Model name: model_name=EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.61492508649826
cohesive_energy=3.540501757109522
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 4.9999999997e-06 eV

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

Energy: 0.015488226402403315
Energy: 0.32377070399613156
Energy: 0.32377070399613156
Energy: 0.015488226402403315
Energy: 0.32377070399468605
Energy: 0.32377070399613156
Energy: 0.015488226402403315
Energy: 0.3237707039975772
Energy: 0.32377070399613156
Energy: 0.015488226400957742
Energy: 0.32094167079199365
Energy: 0.018306423143202005
Energy: 0.3210507671893987
Energy: 0.32094167079199365
Energy: 0.018306423143202005
Energy: 0.3210507671893987
Energy: 0.32094167079199365
Energy: 0.018306423143202005
Energy: 0.3210507671893987
Energy: 0.32094167079199365
Energy: 0.8859345772105687
Energy: 0.5847517058159035
Energy: 0.36569767446584334
Energy: 0.6638127658259261
Energy: 0.5847517058159035
Energy: 0.46660625249269694
Energy: 0.6638127658201438
Energy: 0.5056763900581644
Energy: 0.5056763950590831
Energy: 0.6638127658230351
Energy: 0.32094167079199365
Energy: 0.3210507671893987
Energy: 0.018306423143202005
Energy: 0.32094167079343916
Energy: 0.3210507671908442
Energy: 0.018306423143202005
Energy: 0.32094167079199365
Energy: 0.3210507671893987
Energy: 0.018306423144647574
Energy: 0.32094167079343916
Energy: 0.015488226402403315
Energy: 0.3237707039975772
Energy: 0.32377070399613156
Energy: 0.015488226402403315
Energy: 0.32377070399613156
Energy: 0.3237707039975772
Energy: 0.015488226402403315
Energy: 0.3237707039990227
Energy: 0.3237707039975772
Energy: 0.015488226402403315
Energy: 0.32094167079199365
Energy: 0.018306423143202005
Energy: 0.3210507671893987
Energy: 0.32094167079343916
Energy: 0.018306423144647574
Energy: 0.3210507671893987
Energy: 0.32094167079199365
Energy: 0.018306423143202005
Energy: 0.3210507671893987
Energy: 0.32094167079199365
Energy: 0.6638127658230351
Energy: 0.18739289275404516
Energy: 0.01633005476613363
Energy: 0.6638127658230351
Energy: 0.18739289275404516
Energy: 0.016330054767579198
Energy: 0.6638127658230351
Energy: 0.18739289275404516
Energy: 0.016330054767579198
Energy: 0.6638127658244805

minimum gb energy = 0.015488226400957742 eV
minimum distance =  2.35339940331872 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 0.9095386784844615
Energy: 0.9094511291357299
Energy: 0.7538881137110891
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Energy: 0.7538881137110891
Energy: 0.7782160173196994
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Energy: 0.8745232442374655
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Energy: 0.9470617011665955
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Energy: 0.8835606135250762
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Energy: 0.799492217021814
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Energy: 0.9048233342871558
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Energy: 0.9094511291339916
Energy: 0.7573101938440702
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Energy: 0.9094511291328969
Energy: 0.8213623123604458
Energy: 0.9095386784926377
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Energy: 0.757310193843362
Energy: 0.7782160173242705
Energy: 0.7871360832501911
Energy: 0.8745232442364355
Energy: 0.778216017326073
Energy: 0.787136083249483
Energy: 0.8745232442399764
Energy: 0.7782160173274895
Energy: 0.7871360832477448
Energy: 0.8745232442360492
Energy: 0.7782160173256868
Energy: 0.8366564874465567
Energy: 0.9134967942412048
Energy: 0.8837245865248862
Energy: 0.8466062959500522
Energy: 0.91349679424687
Energy: 0.8837245865386634
Energy: 0.8366564874465567
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Energy: 0.8837245864579951
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Energy: 0.9094768569315295
Energy: 0.9791709813637313
Energy: 0.6895809934398974
Energy: 0.9094768569375812
Energy: 0.9791709813630229
Energy: 0.6895809934391891
Energy: 0.9094768569371948
Energy: 0.9791709813623147
Energy: 0.6895809934380948
Energy: 0.9094768569319156

minimum gb energy = 0.656032284934252 eV
minimum distance =  2.37622941505787 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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Energy: 0.7586741826829162
Energy: 0.7585455685648336
Energy: 0.9266437486070377
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minimum gb energy = 0.7585455685613781 eV
minimum distance =  2.25004601880071 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.975296879812713
Energy: 0.9001942123789904
Energy: 0.915267339117256
Energy: 0.9754056292794244
Energy: 0.9087857723613723
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Energy: 0.9754056292763057
Energy: 0.9088169028095926
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Energy: 0.9754056292782549
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Energy: 0.9152673391143145
Energy: 0.9488832382125988
Energy: 0.877082734281878
Energy: 0.8831122196085006
Energy: 0.9341561333151854
Energy: 0.8932550913157884
Energy: 0.882900017853562
Energy: 0.9125035065742548
Energy: 0.8770827342787593
Energy: 0.883112219609103
Energy: 0.9172176355479349
Energy: 0.9617574532932226
Energy: 0.91567070316908
Energy: 0.9135543610244015
Energy: 0.9724494636709476
Energy: 0.9156707031640121
Energy: 0.9135543610253938
Energy: 0.9617574532885446
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Energy: 0.9724494636682188
Energy: 0.8777929726598035
Energy: 0.8693974274169676
Energy: 0.940323893336696
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Energy: 0.8693974274154083
Energy: 0.9145873855528595
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Energy: 0.9403238933388224
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Energy: 0.8786499847628414
Energy: 0.8540285102446571
Energy: 0.8765477456174566
Energy: 0.878649984758943
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Energy: 0.8765477456158973
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Energy: 0.9445237074807911
Energy: 0.9390222237011093
Energy: 0.9221601320864526
Energy: 0.9445237074804014
Energy: 0.9277846719374456
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Energy: 0.8968506103414435
Energy: 0.9255382604247779
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Energy: 0.9255382604204899
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Energy: 0.8990190513743488
Energy: 0.9910496363727139
Energy: 0.991944981909681
Energy: 0.8990258253309433
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Energy: 0.8990190513804089
Energy: 0.9910496363701624
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Energy: 0.8990258253286043
Energy: 0.9652680799881743
Energy: 0.8901609154565564
Energy: 0.9163870122714884
Energy: 0.965268079983709
Energy: 0.8901609154555994
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Energy: 0.9652680799897337
Energy: 0.8901609154557767
Energy: 0.9163870122678028
Energy: 0.9652680799891313
Energy: 0.9228920930266411
Energy: 0.916842504661293
Energy: 0.9275010175342447
Energy: 0.9276562126967531
Energy: 0.9168425046645889
Energy: 0.9285517625487855
Energy: 0.9066289387390433
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Energy: 0.9326104419858482
Energy: 0.927656212691508
Energy: 0.8953427022157597
Energy: 0.929813778584136
Energy: 0.8539927554443834
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Energy: 0.9300849202683366
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Energy: 0.8953427022087427
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Energy: 0.8539927554439934
Energy: 0.8954849910583735
Energy: 0.9651720430557311
Energy: 0.9488946260350447
Energy: 0.9030132272505372
Energy: 0.9651720430594521
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Energy: 0.9030132272491905
Energy: 0.9651720430563335
Energy: 0.9488946260369939
Energy: 0.9030132272503602
Energy: 0.9651720430553411
Energy: 0.8969631144515345
Energy: 0.9099637120906611
Energy: 0.9424755262135532
Energy: 0.8969631144519246
Energy: 0.9099637120887119
Energy: 0.9424755262088752
Energy: 0.8969631144532713
Energy: 0.9099637120923977
Energy: 0.942475526206359
Energy: 0.8969631144536611
Energy: 0.9299936477061149
Energy: 1.0353448656258575
Energy: 0.9456610810510432
Energy: 0.9263089969641056
Energy: 1.0200798093547874
Energy: 0.8723122992980562
Energy: 0.9262844142802946
Energy: 1.0353448656278068
Energy: 0.8563820251384417
Energy: 0.9224615987176812
Energy: 0.960284165753836
Energy: 0.9442785984932413
Energy: 0.8819041757294246
Energy: 0.9602841657550055
Energy: 0.944278598493631
Energy: 0.8819041757315509
Energy: 0.960284165753836
Energy: 0.944278598491292
Energy: 0.8819041757282551
Energy: 0.9602841657518868
Energy: 0.8490610726734104
Energy: 0.8880366035061401
Energy: 0.9105747858340109
Energy: 0.8490610726769189
Energy: 0.8880366035065298
Energy: 0.9105747858340109
Energy: 0.8490610726730204
Energy: 0.8880366035022416
Energy: 0.9105747858373422
Energy: 0.8490610726731976
Energy: 0.8961592513530136
Energy: 0.8932519530395268
Energy: 0.9295710214060877
Energy: 0.8961592513518439
Energy: 0.8932519530404837
Energy: 0.9295710214074697
Energy: 0.8961592513526236
Energy: 0.8932519530371877
Energy: 0.9295710214094189
Energy: 0.896159251353226
Energy: 0.8766103389432881
Energy: 0.915293747872788
Energy: 0.9118371552110502
Energy: 0.8766103389448475
Energy: 0.9151865461957478
Energy: 0.9118371552097034
Energy: 0.8766103389473637
Energy: 0.9152937478749501
Energy: 0.9118371552128223
Energy: 0.8766103389436779
Energy: 0.9176719707081996
Energy: 0.9403742887844432
Energy: 0.9249820933143444
Energy: 0.9176719707054707
Energy: 0.9403523634743833
Energy: 0.9249820933155141
Energy: 0.9176719707062504
Energy: 0.9403742887879518
Energy: 0.9249820933120056
Energy: 0.9176719707064631
Energy: 0.8561616909295517
Energy: 0.9182366832134047
Energy: 0.899931043025318
Energy: 0.8561616909225347
Energy: 0.9182366832124124
Energy: 0.8999310430208525
Energy: 0.8561616909225347
Energy: 0.9182366832108529
Energy: 0.8999310430239712
Energy: 0.8561616909207627
Energy: 0.9375627728203405
Energy: 0.9948600716292563
Energy: 0.9004204185766373
Energy: 0.937562772822467
Energy: 0.9681642383406643
Energy: 0.9004204185797561
Energy: 0.9375627728212975
Energy: 0.9948600716333318
Energy: 0.9004204185801459
Energy: 0.9375627728203405
Energy: 0.9532703132368245
Energy: 0.8824242734735772
Energy: 0.9147193343438542
Energy: 0.9532703132368245
Energy: 0.8821982157806623
Energy: 0.9147193343460162
Energy: 0.9532703132391634
Energy: 0.8824242734743569
Energy: 0.9147193343452366
Energy: 0.9532703132372142
Energy: 0.8774314242126194
Energy: 0.8824332048763728
Energy: 0.9488927027174914
Energy: 0.8774314242073742
Energy: 0.8823245262856284
Energy: 0.9488927027196533
Energy: 0.877431424208721
Energy: 0.8824332048755932
Energy: 0.9488927027200432
Energy: 0.8774314242118397

minimum gb energy = 0.8488992695810283 eV
minimum distance =  2.34538762607611 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.8416771979227253
Energy: 0.9014218594617274
Energy: 0.90176131213287
Energy: 0.8416771979240637
Energy: 0.9014218594623966
Energy: 0.9017613121482609
Energy: 0.8416771979227253
Energy: 0.9014218594630657
Energy: 0.9017613121121258
Energy: 0.8416771979240637
Energy: 0.8989884798589292
Energy: 0.8502619166248526
Energy: 0.927938941256784
Energy: 0.8989884798555834
Energy: 0.8502619166275293
Energy: 0.9279389412574532
Energy: 0.8989884798575909
Energy: 0.8502619166255218
Energy: 0.927938941256784
Energy: 0.8989884798555834
Energy: 0.8861625433463045
Energy: 0.9343151480483897
Energy: 0.8139362651131972
Energy: 0.886162543348312
Energy: 0.9343152416115619
Energy: 0.8139362644376406
Energy: 0.8861625433476429
Energy: 0.9343154872534956
Energy: 0.8139362634991915
Energy: 0.886162543348312
Energy: 0.9460501140700939
Energy: 0.9008505741277935
Energy: 0.849761460534018
Energy: 0.9460501140721014
Energy: 0.9008505741271243
Energy: 0.8497614605320105
Energy: 0.9460501140694247
Energy: 0.9008505741277935
Energy: 0.8497614605346872
Energy: 0.946050114070763
Energy: 0.8794004698627144
Energy: 0.9121205171229563
Energy: 0.8812013083139916
Energy: 0.8794004698680373
Energy: 0.9121205171256328
Energy: 0.8812013083153298
Energy: 0.8794004698633835
Energy: 0.9121205171236254
Energy: 0.8812013083146607
Energy: 0.8794004698673682
Energy: 0.850442852700558
Energy: 0.9960313374473129
Energy: 0.9451589002221191
Energy: 0.8504428527025654
Energy: 0.9960313374499894
Energy: 0.9451589002254649
Energy: 0.850442852701227
Energy: 0.9960313374473129
Energy: 0.9451589002221191
Energy: 0.8504428527025654
Energy: 0.8999985160851297
Energy: 0.928004564762428
Energy: 0.9000041340446931
Energy: 0.8999985160844605
Energy: 0.9280045647651046
Energy: 0.900004134048039
Energy: 0.8999985160924906
Energy: 0.92800456476112
Energy: 0.9000041340453623
Energy: 0.8999985160837913
Energy: 0.9536362039265156
Energy: 0.848815956042094
Energy: 0.8485774251465535
Energy: 0.953636203924508
Energy: 0.8488159560440711
Energy: 0.8485774251452153
Energy: 0.9536362039271847
Energy: 0.848815956042094
Energy: 0.8485774251452153
Energy: 0.953636203924508
Energy: 0.8999720373660747
Energy: 0.9001136240555316
Energy: 0.9279489728914128
Energy: 0.8999720373660747
Energy: 0.9001136240555316
Energy: 0.9279489728927514
Energy: 0.899972037363398
Energy: 0.9001136240562008
Energy: 0.9279489728907436
Energy: 0.8999720373660747
Energy: 0.8501999976627793
Energy: 0.944582277293044
Energy: 0.9963071077781546
Energy: 0.8501999976621102
Energy: 0.9445822772903675
Energy: 0.9963071077788238
Energy: 0.8501999976627793
Energy: 0.9445822772903675
Energy: 0.9963071077781546
Energy: 0.8501999976621102
Energy: 0.8793276619635826
Energy: 0.880995872383953
Energy: 0.912010620702778
Energy: 0.8793276619622443
Energy: 0.8809958723826148
Energy: 0.9120106206994322
Energy: 0.8793276619642518
Energy: 0.880995872383953
Energy: 0.9120106207014397
Energy: 0.8793276619642518
Energy: 0.9461520419082341
Energy: 0.8497659976096876
Energy: 0.900772959966098
Energy: 0.9461520419082341
Energy: 0.8497659976056726
Energy: 0.9007729599674363
Energy: 0.9461520419089033
Energy: 0.8497659976103568
Energy: 0.900772959966098
Energy: 0.9461520419089033
Energy: 0.886180872816315
Energy: 0.8139871311936819
Energy: 0.9341610974756618
Energy: 0.8861808728176533
Energy: 0.8139871312016815
Energy: 0.9341610971960705
Energy: 0.8861808728176533
Energy: 0.8139871312050274
Energy: 0.9341611101614665
Energy: 0.8861808728176533
Energy: 0.8993747338923691
Energy: 0.9274897110407196
Energy: 0.8502454743914769
Energy: 0.8993747338923691
Energy: 0.9274897110360355
Energy: 0.8502454743894695
Energy: 0.8993747338923691
Energy: 0.9274897110387121
Energy: 0.8502454743908078
Energy: 0.8993747338903615
Energy: 0.8416771979220562
Energy: 0.9014218594610581
Energy: 0.9017613121382234
Energy: 0.8416771979233945
Energy: 0.9014218594630657
Energy: 0.9017613121047953
Energy: 0.8416771979213871
Energy: 0.9014218594597199
Energy: 0.9017613120981036
Energy: 0.8416771979227253

minimum gb energy = 0.8139362634991915 eV
minimum distance =  2.34495454142447 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.9467024294114005
Energy: 0.8286087375883017
Energy: 0.8278914251343743
Energy: 0.9175003286372931
Energy: 0.82860873757532
Energy: 0.8278914251265854
Energy: 0.9467024294088042
Energy: 0.82860873757532
Energy: 0.8278914251265854
Energy: 0.9175003286372931
Energy: 0.8169152717598687
Energy: 0.7417724743864722
Energy: 0.8353908359688297
Energy: 0.8169152717598687
Energy: 0.7417724743942611
Energy: 0.8353908359662333
Energy: 0.8169152717598687
Energy: 0.7417724743838758
Energy: 0.8353908359610406
Energy: 0.816915271762465
Energy: 0.7795880157002526
Energy: 0.7381978513879225
Energy: 0.7928075168945323
Energy: 0.7845431104948717
Energy: 0.7381978513853261
Energy: 0.7736191452720919
Energy: 0.8051127267152206
Energy: 0.7381978513801335
Energy: 0.7699750335384541
Energy: 0.8027769268879247
Energy: 0.7583838389049707
Energy: 0.7580178908675206
Energy: 0.7577232674614635
Energy: 0.7583838389127598
Energy: 0.7580178908649242
Energy: 0.7579024567859488
Energy: 0.7583838389153561
Energy: 0.7580178908675206
Energy: 0.7577232674562707
Energy: 0.7583838389101635
Energy: 0.7768844886561274
Energy: 0.7850098598606522
Energy: 0.757695495047395
Energy: 0.7768844886613199
Energy: 0.7850098598866154
Energy: 0.7578639206680479
Energy: 0.7768844886561274
Energy: 0.7850098599099824
Energy: 0.7576954950525404
Energy: 0.7768844886561274
Energy: 0.7522697898032422
Energy: 0.809006100958099
Energy: 0.7995679947374854
Energy: 0.7522697898110311
Energy: 0.8090061009555026
Energy: 0.7995679947348892
Energy: 0.7522697898058386
Energy: 0.8090061009632917
Energy: 0.7995679947400816
Energy: 0.752269789800646
Energy: 0.7581484489157364
Energy: 0.7370155398778208
Energy: 0.8320856220576819
Energy: 0.75814844891314
Energy: 0.7370155398752244
Energy: 0.8320856220602783
Energy: 0.7581484489157364
Energy: 0.7370155398700318
Energy: 0.8320856220602783
Energy: 0.7581484489157364
Energy: 0.8270331810096508
Energy: 0.7508516910888122
Energy: 0.786133102688027
Energy: 0.8270331810044582
Energy: 0.7508701178485669
Energy: 0.7861331026932197
Energy: 0.8270331810096508
Energy: 0.7508516910836195
Energy: 0.7861331026906233
Energy: 0.8270331810070546
Energy: 0.7996380028875976
Energy: 0.8383827937738985
Energy: 0.7588709576292981
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Energy: 0.7588709576344909
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Energy: 0.7588709576344909
Energy: 0.7996380028642779
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Energy: 0.8066565737904379
Energy: 0.7744220821131641
Energy: 0.7464681845193861
Energy: 0.8066565737878415
Energy: 0.7744220821131641
Energy: 0.7464681845219825
Energy: 0.8066565737904379
Energy: 0.7744220821157605
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Energy: 0.7442523543902796
Energy: 0.7672447739148017
Energy: 0.7670700800973547
Energy: 0.7442523543876832
Energy: 0.7671644068370528
Energy: 0.7670585419691713
Energy: 0.7442523543902796
Energy: 0.767244773925187
Energy: 0.7670700800921622
Energy: 0.7442523543954722
Energy: 0.7471453873656372
Energy: 0.7642593005048128
Energy: 0.8102712338620506
Energy: 0.7471453873630409
Energy: 0.7643666855992175
Energy: 0.8102712338620506
Energy: 0.7471453873656372
Energy: 0.7642593005515466
Energy: 0.8102712338672431
Energy: 0.7471453873708298
Energy: 0.8286763757149109
Energy: 0.7537511632406764
Energy: 0.8498105329421196
Energy: 0.8286763757123148
Energy: 0.7537500646746051
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Energy: 0.7537511632354836
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Energy: 0.8281846697521085
Energy: 0.8261953609073238
Energy: 0.7507647996032705
Energy: 0.8281846697443195
Energy: 0.8261953609099201
Energy: 0.7507647996006741
Energy: 0.8281846697443195
Energy: 0.8261953609047274
Energy: 0.7507647996084632
Energy: 0.8281846697469157
Energy: 0.744885556227761
Energy: 0.8354534450667592
Energy: 0.7500681059780829
Energy: 0.7448855562251647
Energy: 0.8354534450693556
Energy: 0.7500681059780829
Energy: 0.7448855562303573
Energy: 0.8354534450667592
Energy: 0.7500681059832757
Energy: 0.744885556227761
Energy: 0.7388854046600376
Energy: 0.8029558447585023
Energy: 0.8059554179684972
Energy: 0.7388854046703756
Energy: 0.8029558447533097
Energy: 0.8059554179710936
Energy: 0.7388854046677794
Energy: 0.8029558447481171
Energy: 0.8059554179736899
Energy: 0.7388854046626339
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Energy: 0.7736646467175143
Energy: 0.7796383875641315
Energy: 0.7759015298471083
Energy: 0.773664646681213
Energy: 0.7796383875589389
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Energy: 0.7895100079060292
Energy: 0.7787966024149193
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Energy: 0.7895100079086256
Energy: 0.7787966024097266
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Energy: 0.7895100079060292
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Energy: 0.751511127169245
Energy: 0.789510007911222
Energy: 0.7842333388802225
Energy: 0.8272112658272568
Energy: 0.7371356243657556
Energy: 0.7842333388776261
Energy: 0.8272112658298532
Energy: 0.7371356243709483
Energy: 0.7842333388776261
Energy: 0.8272112658375947
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Energy: 0.7842333388802225
Energy: 0.7510468868741914
Energy: 0.844308096027082
Energy: 0.7423750813276567
Energy: 0.7508986390800341
Energy: 0.8443080960296784
Energy: 0.7423750813328495
Energy: 0.7510468868715953
Energy: 0.844308096016744
Energy: 0.7423750813276567
Energy: 0.7508986390774377
Energy: 0.7506029630019947
Energy: 0.8281711740206134
Energy: 0.8275028550547738
Energy: 0.7505903695873334
Energy: 0.828171174025806
Energy: 0.8275028550521775
Energy: 0.7506029630097837
Energy: 0.828171174025806
Energy: 0.8275028550495811
Energy: 0.7505903695899296
Energy: 0.8436864155050918
Energy: 0.7556248193983884
Energy: 0.7970094999762207
Energy: 0.8436864155024956
Energy: 0.7556248194035812
Energy: 0.7970094964104801
Energy: 0.8436864155050918
Energy: 0.7556248194035812
Energy: 0.7970094981310386
Energy: 0.8436864154998992
Energy: 0.7388485695480699
Energy: 0.764565603710828
Energy: 0.7510145280663965
Energy: 0.738848569550666
Energy: 0.7645656037134243
Energy: 0.7510145280638002
Energy: 0.7388485695480699
Energy: 0.7645656037134243
Energy: 0.7510145280663965
Energy: 0.7388485695454735
Energy: 0.76727246145649
Energy: 0.7668546553940275
Energy: 0.7442671792685727
Energy: 0.767272461464279
Energy: 0.7668546553991729
Energy: 0.744267179271169
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Energy: 0.7668546553940275
Energy: 0.7442671792763617
Energy: 0.7672724614538936
Energy: 0.7924377434514595
Energy: 0.8012232573478248
Energy: 0.7461869936405404
Energy: 0.7924377434566522
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Energy: 0.7924377434540558
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Energy: 0.8016114486204867
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Energy: 0.8029078047148135
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Energy: 0.7733453239926635
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Energy: 0.7733453239926635
Energy: 0.8012273585277757
Energy: 0.755663202147048
Energy: 0.8321652547805343
Energy: 0.7394668852768396
Energy: 0.7984030471787396
Energy: 0.8321652547857268
Energy: 0.7394668852742433
Energy: 0.7984030471735469
Energy: 0.8321652547805343
Energy: 0.7394668852716471
Energy: 0.7984030471735469
Energy: 0.832165254777938
Energy: 0.8290354587718153
Energy: 0.8255792930670347
Energy: 0.9171104338719885
Energy: 0.8290354587640263
Energy: 0.8255792930748235
Energy: 0.9171104338693923
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Energy: 0.8255792930774198
Energy: 0.9171104338719885
Energy: 0.8290354587666227
Energy: 0.7444403386405766
Energy: 0.8255987323904669
Energy: 0.7783991506415763
Energy: 0.7444403386431258
Energy: 0.8279079056747429
Energy: 0.7783991506337874
Energy: 0.7444403386431258
Energy: 0.8255987323904669
Energy: 0.7783991506311911
Energy: 0.7444403386379803
Energy: 0.7452867157695248
Energy: 0.7674141910222887
Energy: 0.7686272987437255
Energy: 0.7452867157617357
Energy: 0.7674361806762449
Energy: 0.768616852550986
Energy: 0.7452867157617357
Energy: 0.7674141910196923
Energy: 0.7686272987411292
Energy: 0.7452867157695248
Energy: 0.7518801928412041
Energy: 0.757095616316289
Energy: 0.7586375789578682
Energy: 0.7518801928412041
Energy: 0.7570960652701222
Energy: 0.7586375789474828
Energy: 0.7518801928412041
Energy: 0.7570956163188853
Energy: 0.7586375789526756
Energy: 0.7518801928412041
Energy: 0.7845499507790663
Energy: 0.7588875937953949
Energy: 0.7980542894034116
Energy: 0.7845499506752607
Energy: 0.7589017044935784
Energy: 0.7980542894112006
Energy: 0.7845499509866776
Energy: 0.7588875937927986
Energy: 0.7980542894112006
Energy: 0.7845499508958536
Energy: 0.7848173298405627
Energy: 0.8292503796361119
Energy: 0.7512772500178277
Energy: 0.7848173298431591
Energy: 0.8292503796283228
Energy: 0.7512772500178277
Energy: 0.7848173298483516
Energy: 0.8292503796309192
Energy: 0.7512772500178277
Energy: 0.7848173298457554

minimum gb energy = 0.7367792298867436 eV
minimum distance =  2.30249864728754 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.3322125919542753
Energy: 0.41340161658791236
Energy: 0.41343831815176724
Energy: 0.3322125919539672
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Energy: 0.3418647625729211
Energy: 0.4081614954376558
Energy: 0.3455101167969897
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Energy: 0.33227696650242783
Energy: 0.42670608253862663
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Energy: 0.3701001801748201
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Energy: 0.4082018051748036
Energy: 0.3418640076013884
Energy: 0.34525838552501065
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Energy: 0.3418640076029294
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Energy: 0.3418640076013884
Energy: 0.3322125919539672
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Energy: 0.4134383181514591
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Energy: 0.41343831815176724
Energy: 0.3322125919542753
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Energy: 0.34186476257168835
Energy: 0.40816149543673114
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Energy: 0.35205927809611753
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Energy: 0.3514749275581059
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Energy: 0.41308962966336604
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Energy: 0.4248389585682978
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Energy: 0.3393402761596222
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Energy: 0.41308962966336604
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Energy: 0.3701001801751283
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Energy: 0.4135906222120071
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Energy: 0.4135906222116989
Energy: 0.3701001801748201
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Energy: 0.35207491708178806
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Energy: 0.4129895754958662
Energy: 0.34622015626910724
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Energy: 0.3462201562706482
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Energy: 0.3462201562697237
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Energy: 0.4129895754958662
Energy: 0.41300524083297024
Energy: 0.33403573928131597
Energy: 0.34611421422282496
Energy: 0.41300524083235385
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Energy: 0.41300524083297024
Energy: 0.33403573927761765
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Energy: 0.413005240832662
Energy: 0.41308962966367424
Energy: 0.3393402761605468
Energy: 0.42483895856798964
Energy: 0.41308962966336604
Energy: 0.33934027615900575
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Energy: 0.41308962966336604
Energy: 0.3393402761602386
Energy: 0.4248389585682978
Energy: 0.4130896296630578
Energy: 0.3701001801748201
Energy: 0.35146296370470975
Energy: 0.4135906222113907
Energy: 0.3701001801751283
Energy: 0.3514629637031687
Energy: 0.4135906222116989
Energy: 0.3701001801748201
Energy: 0.3514629637037851
Energy: 0.41359062221108256
Energy: 0.3701001801751283
Energy: 0.3322552825419117
Energy: 0.35207491708117167
Energy: 0.4266936331893698
Energy: 0.3322552825394461
Energy: 0.3520749170808634
Energy: 0.4266936331893698
Energy: 0.33225528253913794
Energy: 0.3520749170820962
Energy: 0.42669363318875336
Energy: 0.3322552825409871
Energy: 0.341864007602313
Energy: 0.34525838553209914
Energy: 0.40820180517449534
Energy: 0.3418640076013884
Energy: 0.345258385525627
Energy: 0.40820180517418714
Energy: 0.341864007602313
Energy: 0.345258385527168
Energy: 0.40820180517449534
Energy: 0.34186400760169666

minimum gb energy = 0.3322125919539672 eV
minimum distance =  2.40205052593288 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.7073293580911643
Energy: 0.7389047649718489
Energy: 0.7387960986331734
Energy: 0.7073293580928561
Energy: 0.738904764970157
Energy: 0.7387960986314814
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Energy: 0.7389047649718489
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Energy: 0.7057360745686384
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Energy: 0.8078792424926305
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Energy: 0.7037718811290365
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Energy: 0.7037718811307285
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Energy: 0.7109270516921863
Energy: 0.7604405728186133
Energy: 0.72580986194886
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Energy: 0.7604405728203053
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Energy: 0.7109270516921863
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Energy: 0.7106650483618759
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Energy: 0.7181648284786946
Energy: 0.7106650483669517
Energy: 0.7425288674015544
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Energy: 0.7344997364218568
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Energy: 0.7173863505989265
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Energy: 0.6804111055546812
Energy: 0.6864350810521731
Energy: 0.739392056673011
Energy: 0.6804111055546812

minimum gb energy = 0.6770562794579035 eV
minimum distance =  2.29306358460248 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.8696874631483865
Energy: 0.949961287819199
Energy: 0.9499117596645531
Energy: 0.869687463150626
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Energy: 0.8770041255694899
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Energy: 0.9546139503082958
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Energy: 0.8979650313252087
Energy: 0.8676471687893087
Energy: 0.8912504983992565
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Energy: 0.8676471687893087
Energy: 0.891250498401496
Energy: 0.8703970986787941
Energy: 0.8676471687926679
Energy: 0.8912504983992565
Energy: 0.8771465176227984
Energy: 0.8676471687915481
Energy: 0.8675257263823799
Energy: 0.9135666220679352
Energy: 0.9387550776621757
Energy: 0.8675257263834997
Energy: 0.9135666220354883
Energy: 0.9387550776599364
Energy: 0.8675257263823799
Energy: 0.9135666220488995
Energy: 0.9387550776632955
Energy: 0.8675257263834997
Energy: 0.9194907005328289
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Energy: 0.9548953740455601
Energy: 0.9194907005339487
Energy: 0.9327732574854075
Energy: 0.9548953740455601
Energy: 0.9194907005328289
Energy: 0.932773257484288
Energy: 0.9548953740455601
Energy: 0.9194907005339487

minimum gb energy = 0.866615296641659 eV
minimum distance =  2.32540375754663 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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Energy: 1.019985299513122
Energy: 1.0202601516033492
Energy: 1.027430179698093
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Energy: 1.0362999148880974
Energy: 0.999642623680787
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Energy: 1.0514266386895297
Energy: 1.0362999148880974
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Energy: 1.0371600641410559
Energy: 1.027360618245677
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Energy: 1.0371600641451109
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Energy: 1.0282095697107563
Energy: 1.002079665303899
Energy: 0.9940852504058344
Energy: 1.0021182665387633
Energy: 1.0020796653080295
Energy: 0.9940852504038068
Energy: 1.002118266534633
Energy: 1.0020796653060018
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Energy: 1.0021182665408659
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Energy: 1.0320623884184605
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Energy: 1.0354222557229693
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Energy: 1.0165618079621732
Energy: 1.0371784545386513
Energy: 1.032062388420563
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Energy: 1.0636480855902983
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Energy: 1.0176326308724244
Energy: 1.0636480855881956
Energy: 1.0094033460740373
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minimum gb energy = 0.9856142048541559 eV
minimum distance =  2.28271984267289 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.9831354422995594
Energy: 1.034292605473688
Energy: 0.9812073948991862
Energy: 0.9831354422990536
Energy: 0.9810738726074409
Energy: 1.0331098068552378
Energy: 1.0721580662985937
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Energy: 1.0721580662985937
Energy: 0.981073872607694
Energy: 1.0331098068552378
Energy: 1.0721580662985937
Energy: 0.981073872607188
Energy: 1.0446154433168866
Energy: 1.0026956456026648
Energy: 0.9834412626954593
Energy: 1.0446154433171395
Energy: 1.0026956456023888
Energy: 0.9834412626959651
Energy: 1.0446154433173924
Energy: 1.0026956456031706
Energy: 0.9834412626957122
Energy: 1.0446154433186572
Energy: 1.036952727816743
Energy: 1.079752042674065
Energy: 0.9808359118321489
Energy: 1.036952727816743
Energy: 1.0797520426679947
Energy: 0.9808359118313902
Energy: 1.036952727816743
Energy: 1.0797520426642009
Energy: 0.9808359118321489
Energy: 1.0369527278169726
Energy: 1.001655851898343
Energy: 1.0031386091843424
Energy: 0.9814267502536469
Energy: 1.001655851898619
Energy: 1.0031386091843424
Energy: 0.9814267502538998
Energy: 1.001655851898619
Energy: 1.0031386091843424
Energy: 0.9814267502536469
Energy: 1.001655851898619
Energy: 1.0463604598382732
Energy: 1.0365319591845674
Energy: 0.9836217830076908
Energy: 1.0463604598276504
Energy: 1.0365319591848206
Energy: 0.9836217830074377
Energy: 1.046360459838526
Energy: 1.0365319591853264
Energy: 0.9836217830074377
Energy: 1.0463604598347322
Energy: 1.0088337005239547
Energy: 1.0141050338292077
Energy: 1.0141098448849184
Energy: 1.0088337005242074
Energy: 1.0141050338289548
Energy: 1.0141098448846655
Energy: 1.0088337005239547
Energy: 1.0141050338294606
Energy: 1.0141098448849184
Energy: 1.0088337005239547
Energy: 1.046344865382621
Energy: 0.9836347335133895
Energy: 1.0364777606752638
Energy: 1.0463448653833798
Energy: 0.9836347335136424
Energy: 1.036477760674758
Energy: 1.046344865382621
Energy: 0.9836347335133895
Energy: 1.0364777606755164
Energy: 1.0463448653831269
Energy: 1.0015064006124672
Energy: 0.9814314095903139
Energy: 1.0032958730903818
Energy: 1.0015064006119614
Energy: 0.9814314095903139
Energy: 1.0032958730913932
Energy: 1.0015064006119614
Energy: 0.9814314095903139
Energy: 1.0032958730903818
Energy: 1.0015064006116854
Energy: 1.036869223173707
Energy: 0.9807621312688907
Energy: 1.0788643108890543
Energy: 1.036869223173707
Energy: 0.9807621312686378
Energy: 1.0788643108857663
Energy: 1.036869223173707
Energy: 0.9807621312686378
Energy: 1.0788643108845015
Energy: 1.036869223173937
Energy: 1.0449177898643474
Energy: 0.9834505778850892
Energy: 1.0027242968361874
Energy: 1.0449177898646003
Energy: 0.9834505778853423
Energy: 1.002724296837199
Energy: 1.0449177898643474
Energy: 0.9834505778853423
Energy: 1.0027242968354055
Energy: 1.0449177898648534
Energy: 0.9810712322195976
Energy: 1.0722028660903986
Energy: 1.033171590002246
Energy: 0.9810712322193447
Energy: 1.0722028660896399
Energy: 1.033171590002246
Energy: 0.9810712322198505
Energy: 1.0722028660903986
Energy: 1.033171590002246
Energy: 0.9810712322198505
Energy: 0.9831884754761642
Energy: 0.9811807434299956
Energy: 1.0343630117741298
Energy: 0.9831884754761642
Energy: 0.9811807434302486
Energy: 1.0343630117743827
Energy: 0.9831884754759113
Energy: 0.9811807434302486
Energy: 1.0343630117743827
Energy: 0.9831884754761642
Energy: 1.090313883851291
Energy: 1.027754327987956
Energy: 1.0274986388689258
Energy: 1.0903138838515438
Energy: 1.0277543279882086
Energy: 1.0274986388696845
Energy: 1.090313883851291
Energy: 1.027754327987703
Energy: 1.0274986388691787
Energy: 1.090313883850785
Energy: 0.9831354422990536
Energy: 1.0342926054734582
Energy: 0.9812073948989333
Energy: 0.9831354422993065
Energy: 1.0342926054739412
Energy: 0.9812073948991862
Energy: 0.9831354422990536
Energy: 1.0342926054734582
Energy: 0.9812073948989333
Energy: 0.9831354422990536
Energy: 0.9810738726069351
Energy: 1.033109806854985
Energy: 1.0721580662985937
Energy: 0.9810738726074409
Energy: 1.0331098068552378
Energy: 1.072158066298341
Energy: 0.9810738726064291
Energy: 1.0331098068552378
Energy: 1.0721580662988468
Energy: 0.9810738726074409
Energy: 1.0446154433168866
Energy: 1.0026956456034006
Energy: 0.9834412626954593
Energy: 1.0446154433166337
Energy: 1.0026956456026648
Energy: 0.9834412626952064
Energy: 1.0446154433176456
Energy: 1.0026956456028946
Energy: 0.9834412626959651
Energy: 1.0446154433166337
Energy: 1.0369527278169726
Energy: 1.0797520426788474
Energy: 0.9808359118313902
Energy: 1.0369527278172488
Energy: 1.0797520426677418
Energy: 0.9808359118321489
Energy: 1.036952727816743
Energy: 1.0797520426785943
Energy: 0.9808359118316431
Energy: 1.036952727816743

minimum gb energy = 0.9807621312683849 eV
minimum distance =  2.30528752696445 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.0006496232357278
Energy: 1.0016727572305855
Energy: 1.0014313822809295
Energy: 1.0006496232357278
Energy: 1.0016727572301283
Energy: 1.001431382279101
Energy: 1.000649623236642
Energy: 1.0016727572301283
Energy: 1.0014313822781866
Energy: 1.0006496232352708
Energy: 0.9989769176499902
Energy: 1.0012075270664902
Energy: 1.000859726268178
Energy: 0.9989769176490759
Energy: 1.0012075270651188
Energy: 1.0008597262686352
Energy: 0.9989769176495331
Energy: 1.0012075270669474
Energy: 1.000859726268178
Energy: 0.9989769176490759
Energy: 0.9998009481414423
Energy: 1.0006199469935269
Energy: 1.0833486891989828
Energy: 0.9998009481423566
Energy: 1.000619946993984
Energy: 1.083348689200811
Energy: 0.9998009481414423
Energy: 1.0006199469948984
Energy: 1.0833486891985258
Energy: 0.9998009481423566
Energy: 1.0831236189339855
Energy: 1.0005257510050263
Energy: 0.9998029817111248
Energy: 1.0831236189344426
Energy: 1.0005257510027405
Energy: 0.9998029817106675
Energy: 1.083123618932157
Energy: 1.0005257510041121
Energy: 0.9998029817111248
Energy: 1.0831236189330713
Energy: 1.0007257150058892
Energy: 1.0013880183487867
Energy: 0.9989944497834332
Energy: 1.0007257150040605
Energy: 1.001388018349701
Energy: 0.9989944497870904
Energy: 1.0007257150049749
Energy: 1.0013880183487867
Energy: 0.9989944497825191
Energy: 1.0007257150045177
Energy: 1.0016727572296709
Energy: 1.0014313822781866
Energy: 1.0006496232370992
Energy: 1.0016727572296709
Energy: 1.0014313822809295
Energy: 1.0006496232348137
Energy: 1.001672757228757
Energy: 1.0014313822813867
Energy: 1.000649623236185
Energy: 1.0016727572301283
Energy: 1.0012075270651188
Energy: 1.0008597262686352
Energy: 0.9989769176499902
Energy: 1.0012075270669474
Energy: 1.0008597262690921
Energy: 0.9989769176490759
Energy: 1.001207527065576
Energy: 1.000859726268178
Energy: 0.9989769176504474
Energy: 1.0012075270669474
Energy: 1.000619946994441
Energy: 1.083348689200354
Energy: 0.9998009481409853
Energy: 1.000619946994441
Energy: 1.08334868919944
Energy: 0.9998009481423566
Energy: 1.000619946993984
Energy: 1.083348689200354
Energy: 0.9998009481409853
Energy: 1.000619946994441
Energy: 1.0005257510050263
Energy: 0.9998029817106675
Energy: 1.0831236189307856
Energy: 1.0005257510018264
Energy: 0.999802981711582
Energy: 1.083123618932614
Energy: 1.0005257509999979
Energy: 0.9998029817106675
Energy: 1.0831236189335283
Energy: 1.0005257510045693
Energy: 1.001388018349701
Energy: 0.9989944497852618
Energy: 1.0007257150077176
Energy: 1.0013880183492438
Energy: 0.9989944497852618
Energy: 1.0007257150036035
Energy: 1.001388018349701
Energy: 0.9989944497861759
Energy: 1.0007257150058892
Energy: 1.0013880183492438
Energy: 1.0014313822795582
Energy: 1.0006496232352708
Energy: 1.0016727572301283
Energy: 1.001431382279101
Energy: 1.000649623236642
Energy: 1.0016727572296709
Energy: 1.001431382281844
Energy: 1.0006496232357278
Energy: 1.0016727572305855
Energy: 1.0014313822781866
Energy: 1.0008597262690921
Energy: 0.9989769176495331
Energy: 1.0012075270651188
Energy: 1.0008597262690921
Energy: 0.9989769176499902
Energy: 1.0012075270669474
Energy: 1.0008597262686352
Energy: 0.998976917648619
Energy: 1.0012075270660332
Energy: 1.000859726268178
Energy: 1.0833486891976114
Energy: 0.9998009481423566
Energy: 1.000619946994441
Energy: 1.08334868919944
Energy: 0.9998009481409853
Energy: 1.000619946994441
Energy: 1.0833486891998971
Energy: 0.9998009481423566
Energy: 1.000619946994441
Energy: 1.0833486891989828
Energy: 0.999802981711582
Energy: 1.083123618942214
Energy: 1.0005257510041121
Energy: 0.9998029817106675
Energy: 1.083123618942214
Energy: 1.0005257510027405
Energy: 0.9998029817111248
Energy: 1.083123618942214
Energy: 1.0005257510045693
Energy: 0.9998029817106675
Energy: 0.9989944497843475
Energy: 1.0007257150040605
Energy: 1.001388018349701
Energy: 0.9989944497834332
Energy: 1.000725715006346
Energy: 1.0013880183487867
Energy: 0.9989944497857189
Energy: 1.0007257150026891
Energy: 1.001388018349701
Energy: 0.9989944497857189
Energy: 1.000649623236642
Energy: 1.0016727572310424
Energy: 1.0014313822781866
Energy: 1.000649623236642
Energy: 1.0016727572301283
Energy: 1.0014313822813867
Energy: 1.0006496232357278
Energy: 1.0016727572305855
Energy: 1.0014313822804723
Energy: 1.0006496232343565
Energy: 0.9989769176504474
Energy: 1.0012075270669474
Energy: 1.0008597262690921
Energy: 0.9989769176490759
Energy: 1.001207527065576
Energy: 1.0008597262686352
Energy: 0.9989769176495331
Energy: 1.0012075270669474
Energy: 1.0008597262686352
Energy: 0.998976917648619
Energy: 0.9998009481414423
Energy: 1.0006199469930699
Energy: 1.0833486891971544
Energy: 0.9998009481423566
Energy: 1.000619946994441
Energy: 1.0833486891980684
Energy: 0.9998009481409853
Energy: 1.000619946993984
Energy: 1.08334868919944
Energy: 0.9998009481423566
Energy: 1.0831236189417566
Energy: 1.0005257510022836
Energy: 0.999802981711582
Energy: 1.0831236189417566
Energy: 1.0005257510041121
Energy: 0.9998029817106675
Energy: 1.083123618943128
Energy: 1.0005257510018264
Energy: 0.9998029817111248
Energy: 1.0831236189412996
Energy: 1.0007257150058892
Energy: 1.0013880183487867
Energy: 0.9989944497834332
Energy: 1.0007257150058892
Energy: 1.001388018349701
Energy: 0.9989944497848047
Energy: 1.0007257150049749
Energy: 1.0013880183492438
Energy: 0.9989944497857189
Energy: 1.0007257150036035
Energy: 1.0016727572305855
Energy: 1.0014313822800154
Energy: 1.000649623236642
Energy: 1.0016727572301283
Energy: 1.0014313822781866
Energy: 1.0006496232357278
Energy: 1.0016727572310424
Energy: 1.0014313822795582
Energy: 1.000649623236185
Energy: 1.0016727572305855
Energy: 1.001207527065576
Energy: 1.000859726268178
Energy: 0.9989769176499902
Energy: 1.0012075270674046
Energy: 1.0008597262686352
Energy: 0.998976917648619
Energy: 1.0012075270651188
Energy: 1.000859726268178
Energy: 0.9989769176499902
Energy: 1.0012075270664902

minimum gb energy = 0.998976917648619 eV
minimum distance =  2.32428656194811 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.010020142034041
Energy: 1.0292282071023118
Energy: 1.0290712904963375
Energy: 0.9748688763355912
Energy: 1.0292282071023118
Energy: 1.0290712904942652
Energy: 1.010020142031969
Energy: 1.029228207104384
Energy: 1.0290712904984096
Energy: 0.9748688763355912
Energy: 0.9800735801403109
Energy: 0.972254002506024
Energy: 0.9657476813800872
Energy: 0.9800735801340944
Energy: 0.972254002506024
Energy: 0.9657476813821592
Energy: 0.9800735801403109
Energy: 0.9722540025080961
Energy: 0.9657476813800872
Energy: 0.9800735801340944
Energy: 0.9985121135196892
Energy: 0.9979517396193378
Energy: 1.1400155102702585
Energy: 0.9985121135196892
Energy: 0.9979517396234819
Energy: 1.1400155102702585
Energy: 0.998512113517617
Energy: 0.9979517396214098
Energy: 1.1400155102723308
Energy: 0.9985121135196892
Energy: 0.9579865031128278
Energy: 0.998443266087761
Energy: 0.9564813874455983
Energy: 0.9579865031045393
Energy: 0.9984432660856888
Energy: 0.9564813874435261
Energy: 0.9579865031149001
Energy: 0.9984432660898331
Energy: 0.9564813874435261
Energy: 0.9579865031066113
Energy: 0.9681342109732491
Energy: 0.9730402521352673
Energy: 1.0381072742080857
Energy: 0.9681342109753213
Energy: 0.9730402521394116
Energy: 1.03810727421223
Energy: 0.9681342109732491
Energy: 0.9730402521352673
Energy: 1.0381072742080857
Energy: 0.9681342109732491
Energy: 1.0046855900539244
Energy: 0.9613399704863071
Energy: 0.9519052514681079
Energy: 1.004685590064285
Energy: 0.9613399698276237
Energy: 0.9519052514660357
Energy: 1.0046855900539244
Energy: 0.9613399697282353
Energy: 0.9519052514660357
Energy: 1.0046855900622131
Energy: 0.9984753302213747
Energy: 0.9585967421079731
Energy: 0.9802272812915387
Energy: 0.9984728638661585
Energy: 0.9585967421100452
Energy: 0.9802272812853221
Energy: 0.9984753302234468
Energy: 0.9585967421059011
Energy: 0.9802272812915387
Energy: 0.9984728638682308
Energy: 0.972439819525946
Energy: 1.0648251770493116
Energy: 1.0368010138540062
Energy: 0.9724398195280182
Energy: 1.0648251770534558
Energy: 1.0368010138477899
Energy: 0.972439819525946
Energy: 1.0648251770493116
Energy: 1.0368010138519341
Energy: 0.972439819525946
Energy: 0.9481906999096249
Energy: 0.9758110525320675
Energy: 0.9732365011880812
Energy: 0.9481906999054805
Energy: 0.9758110525341395
Energy: 0.9732365011880812
Energy: 0.9481906999075528
Energy: 0.9758110525320675
Energy: 0.9732365011860091
Energy: 0.9481906999034083
Energy: 0.9726428019816494
Energy: 1.0437439994441993
Energy: 0.9814272470604072
Energy: 0.972650754772819
Energy: 1.0437439994441993
Energy: 0.9814272470645514
Energy: 0.9726428019795772
Energy: 1.043743999452488
Energy: 0.9814272470604072
Energy: 0.972650754772819
Energy: 1.0104833597577183
Energy: 0.9400113716118529
Energy: 1.0237421243577207
Energy: 1.010483359761863
Energy: 0.9400113716077086
Energy: 1.0237421243556486
Energy: 1.0104833597577183
Energy: 0.940011371613925
Energy: 1.0237421243577207
Energy: 1.0104833597577183
Energy: 1.0374933337944119
Energy: 0.9476725994745617
Energy: 1.1065832980751602
Energy: 1.0374933337944119
Energy: 0.9470140705081801
Energy: 1.1065832980710157
Energy: 1.0374933337964842
Energy: 0.9476725994724895
Energy: 1.106583298073088
Energy: 1.0374933337944119
Energy: 1.0784373217988896
Energy: 0.9564362425359504
Energy: 1.0009562265480296
Energy: 1.0784373217947452
Energy: 0.9564362425338784
Energy: 1.0009562265480296
Energy: 1.0784373217968173
Energy: 0.9564362425359504
Energy: 1.0009562265480296
Energy: 1.0784373217947452
Energy: 0.9503191767652966
Energy: 0.9495395472471903
Energy: 0.9827453341142637
Energy: 0.9503191767673691
Energy: 0.9495395472471903
Energy: 0.9827453341163359
Energy: 0.9503191767652966
Energy: 0.9495395472451181
Energy: 0.9827453341142637
Energy: 0.9503191767694411
Energy: 1.0285134236398932
Energy: 1.0500120825254653
Energy: 0.9617228566539017
Energy: 1.0285134236378213
Energy: 1.0500120825275376
Energy: 0.9617450668704229
Energy: 1.0285134236378213
Energy: 1.0500120825254653
Energy: 0.9617228566539017
Energy: 1.0285134236398932
Energy: 0.9625067810166299
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Energy: 1.0828961494146516
Energy: 0.962506781018702
Energy: 0.9780116341693668
Energy: 1.0828961494105074
Energy: 0.9625067810166299
Energy: 0.9780116341735112
Energy: 1.0828961494125793
Energy: 0.9625067810166299
Energy: 0.9819334775511983
Energy: 1.0412913486501874
Energy: 1.0282114157912536
Energy: 1.0169895647814495
Energy: 1.041291348643971
Energy: 1.0282114157871092
Energy: 0.9819334775491261
Energy: 1.0412913486522595
Energy: 1.0282114157891813
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Energy: 0.9754748451658546
Energy: 0.9737062223418033
Energy: 0.9647247342850345
Energy: 0.9754748451720712
Energy: 0.9737062223355868
Energy: 0.9647247342953953
Energy: 0.9754748451658546
Energy: 0.9737062223438754
Energy: 0.9647247342891789
Energy: 0.975474845169999
Energy: 0.9644257740407061
Energy: 0.9801249548253623
Energy: 0.984051430671997
Energy: 0.9644257740386338
Energy: 0.9801249548440117
Energy: 0.984051430674069
Energy: 0.9644257740407061
Energy: 0.9801249548523003
Energy: 0.984051430671997
Energy: 0.9644257740386338
Energy: 1.0109048258722437
Energy: 0.961532268504904
Energy: 0.9982775833570695
Energy: 1.0109048258722437
Energy: 0.9615322685069763
Energy: 0.9982775833508529
Energy: 1.0109048258722437
Energy: 0.9615322685069763
Energy: 0.9982775833570695
Energy: 1.0109048258722437
Energy: 1.0045550818152753
Energy: 0.972569183545013
Energy: 1.1036257230324402
Energy: 1.0045550818132032
Energy: 0.9725691835429409
Energy: 1.1036257230365845
Energy: 1.0045550818152753
Energy: 0.9725691835429409
Energy: 1.1036257230324402
Energy: 1.0045550818132032
Energy: 1.0114909363705404
Energy: 1.0914093726668663
Energy: 0.9523640202602861
Energy: 1.0114909363684683
Energy: 1.0914093726668663
Energy: 0.9523640202602861
Energy: 1.0114909363726128
Energy: 1.0914093726668663
Energy: 0.9523640202582139
Energy: 1.0114909363684683
Energy: 1.0052548367800678
Energy: 0.9982899189758407
Energy: 1.0270998855479923
Energy: 1.0052493286436899
Energy: 0.9982879284157846
Energy: 1.0270998855417757
Energy: 1.0052548367800678
Energy: 0.9982899189737686
Energy: 1.02709988554592
Energy: 1.0052493286436899
Energy: 0.9568972137851165
Energy: 0.9592630187407165
Energy: 0.9376495199449435
Energy: 0.9568972137788999
Energy: 0.9592630187407165
Energy: 0.9376495199429089
Energy: 0.9568972137830442
Energy: 0.9592630187386445
Energy: 0.9376495199449435
Energy: 0.9568972137788999
Energy: 1.0397203420384244
Energy: 1.010008020414541
Energy: 1.010221170806093
Energy: 1.0397203420342802
Energy: 1.010008020418685
Energy: 1.010221170806093
Energy: 1.0397203420363523
Energy: 1.010008020414541
Energy: 1.0102211708040207
Energy: 1.0397203420342802
Energy: 0.9716653895707236
Energy: 1.0379553291254393
Energy: 1.0199487634468454
Energy: 0.9722004755318334
Energy: 1.0379553291275114
Energy: 1.0199487634468454
Energy: 0.9716653895707236
Energy: 1.0379553291254393
Energy: 1.0199487634468454
Energy: 0.9722004755318334
Energy: 1.0310727380956821
Energy: 0.942103478970736
Energy: 1.0207330815884472
Energy: 1.0310727381060052
Energy: 0.9421034789665917
Energy: 1.0207330815863753
Energy: 1.0310727380956821
Energy: 0.942103478970736
Energy: 1.0207330815863753
Energy: 1.0310727381060052
Energy: 0.9913377706095516
Energy: 0.9738231870174943
Energy: 1.1286864283618747
Energy: 0.9913377706136961
Energy: 0.9738231870216386
Energy: 1.1286864283577303
Energy: 0.9913377706095516
Energy: 0.97382318701335
Energy: 1.1286864283618747
Energy: 0.9913377706136961
Energy: 1.0153376400176923
Energy: 0.944670702339985
Energy: 1.0089373764081
Energy: 1.01425559043711
Energy: 0.9439474991852912
Energy: 1.0089373764081
Energy: 1.0153376400176923
Energy: 0.9446707023420573
Energy: 1.0089373764081
Energy: 1.0142555904350379
Energy: 0.9766186528355445
Energy: 0.9515787305726239
Energy: 1.0491603738313127
Energy: 0.9766186528355445
Energy: 0.951578730574696
Energy: 1.0491603738313127
Energy: 0.9766186528376166
Energy: 0.9515787305726239
Energy: 1.049160373833385
Energy: 0.9766186528334724
Energy: 1.0189199878981177
Energy: 1.049795538197867
Energy: 0.966130027004081
Energy: 1.0189199878919013
Energy: 1.049795538199939
Energy: 0.9663262189994498
Energy: 1.0189199878960453
Energy: 1.049795538199939
Energy: 0.966130027004081
Energy: 1.0189199878919013
Energy: 0.9432325490236549
Energy: 1.0471410841884994
Energy: 1.0862575153594352
Energy: 0.9432325490257272
Energy: 1.0471410841802105
Energy: 1.0862575153718306
Energy: 0.9432325490257272
Energy: 1.0471410841884994
Energy: 1.0862575153615075
Energy: 0.9432325490257272
Energy: 1.0094611978672672
Energy: 1.0797444553651523
Energy: 0.9934422260300436
Energy: 0.9744595388989498
Energy: 1.0797444553651523
Energy: 0.993442226034188
Energy: 1.0094611978672672
Energy: 1.0797444553672244
Energy: 0.9934422260300436
Energy: 0.9744595388989498
Energy: 1.0096973812240724
Energy: 0.9626161832814925
Energy: 1.0644102857253868
Energy: 0.9746007546834456
Energy: 0.9626161832835646
Energy: 1.0707582657344088
Energy: 1.0096973812240724
Energy: 0.9626161832835646
Energy: 1.0644102857233146
Energy: 0.9746007546834456
Energy: 0.9434028959463091
Energy: 1.0371722291315713
Energy: 0.9795817616620816
Energy: 0.9434028959483813
Energy: 1.0371722291315713
Energy: 0.9795817616641537
Energy: 0.9434028959463091
Energy: 1.0371722291336432
Energy: 0.9795817616579373
Energy: 0.9434028959483813
Energy: 0.9553061064964972
Energy: 0.9678683115583382
Energy: 0.9560337079316512
Energy: 0.9553061064964972
Energy: 0.9678683115645548
Energy: 0.9560337079337233
Energy: 0.9553061064964972
Energy: 0.9678683115583382
Energy: 0.9560337079337233
Energy: 0.955306106494425
Energy: 0.9768793360913317
Energy: 1.0861547621537244
Energy: 0.9451993080235699
Energy: 0.9768793360934039
Energy: 1.0861547621557965
Energy: 0.9452448549072624
Energy: 0.9768793360934039
Energy: 1.0861547621578689
Energy: 0.9451993080235699
Energy: 0.9768793360954761
Energy: 1.1135272645025314
Energy: 1.0244756596655222
Energy: 0.9472931083507153
Energy: 1.1135272645025314
Energy: 1.0244756596717386
Energy: 0.9472931083424266
Energy: 1.1135272645025314
Energy: 1.0244756596675944
Energy: 0.9472931083507153
Energy: 1.1135272645004592
Energy: 0.957789943789081
Energy: 1.091257756676517
Energy: 0.9736519453932913
Energy: 0.9577899437870089
Energy: 1.0912577566723725
Energy: 0.9736519453870749
Energy: 0.9577899437870089
Energy: 1.0912577566744446
Energy: 0.973651945389147
Energy: 0.957789943789081
Energy: 1.084187293074504
Energy: 1.024050797908658
Energy: 0.9435848356633109
Energy: 1.084187293072432
Energy: 1.0240507979148745
Energy: 0.9435848356612386
Energy: 1.084187293074504
Energy: 1.0240507979107303
Energy: 0.9435848356633109
Energy: 1.084187293072432
Energy: 0.9720635588174348
Energy: 1.0338877484684434
Energy: 1.0101405582341112
Energy: 0.972063558821579
Energy: 1.033887748464299
Energy: 1.0101405582403276
Energy: 0.9720635588153627
Energy: 1.0338877484705156
Energy: 1.0101405582361833
Energy: 0.9720635588195069
Energy: 1.0604920152868533
Energy: 0.9765173107494521
Energy: 0.9756366323004747
Energy: 1.0604920153407296
Energy: 0.97651731074738
Energy: 0.9756366323004747
Energy: 1.0604920153055029
Energy: 0.9765173107494521
Energy: 0.9756366323025468
Energy: 1.06049201532208
Energy: 0.9484095003362073
Energy: 0.9406860476050909
Energy: 1.0303065564071436
Energy: 0.9484095003362073
Energy: 0.9406860476050909
Energy: 1.0303065564092158
Energy: 0.9484095003362073
Energy: 0.9406860476050909
Energy: 1.0303065564050717
Energy: 0.9484095003362073
Energy: 0.9986393819277436
Energy: 1.0394238946625467
Energy: 0.9983236187519459
Energy: 0.9986393819318882
Energy: 1.0394238946604746
Energy: 0.9983236187560901
Energy: 0.998639381929816
Energy: 1.0394238946604746
Energy: 0.9983236187519459
Energy: 0.9986393819318882
Energy: 0.9772207393536454
Energy: 0.9473470988931477
Energy: 0.9982117671183134
Energy: 0.9772207393536454
Energy: 0.9473519138451896
Energy: 0.9982117671141689
Energy: 0.9772207393495012
Energy: 0.9473470988910753
Energy: 0.9982117671224576
Energy: 0.9772207393536454
Energy: 0.9763311033913478
Energy: 0.9692876406711911
Energy: 1.082834258259761
Energy: 0.9763311033934201
Energy: 0.9692876406711911
Energy: 1.082834258259761
Energy: 0.9763311033913478
Energy: 0.9692876406711911
Energy: 1.082834258259761
Energy: 0.9763311033954923
Energy: 0.9677006774618772
Energy: 0.9849411385242308
Energy: 0.9619421379501782
Energy: 0.9677006774618772
Energy: 0.9849411385221587
Energy: 0.9622350026712548
Energy: 0.9677006774618772
Energy: 0.9849411385242308
Energy: 0.9619421379522504
Energy: 0.9677006774618772
Energy: 0.9432768044326146
Energy: 0.9879364806590785
Energy: 1.0938177119726091
Energy: 0.943276804426398
Energy: 0.9879364806611506
Energy: 1.093817711968465
Energy: 0.9432768044326146
Energy: 0.9879364806590785
Energy: 1.0938177119726091
Energy: 0.943276804426398
Energy: 0.9737879412566739
Energy: 1.0774775335802402
Energy: 0.9568584810312255
Energy: 1.0092979570579985
Energy: 1.077477533578168
Energy: 0.9568584810312255
Energy: 0.9737879412546019
Energy: 1.0774775335802402
Energy: 0.9568584810312255
Energy: 1.0092979570559264

minimum gb energy = 0.9376495199429089 eV
minimum distance =  2.25217563719422 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 0.9099163725297257
Energy: 0.921130154945043
Energy: 0.9214181234831176
Energy: 0.9099163725297257
Energy: 0.9211301549465529
Energy: 0.9214181234853824
Energy: 0.9099163725297257
Energy: 0.921130154945043
Energy: 0.9214181234846274
Energy: 0.9099163725297257
Energy: 0.9332574319366574
Energy: 0.8878462602183798
Energy: 0.9013388122726824
Energy: 0.9332574319374123
Energy: 0.8878462602206444
Energy: 0.9013388122719276
Energy: 0.9332574319396771
Energy: 0.8878462602191346
Energy: 0.9013388122726824
Energy: 0.9332574319389222
Energy: 1.0069042232951453
Energy: 0.8797056009678504
Energy: 1.089797679358461
Energy: 1.0124848538384863
Energy: 0.8797056009693602
Energy: 1.0897976890224912
Energy: 1.0069042232951453
Energy: 0.8797056009678504
Energy: 1.089797673364771
Energy: 1.0069042232981649
Energy: 1.0003569470236116
Energy: 1.0049269735097728
Energy: 0.9353076358666542
Energy: 1.000356947021347
Energy: 1.0049269735233615
Energy: 0.9353076358643894
Energy: 1.0003569470236116
Energy: 1.0049269735120376
Energy: 0.9353076358666542
Energy: 1.000356947021347
Energy: 0.9350321315611873
Energy: 0.8970345669017538
Energy: 0.9848811622726469
Energy: 0.9350321315611873
Energy: 0.8970345669025086
Energy: 0.9848811622718919
Energy: 0.9350321315619423
Energy: 0.8970345669017538
Energy: 0.9848811622726469
Energy: 0.9350321315611873
Energy: 0.9353229607004223
Energy: 1.0359852220799852
Energy: 0.887640965865927
Energy: 0.9353229607004223
Energy: 1.035985222078475
Energy: 0.8876409658636621
Energy: 0.9353229607004223
Energy: 1.0359852220799852
Energy: 0.887640965865927
Energy: 0.9353229607004223
Energy: 0.9329968231080581
Energy: 0.9085933668993569
Energy: 0.8795195857832167
Energy: 0.9329968231073033
Energy: 0.9085933668993569
Energy: 0.8795195857854815
Energy: 0.9329968231110778
Energy: 0.9085933669001118
Energy: 0.8795195857839716
Energy: 0.9329968231065482
Energy: 0.9202266563773852
Energy: 1.0548790078129235
Energy: 0.8934701854570505
Energy: 0.9202266563788951
Energy: 1.054879007810659
Energy: 0.8934701854593152
Energy: 0.9202266563773852
Energy: 1.0548790078121688
Energy: 0.8934701854570505
Energy: 0.9202266563796501
Energy: 1.031297316661336
Energy: 0.8980647741361171
Energy: 0.8968138305829361
Energy: 1.0312973166628456
Energy: 0.8980647741353621
Energy: 0.8968138305829361
Energy: 1.031297316659826
Energy: 0.8980647741361171
Energy: 0.8968138305829361
Energy: 1.0312973166650763
Energy: 0.9990581220099028
Energy: 0.9211335035134629
Energy: 0.9957888508345508
Energy: 0.999058122007638
Energy: 0.9211335035119531
Energy: 0.9957993596338474
Energy: 0.9990581220091479
Energy: 0.9211335035134629
Energy: 0.9957887305748849
Energy: 0.9990581220068832
Energy: 0.9760182691203102
Energy: 0.885698397594921
Energy: 0.9198329706327217
Energy: 0.9760182691232956
Energy: 0.8856983975934112
Energy: 0.9198329706319668
Energy: 0.9760182691225749
Energy: 0.885698397594166
Energy: 0.9198329706334767
Energy: 0.9760182691225749
Energy: 0.9300294668537884
Energy: 0.8911683796013364
Energy: 0.8917676139966004
Energy: 0.9300294668530334
Energy: 0.8911683796013364
Energy: 0.8917676139958456
Energy: 0.9300294668537884
Energy: 0.8911683796013364
Energy: 0.8917676139950906
Energy: 0.9300294668530334
Energy: 0.8969808786066368
Energy: 1.0690060003186364
Energy: 0.8969569705448444
Energy: 0.8969808786058819
Energy: 1.0690060003186364
Energy: 0.8969569705440894
Energy: 0.8969808786066368
Energy: 1.0690060003193915
Energy: 0.8969569705448444
Energy: 0.8969808786066368
Energy: 0.901625176327874
Energy: 0.8891361445549701
Energy: 0.8957397744247387
Energy: 0.9016251763308937
Energy: 0.8891361445534604
Energy: 0.8957397744247387
Energy: 0.9016251763286289
Energy: 0.8891361445557251
Energy: 0.8957397744247387
Energy: 0.9016251763301388

minimum gb energy = 0.8795195857832167 eV
minimum distance =  2.29240863799714 Angstroms
sigma value = 33