6158077125517822
Energy: 0.8170472634779045
Energy: 0.7283335426116391
Energy: 0.6198132938869869
Energy: 0.7283335426116391
Energy: 0.6207320591019726
Energy: 0.6635486392456167
Energy: 0.5854742807234813
Energy: 0.6635486392446587
Energy: 0.8031711676471678
Energy: 0.6378662968293344
Energy: 0.6220868813144117
Energy: 0.6378662968312501
Energy: 0.6687977001337256
Energy: 0.6158821055030452
Energy: 0.5899837863698398
Energy: 0.6158821055020874
Energy: 0.9484044453062579
Energy: 0.7283714454379926
Energy: 0.6203423524025647
Energy: 0.7283714454360768
Energy: 0.6206692335332359
Energy: 0.6637573718611823
Energy: 0.5847212078476443
Energy: 0.6637573718650138
Energy: 0.6186312875964982
Energy: 0.6383541822157621
Energy: 0.622004510405539
Energy: 0.6383541822148042
Energy: 0.6214700644795363
Energy: 0.6158279728693827
Energy: 0.8326401275923164
Energy: 0.6158279728712986
Energy: 0.5925382403178694
Energy: 0.7283318096688374
Energy: 0.6200668422431388
Energy: 0.7283318096688374
Energy: 0.6173154887937297
Energy: 0.7263301775409309
Energy: 0.8149982132692165
Energy: 0.7263301775399731
Energy: 0.5895315022679497
Energy: 0.6638256818810316
Energy: 0.6155626811392599
Energy: 0.6638256818829474

minimum gb energy = 0.5847212078476443 eV
minimum distance =  2.30478858478061 Angstroms
sigma value = 41


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

Energy: 0.9529450846926477
Energy: 0.5927262921982526
Energy: 0.5392669423559908
Energy: 0.5927262922076763
Energy: 0.9267466511857768
Energy: 0.5667207744378006
Energy: 0.554364611617761
Energy: 0.5667207744346594
Energy: 0.658679319484787
Energy: 0.5615911870473893
Energy: 0.55981899212898
Energy: 0.561591187044248
Energy: 0.7750629847595472
Energy: 0.5734498716665023
Energy: 0.5546646655946658
Energy: 0.5734498716672877
Energy: 0.6296863989992294
Energy: 0.5980229095955837
Energy: 0.562336100624896
Energy: 0.5980229095924425
Energy: 0.6370053564313775
Energy: 0.5648125010675599
Energy: 0.5623412375171613
Energy: 0.5648125010714508
Energy: 0.560877767131389
Energy: 0.56418569404639
Energy: 0.6367876505436615
Energy: 0.5641856940456047
Energy: 0.6101916349890794
Energy: 0.5821475401822079
Energy: 0.6299656183141121
Energy: 0.5821475401790668
Energy: 0.5564531222366431
Energy: 0.5800641506023483
Energy: 0.8432072719930814
Energy: 0.5800641506031337
Energy: 0.543479743944206
Energy: 0.5598614314838912
Energy: 0.6590845919775438
Energy: 0.5598614314823206
Energy: 0.5536396215036482
Energy: 0.5667649389487642
Energy: 1.0364808673773938
Energy: 0.5667649389503348
Energy: 0.5357351410268818
Energy: 0.5803155264626193
Energy: 0.8632523536120473
Energy: 0.5803155264579075
Energy: 0.5564427090768786
Energy: 0.5823964855004929
Energy: 1.0287506539777944
Energy: 0.582396485498137
Energy: 0.7387309308296299
Energy: 0.6342691756223943
Energy: 0.6590868236018002
Energy: 0.6342691756223943
Energy: 0.5552916338966465
Energy: 0.5732539778163184
Energy: 0.9004062163327966
Energy: 0.5732539778139625
Energy: 0.7422576129491881
Energy: 0.5810872450256865
Energy: 0.6300277531633494
Energy: 0.5810872450327541
Energy: 0.5650019192382054
Energy: 0.5789385931983867
Energy: 0.832086180941044
Energy: 0.578938593188963
Energy: 0.8130861722470835
Energy: 0.6345876827546842
Energy: 0.562319045778148
Energy: 0.6345876827523284
Energy: 0.6312019688324008
Energy: 0.5787509908472593
Energy: 0.6104611907171951
Energy: 0.5787509908417622
Energy: 0.8236108850394825
Energy: 0.5810241309162466
Energy: 0.5596753918780608
Energy: 0.5810241309178173
Energy: 0.6603578862795357
Energy: 0.5788747133545464
Energy: 0.610208999951924
Energy: 0.5788747133552961
Energy: 1.035557490672862
Energy: 0.5976217341596125
Energy: 0.5545036930339596
Energy: 0.5976217341596125
Energy: 0.929769250865585
Energy: 0.5903568755181999
Energy: 0.5357933570244335
Energy: 0.5903568755205559
Energy: 0.9253781096798682
Energy: 0.5823180892836445
Energy: 0.5560522500216966
Energy: 0.582318089282074
Energy: 0.6603481325257932
Energy: 0.6320040010630992
Energy: 0.5363111853926837
Energy: 0.6320040010670256
Energy: 0.906646567705874
Energy: 0.6099619120150229
Energy: 0.5575322345407131
Energy: 0.6099619120126669
Energy: 0.6313496597855012
Energy: 0.5793292811825278
Energy: 0.7503880064760226
Energy: 0.5793292811817424
Energy: 0.6279919486002928
Energy: 0.5807580799776664
Energy: 0.5648547440946367
Energy: 0.5807580799784519
Energy: 0.565102508309448
Energy: 0.6322719454736481
Energy: 0.8100511806456224
Energy: 0.6322719454752187
Energy: 0.6102759587703338
Energy: 0.61970012501486
Energy: 0.6336599945411205
Energy: 0.6197001250164306
Energy: 0.5587562493321668
Energy: 0.5789323412466711
Energy: 0.8186415727162152
Energy: 0.5789323412482417
Energy: 0.5463549860413456
Energy: 0.5786829078489557
Energy: 0.6631679229370185
Energy: 0.5786829077932348

minimum gb energy = 0.5357351410268818 eV
minimum distance =  2.29483088465243 Angstroms
sigma value = 15


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

Energy: 0.7864713044716993
Energy: 0.5248666139459096
Energy: 0.6737079877691884
Energy: 0.5248666139432486
Energy: 0.8821642235053191
Energy: 0.5220679201784356
Energy: 0.5231095029151807
Energy: 0.5220679201904103
Energy: 0.5457763845357368
Energy: 0.5218505358458955
Energy: 0.4936494084027837
Energy: 0.5218505358465608
Energy: 0.7738779457336132
Energy: 0.5225440056749381
Energy: 0.523094486863534
Energy: 0.5225440056756033
Energy: 0.5207377126610732
Energy: 0.5251128972081195
Energy: 0.4976022165562403
Energy: 0.5251128972041279
Energy: 0.6456036485016264
Energy: 0.5219100892422376
Energy: 0.523193888225662
Energy: 0.5219100892435681
Energy: 0.5226125822038895
Energy: 0.5335805417138181
Energy: 0.5169203013567225
Energy: 0.5335805417111571
Energy: 0.6209931134301988
Energy: 0.5337637887803001
Energy: 0.5230541506789077
Energy: 0.5337637887783042
Energy: 0.5244061719932434
Energy: 0.5347690132982825
Energy: 0.7052474936727495
Energy: 0.534769013296952
Energy: 0.4993290385436726
Energy: 0.5220819696419743
Energy: 0.5212193984175153
Energy: 0.5220819696399784
Energy: 0.5224818106691052
Energy: 0.5231440707102171
Energy: 0.7751623163100095
Energy: 0.5231440707122129
Energy: 0.5114418747616641
Energy: 0.5220447799504419
Energy: 0.5464719707447054
Energy: 0.5220447799491112
Energy: 0.5244799874464333
Energy: 0.5346336700758578
Energy: 0.979369935486122
Energy: 0.5346336700725316
Energy: 0.49693589976532265
Energy: 0.5217589391600446
Energy: 0.7849986526545691
Energy: 0.5217589391587141
Energy: 0.5227214770125345
Energy: 0.5221186545836817
Energy: 0.980817144278405
Energy: 0.5221186545830164
Energy: 0.6733316656422487
Energy: 0.5221304362941528
Energy: 0.546466144294158
Energy: 0.5221304362948179
Energy: 0.5244946725007634
Energy: 0.5338018189615689
Energy: 0.8711312378797086
Energy: 0.5338018189602383
Energy: 0.6674457483380077
Energy: 0.5214032144410785
Energy: 0.5212045332442365
Energy: 0.5214032144404132
Energy: 0.5226135356648582
Energy: 0.5212738838665919
Energy: 0.7472804239156051
Energy: 0.5212738838659265
Energy: 0.6728493971115274
Energy: 0.5224653333171257
Energy: 0.5231912949765142
Energy: 0.5224653333157953
Energy: 0.5243212000442157
Energy: 0.5464066977161574
Energy: 0.6214303610298482
Energy: 0.5464066977208142
Energy: 0.6803546018594917
Energy: 0.5331959696766024
Energy: 0.5266856851506496
Energy: 0.533195969677933
Energy: 0.5225638184091748
Energy: 0.5217454200875395
Energy: 0.4943944725984951
Energy: 0.5217454200842131
Energy: 0.9081272068782035
Energy: 0.523025052995201
Energy: 0.5232851570780634
Energy: 0.523025052995201
Energy: 0.547759832416733
Energy: 0.5467146558689305
Energy: 0.4945158429361596
Energy: 0.5467146558769136
Energy: 0.8852647364293599
Energy: 0.5333703762262743
Energy: 0.5267171492851491
Energy: 0.5333703762236133
Energy: 0.7839586371606501
Energy: 0.5215378773118009
Energy: 0.49523921628863465
Energy: 0.5215378773131314
Energy: 0.9795242526314432
Energy: 0.5232326955180254
Energy: 0.5232184545898508
Energy: 0.5232326954369239
Energy: 0.5478185626404213
Energy: 0.5465584696861274
Energy: 0.4958844139667551
Energy: 0.5465584697273738
Energy: 0.7745907227936882
Energy: 0.5334657904985856
Energy: 0.5267672955097706
Energy: 0.5334657904979203
Energy: 0.5226416469197922
Energy: 0.5212836416508302
Energy: 0.6829408258215975
Energy: 0.521283641652826
Energy: 0.7595140762334129
Energy: 0.5211692748530011
Energy: 0.5232983495088459
Energy: 0.5211692748530011
Energy: 0.5246000006177121
Energy: 0.5477745563191819
Energy: 0.6724516320104414
Energy: 0.5477745563151905
Energy: 0.5169973161174023
Energy: 0.5463063056210088
Energy: 0.5267339337162658
Energy: 0.5463063056230045
Energy: 0.5166277160705367
Energy: 0.5236443885187071
Energy: 0.6770308692991722
Energy: 0.5236443884562328
Energy: 0.5048901385917663
Energy: 0.5212398135275037
Energy: 0.5250331255035229
Energy: 0.5212398135314953
Energy: 0.5243432344060953
Energy: 0.5909048163817778
Energy: 0.9069516245141874
Energy: 0.5909048163857694

minimum gb energy = 0.4936494084027837 eV
minimum distance =  2.29681494309765 Angstroms
sigma value = 85


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

Energy: 0.7485320092970502
Energy: 0.5194320550596674
Energy: 0.5357715412209297
Energy: 0.5194320550596674
Energy: 0.9072360143017469
Energy: 0.5152342252986316
Energy: 0.4839099624478062
Energy: 0.5152342252986316
Energy: 0.713570519765693
Energy: 0.5151354588587351
Energy: 0.44325149043045564
Energy: 0.5151354588581581
Energy: 0.8115585755797138
Energy: 0.5152094394720758
Energy: 0.48398385462062676
Energy: 0.5152094394732297
Energy: 0.5143603293840254
Energy: 0.48235902769304184
Energy: 0.4462669848049856
Energy: 0.4823590276918879
Energy: 0.7717435627857648
Energy: 0.5155374848015727
Energy: 0.4839617205656693
Energy: 0.5155374848004187
Energy: 0.4814593108928064
Energy: 0.5347352170090851
Energy: 0.485052773346165
Energy: 0.5347352170079311
Energy: 0.6695095520488317
Energy: 0.5144477347065756
Energy: 0.48376163057593685
Energy: 0.5144477347059986
Energy: 0.4832925110145447
Energy: 0.4978180795391891
Energy: 0.5997545376962916
Energy: 0.4978180795391891
Energy: 0.5568393568525102
Energy: 0.5342787341602553
Energy: 0.4820093437904264
Energy: 0.5342787341608323
Energy: 0.48530204273592864
Energy: 0.515237225491281
Energy: 0.7160439840343873
Energy: 0.515237225490704
Energy: 0.44630603719855005
Energy: 0.514314341430075
Energy: 0.5148237701391213
Energy: 0.514314341430075
Energy: 0.48341011343835694
Energy: 0.4969365002319324
Energy: 0.8111140077040698
Energy: 0.4969365002307784
Energy: 0.44324184696038593
Energy: 0.5153236239884635
Energy: 0.7133262557400205
Energy: 0.5153236239884635
Energy: 0.48537176180541597
Energy: 0.5153072603834713
Energy: 0.9710040919491222
Energy: 0.5153072603852022
Energy: 0.4476000856027081
Energy: 0.5191537786280288
Energy: 0.7484068351113239
Energy: 0.5191537786286058
Energy: 0.483492996720988
Energy: 0.4969444844632927
Energy: 0.9711677273969889
Energy: 0.4969444844644467
Energy: 0.5894444358632491
Energy: 0.5152349311941524
Energy: 0.7132271626810938
Energy: 0.5152349311935753
Energy: 0.485127589586043
Energy: 0.5153391404534271
Energy: 0.8703595057586349
Energy: 0.5153391404540041
Energy: 0.5967807358658781
Energy: 0.5188889227364497
Energy: 0.5149399330151938
Energy: 0.5188889227329877
Energy: 0.48354030092075023
Energy: 0.4970357735417177
Energy: 0.7704342547424395
Energy: 0.4970357735399868
Energy: 0.5934053563619707
Energy: 0.5154677367440262
Energy: 0.4819279632245027
Energy: 0.5154677367434494
Energy: 0.48498444746451985
Energy: 0.514136308307265
Energy: 0.669081061832274
Energy: 0.514136308306111
Energy: 0.6046909757465319
Energy: 0.5367890537814756
Energy: 0.4837881623774708
Energy: 0.5367890537803216
Energy: 0.4834302280176183
Energy: 0.5141057208765061
Energy: 0.5569123982196225
Energy: 0.5141057208759292
Energy: 0.8118622032910852
Energy: 0.5153206139770536
Energy: 0.4845838821805579
Energy: 0.5153206139776307
Energy: 0.5162870233640415
Energy: 0.5140875138925017
Energy: 0.4465332854314103
Energy: 0.5140875138919246
Energy: 0.8248624125325569
Energy: 0.5371544458664066
Energy: 0.4839586647581007
Energy: 0.5371544458669836
Energy: 0.7130229728375489
Energy: 0.5157281392688646
Energy: 0.4444535656448024
Energy: 0.5157281392665566
Energy: 0.9710940321897339
Energy: 0.5152706502763467
Energy: 0.484589557125079
Energy: 0.5152706502734617
Energy: 0.7482839541096207
Energy: 0.5142506881887978
Energy: 0.4457426162300271
Energy: 0.5142506881887978
Energy: 0.8946349229376968
Energy: 0.5340730607825462
Energy: 0.48391023903863667
Energy: 0.5340730607848543
Energy: 0.712946416171095
Energy: 0.5154272405862333
Energy: 0.44553691044177784
Energy: 0.5154272405827977
Energy: 0.8702752556691219
Energy: 0.5152852345357988
Energy: 0.4845638746204944
Energy: 0.515285234536953
Energy: 0.5162391484743497
Energy: 0.5140926842873409
Energy: 0.5940847497164836
Energy: 0.5140926842879179
Energy: 0.6859717640604189
Energy: 0.5341895265666529
Energy: 0.4839487464383525
Energy: 0.5341895265660759
Energy: 0.48346676945901307
Energy: 0.5143348686494911
Energy: 0.5933213755872668
Energy: 0.5143348686483371
Energy: 0.6687902667642897
Energy: 0.5140562255457187
Energy: 0.48472429703342845
Energy: 0.514056225538795
Energy: 0.48513830706037686
Energy: 0.5140842501621143
Energy: 0.6045642902560694
Energy: 0.5140842501626912
Energy: 0.45814711646433165
Energy: 0.555317525317303
Energy: 0.48571041037746954
Energy: 0.555317525315572
Energy: 0.48297283638874544
Energy: 0.514310870832853
Energy: 0.8112900152931479
Energy: 0.5143108708339806
Energy: 0.4447582520779345
Energy: 0.5140976299512091
Energy: 0.5161540519478359
Energy: 0.5140976299535172
Energy: 0.48530499900040275
Energy: 0.5140753759594999
Energy: 0.8247329112221932
Energy: 0.5140753759589229

minimum gb energy = 0.44324184696038593 eV
minimum distance =  2.31316240025768 Angstroms
sigma value = 113


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

Energy: 0.015484336140482542
Energy: 0.016177809700740148
Energy: 0.5836799859557938
Energy: 0.016177809700740148
Energy: 0.5832908304161941
Energy: 0.2889327322475462
Energy: 0.2887452987784497
Energy: 0.2889327322479897
Energy: 0.015484336140482542
Energy: 0.016177809700296593
Energy: 0.5836802920574695
Energy: 0.016177809700740148
Energy: 0.5832908304161941
Energy: 0.2889327322475462
Energy: 0.2887452987771436
Energy: 0.2889327322479897
Energy: 0.015484336140482542
Energy: 0.016177809700296593
Energy: 0.5836800475530126
Energy: 0.016177809700740148
Energy: 0.5832908304161941
Energy: 0.2889327322475462
Energy: 0.28874529877803073
Energy: 0.2889327322479897

minimum gb energy = 0.015484336140482542 eV
minimum distance =  2.54660935057257 Angstroms
sigma value = 1