Model name: model_name=EAM_Dynamo_MendelevHanSrolovitz_2003Potential5_Fe__MO_942420706858_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855258293449879
cohesive_energy=4.134425479783591
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.0 eV

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

Energy: 0.012807621035531017
Energy: 0.013095601082537451
Energy: 0.43189956296429927
Energy: 0.013095586371573742
Energy: 0.012807621035531017
Energy: 0.01309560317457225
Energy: 0.013095601400917286
Energy: 2.7669198222202533
Energy: 0.013095593751618322
Energy: 2.38275499773141
Energy: 0.013095628336800896
Energy: 2.38275499773532
Energy: 0.4318995629648019
Energy: 0.013095581431407894
Energy: 0.012807621035531017
Energy: 0.013095580123034339
Energy: 0.4318995629638245
Energy: 0.013095603837835644
Energy: 0.013095601114961924
Energy: 2.3827549977348457
Energy: 0.013095584935457259
Energy: 2.382754997731885
Energy: 0.013095623628521697
Energy: 2.805540772979355
Energy: 0.012807621035531017
Energy: 0.013095640355360396
Energy: 0.4318995629628191
Energy: 0.013095621435778328
Energy: 0.012807621035028312
Energy: 0.013095616189018286
Energy: 0.013095618338026319
Energy: 2.3827549977294273
Energy: 0.013095613564423394
Energy: 2.8055407729813098
Energy: 0.01309563058850039
Energy: 2.3827549977343425

minimum gb energy = 0.012807621035028312 eV
minimum distance =  2.21450986364999 Angstroms
sigma value = 1


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

Energy: 1.3321583187309796
Energy: 1.3788663043017455
Energy: 1.2724443572614579
Energy: 1.3788663043017455
Energy: 1.3321583187333996
Energy: 1.3788663043017455
Energy: 1.3642226985486574
Energy: 1.3451429092452238
Energy: 1.363167055090348
Energy: 1.3451429092440137
Energy: 1.3642226985486574
Energy: 1.3451429092452238
Energy: 1.1919595540727101
Energy: 1.3467992544516851
Energy: 1.3248675086294812
Energy: 1.346799254452895
Energy: 1.19195955407392
Energy: 1.3467992544516851
Energy: 1.353534881572069
Energy: 1.3207546965560755
Energy: 1.2881059978891474
Energy: 1.3207546965609156
Energy: 1.353534881573279
Energy: 1.3207546965633357
Energy: 1.3532849051721987
Energy: 1.3700167022503529
Energy: 1.3177768319006118
Energy: 1.3700167022503529
Energy: 1.353284905177039
Energy: 1.3700167022503529
Energy: 1.3246343077497427
Energy: 1.3448577400812236
Energy: 1.1985527496487178
Energy: 1.3448577400788033
Energy: 1.3246343077485325
Energy: 1.3448577400788033
Energy: 1.3247313393246305
Energy: 1.3457169901524484
Energy: 1.1987206457315704
Energy: 1.3457169901548687
Energy: 1.3247313393246305
Energy: 1.3457169901548687
Energy: 1.3752578577670815
Energy: 1.3719889247935417
Energy: 1.191023626339409
Energy: 1.3719889247947519
Energy: 1.3752578577658712
Energy: 1.3719889247959618
Energy: 1.3764635740415412
Energy: 1.3133017707838597
Energy: 1.2866265954036002
Energy: 1.3133017707838597
Energy: 1.376463574040331
Energy: 1.3133017707814394
Energy: 1.3269319570872842
Energy: 1.3447070316397758
Energy: 1.199454609391956
Energy: 1.3447070316409857
Energy: 1.3269319570872842
Energy: 1.3447070316421958
Energy: 1.3719893839372979
Energy: 1.3202705096839775
Energy: 1.3625341060092584
Energy: 1.3202705096839775
Energy: 1.3719893839372979
Energy: 1.3202705096851874
Energy: 1.1925730250051778
Energy: 1.371011236089364
Energy: 1.1928168137357464
Energy: 1.371011236086944
Energy: 1.1925730250039674
Energy: 1.371011236086944
Energy: 1.3624862687645063
Energy: 1.3202705096827674
Energy: 1.2946399755114677
Energy: 1.3202705096876077
Energy: 1.3624862687657162
Energy: 1.3202705096815575
Energy: 1.1994510586052105
Energy: 1.3447485065403233
Energy: 1.3269339319390554
Energy: 1.3447485065403233
Energy: 1.1994510586052105
Energy: 1.3447485065403233
Energy: 1.2861594632142639
Energy: 1.3136961101865114
Energy: 1.3763640047177481
Energy: 1.3136961101611548
Energy: 1.2861594632142639
Energy: 1.3136961101430038
Energy: 1.1909985053742378
Energy: 1.3720487021847108
Energy: 1.37574198166035
Energy: 1.3720487021835008
Energy: 1.1909985053718175
Energy: 1.3720487021835008
Energy: 1.1986894326879864
Energy: 1.3454081557049846
Energy: 1.3247177964399128
Energy: 1.3454081557049846
Energy: 1.1986894326867765
Energy: 1.3454081557049846
Energy: 1.1988262865898245
Energy: 1.3448740249980788
Energy: 1.3247711743989246
Energy: 1.3448740249992888
Energy: 1.1988262865886143
Energy: 1.3448740249980788
Energy: 1.35290582410543
Energy: 1.369938989709177
Energy: 1.3531033390377778
Energy: 1.3699389897079668
Energy: 1.3529058241066398
Energy: 1.3699389897079668
Energy: 1.2880114761979446
Energy: 1.318473759114702
Energy: 1.3530526324535588
Energy: 1.3184737591280131
Energy: 1.2880114761979446
Energy: 1.3184737591159124
Energy: 1.324852259632388
Energy: 1.346837666823423
Energy: 1.19195675793559
Energy: 1.346837666823423
Energy: 1.3248522596335983
Energy: 1.346837666823423
Energy: 1.3631268043507534
Energy: 1.3452400301527252
Energy: 1.3640945914253906
Energy: 1.3452400301539356
Energy: 1.3631268043507534
Energy: 1.3452400301539356
Energy: 1.3276632008670648
Energy: 1.3788663043005356
Energy: 1.3321583187297692
Energy: 1.3788663042993254
Energy: 1.3276632008670648
Energy: 1.3788663043005356

minimum gb energy = 1.1909985053718175 eV
minimum distance =  2.21225916242964 Angstroms
sigma value = 33


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

Energy: 1.739873458881236
Energy: 1.4487152950193085
Energy: 1.2942823622409227
Energy: 1.4487152950199966
Energy: 1.739873458881236
Energy: 1.4487152950199966
Energy: 1.3828903447609178
Energy: 1.4083944637209633
Energy: 1.3556395886238684
Energy: 1.4083944637237167
Energy: 1.382890344765736
Energy: 1.4083944637237167
Energy: 1.2383948178143271
Energy: 1.4416771359664686
Energy: 1.433133398045284
Energy: 1.44167713596578
Energy: 1.2383948178170803
Energy: 1.44167713596578
Energy: 1.3352139117270068
Energy: 1.3967617113028203
Energy: 1.504011571500513
Energy: 1.3967617113035087
Energy: 1.335213911722877
Energy: 1.3967617113028203
Energy: 1.3351714036322768
Energy: 1.4199951914332956
Energy: 1.4565686027073814
Energy: 1.4199951914332956
Energy: 1.3351714036329652
Energy: 1.4199951914332956
Energy: 1.351293604634783
Energy: 1.4194290721608218
Energy: 1.2476768616302714
Energy: 1.4194290721601335
Energy: 1.3512936046361594
Energy: 1.4194290721587568
Energy: 1.3512279514839998
Energy: 1.419172500587699
Energy: 1.3638881844435995
Energy: 1.4191725005856342
Energy: 1.351227951484688
Energy: 1.4191725005863225
Energy: 1.274922895569985
Energy: 1.4207795664766614
Energy: 1.3960623364894318
Energy: 1.4207795664766614
Energy: 1.27492289557205
Energy: 1.420779566475973
Energy: 1.3728673429704268
Energy: 1.3870790269792177
Energy: 1.3512252573361108
Energy: 1.3870790269771527
Energy: 1.3728673429724914
Energy: 1.3870790269881652
Energy: 1.3043614633490896
Energy: 1.4418316303331071
Energy: 1.3108098590416188
Energy: 1.4418316303317305
Energy: 1.3043614633490896
Energy: 1.4418316303317305
Energy: 1.3081092636847989
Energy: 1.4101988965307592
Energy: 1.444202995636607
Energy: 1.4101988965348888
Energy: 1.3081092636841105
Energy: 1.4101988965342005
Energy: 1.4329778477637571
Energy: 1.4217731591565095
Energy: 1.3059827944599502
Energy: 1.4217731591571976
Energy: 1.4329778477623807
Energy: 1.4217731591578862
Energy: 1.4909943790141493
Energy: 1.3966944309408251
Energy: 1.3090160022781332
Energy: 1.3966944299907105
Energy: 1.4909943790162143
Energy: 1.3966944309291243
Energy: 1.3758456205360847
Energy: 1.4413249985119754
Energy: 1.3624993092444941
Energy: 1.4413249985119754
Energy: 1.3758456205360847
Energy: 1.4413249985119754
Energy: 1.4332205800337579
Energy: 1.4250887997970556
Energy: 1.440010869984917
Energy: 1.4250887997970556
Energy: 1.4332205800337579
Energy: 1.4250887997970556
Energy: 1.4331498642181293
Energy: 1.427467844345389
Energy: 1.3061434969406518
Energy: 1.427467844344701
Energy: 1.4331498642181293
Energy: 1.4274678443440125
Energy: 1.4501339830613014
Energy: 1.4198345226498368
Energy: 1.3104214405596057
Energy: 1.4198345226505253
Energy: 1.4501339990224105
Energy: 1.4198345226505253
Energy: 1.4478731276572114
Energy: 1.4136626044679823
Energy: 1.444202264902544
Energy: 1.4136626044666056
Energy: 1.4478731276578998
Energy: 1.4136626044666056
Energy: 1.2478730711424357
Energy: 1.4214338069409231
Energy: 1.3961325298982434
Energy: 1.421433806940235
Energy: 1.2478730711438124
Energy: 1.421433806940235
Energy: 1.3810073892342913
Energy: 1.3879696480807395
Energy: 1.4430683547739982
Energy: 1.3879696480669736
Energy: 1.3810073892280967
Energy: 1.3879696481171873
Energy: 1.432070047527815
Energy: 1.4418264822287898
Energy: 1.2955483006640354
Energy: 1.4418264822281015
Energy: 1.4320700475285033
Energy: 1.4418264822281015
Energy: 1.3086196467678564
Energy: 1.4094077731464714
Energy: 1.4877736722577974
Energy: 1.4094077731444068
Energy: 1.3086196467685447
Energy: 1.4094077731437185
Energy: 1.3103263767573696
Energy: 1.4211962795954474
Energy: 1.4123726195536692
Energy: 1.4211962795947592
Energy: 1.3103263767594344
Energy: 1.4211962795947592
Energy: 1.5305229868174144
Energy: 1.4085890359798063
Energy: 1.3542431598585425
Energy: 1.4085890359798063
Energy: 1.530522986816038
Energy: 1.4085890359804947
Energy: 1.3571162727568307
Energy: 1.4197774101590495
Energy: 1.4337489064364173
Energy: 1.419777410159738
Energy: 1.357116272767124
Energy: 1.4197774101590495
Energy: 1.3616712532377537
Energy: 1.4402097765302608
Energy: 1.3245041394781174
Energy: 1.4402097765316373
Energy: 1.3616712532370656
Energy: 1.4402097765316373
Energy: 1.3617952251356091
Energy: 1.4402230449515319
Energy: 1.2696669989244131
Energy: 1.4402230449515319
Energy: 1.361795225131479
Energy: 1.44022304495222
Energy: 1.352840371007617
Energy: 1.4198013042973723
Energy: 1.4334146385185358
Energy: 1.4198013042973723
Energy: 1.3528403710427193
Energy: 1.4198013042973723
Energy: 1.526703835720257
Energy: 1.40852550287808
Energy: 1.3543617867778337
Energy: 1.4085255028787684
Energy: 1.5267038357209453
Energy: 1.4085255028787684
Energy: 1.3103987923340756
Energy: 1.4212086803412605
Energy: 1.3729440254016672
Energy: 1.4212086803419486
Energy: 1.3103987923326992
Energy: 1.4212086803419486
Energy: 1.308641795173642
Energy: 1.409407773155419
Energy: 1.5108679653320582
Energy: 1.4094077731561074
Energy: 1.3086417951757068
Energy: 1.4094077731561074
Energy: 1.4322647759049865
Energy: 1.4418271482017764
Energy: 1.2959474894784038
Energy: 1.4418271482003997
Energy: 1.4322647759056746
Energy: 1.4418271481997114
Energy: 1.3821670171404221
Energy: 1.3870974603327786
Energy: 1.4442955338043248
Energy: 1.3870974603375967
Energy: 1.3821670170640536
Energy: 1.3870974603451678
Energy: 1.2478836283621813
Energy: 1.4213497621824698
Energy: 1.3518441781441988
Energy: 1.4213497621838467
Energy: 1.2478836283635577
Energy: 1.4213497621838467
Energy: 1.447093260642086
Energy: 1.4136544556294695
Energy: 1.5118938919410312
Energy: 1.4136544556294695
Energy: 1.447093260639333
Energy: 1.4136544556301578
Energy: 1.4901786233625738
Energy: 1.4199942907045475
Energy: 1.3103391921779162
Energy: 1.4199942907038594
Energy: 1.4901786233804692
Energy: 1.4199942907038594
Energy: 1.4338374746682572
Energy: 1.4258355768875588
Energy: 1.280920158085231
Energy: 1.4258355768875588
Energy: 1.4338374746235498
Energy: 1.4258355768882471
Energy: 1.4333959081903798
Energy: 1.4250332617952277
Energy: 1.4526164629759877
Energy: 1.4250332617945392
Energy: 1.4333959081917562
Energy: 1.4250332617952277
Energy: 1.3765476138281583
Energy: 1.441311290050136
Energy: 1.362575051445061
Energy: 1.441311290050824
Energy: 1.3765476138412356
Energy: 1.4413112900515122
Energy: 1.4912694875966428
Energy: 1.3975535645517416
Energy: 1.3091712852459547
Energy: 1.3975535644808799
Energy: 1.4912694874473476
Energy: 1.3975535645992023
Energy: 1.4330942658997625
Energy: 1.4217737464074351
Energy: 1.2808148197436358
Energy: 1.4217737464060585
Energy: 1.433094265898386
Energy: 1.4217737464067466

minimum gb energy = 1.2383948178143271 eV
minimum distance =  2.2104647045336 Angstroms
sigma value = 51


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

Energy: 1.5184880913336563
Energy: 1.4689649941757836
Energy: 1.3090343700229592
Energy: 1.4689649941757836
Energy: 1.5184880913336563
Energy: 1.468964994174189
Energy: 1.3587934393259298
Energy: 1.4973342153409797
Energy: 1.5800469363104266
Energy: 1.4973342269886072
Energy: 1.358793439324335
Energy: 1.4973342064398678
Energy: 1.250326045701067
Energy: 1.4692309081451382
Energy: 1.6035670555244994
Energy: 1.4692309081451382
Energy: 1.250326045702662
Energy: 1.4692309081451382
Energy: 1.2631584840492107
Energy: 1.4045644946373788
Energy: 1.6575607608907785
Energy: 1.404564494634189
Energy: 1.263158484047616
Energy: 1.404564494634189
Energy: 1.2620426318630458
Energy: 1.4048379945449987
Energy: 1.6061602498028844
Energy: 1.4048379945481881
Energy: 1.2620426318646405
Energy: 1.4048379945481881
Energy: 1.5182489446360572
Energy: 1.4044620451859418
Energy: 1.618834155298578
Energy: 1.404462045184347
Energy: 1.5182489446360572
Energy: 1.4044620451859418
Energy: 1.518987978846282
Energy: 1.4061247281842306
Energy: 1.5988340020342597
Energy: 1.4061247281842306
Energy: 1.5189879788430922
Energy: 1.4061247281842306
Energy: 1.2636138125688572
Energy: 1.4049969072886024
Energy: 1.2350754934433443
Energy: 1.404996907290197
Energy: 1.2636138125688572
Energy: 1.4049969072870077
Energy: 1.519672620177623
Energy: 1.420977068180357
Energy: 1.2667514898365437
Energy: 1.420977068180357
Energy: 1.5196726201855966
Energy: 1.4209770681819156
Energy: 1.2500698398208863
Energy: 1.482834862431491
Energy: 1.2351015756118917
Energy: 1.4828348624346808
Energy: 1.250069839817697
Energy: 1.4828348624346808
Energy: 1.5849926413391726
Energy: 1.4054380516886436
Energy: 1.579302323110157
Energy: 1.4054380516886436
Energy: 1.584992641337578
Energy: 1.4054380516886436
Energy: 1.5194708457058645
Energy: 1.4691733636169173
Energy: 1.6317217434706062
Energy: 1.4691733636185123
Energy: 1.519470845702675
Energy: 1.4691733636185123
Energy: 1.3932271803093064
Energy: 1.4172300454221176
Energy: 1.5783717829221693
Energy: 1.4172300454205229
Energy: 1.3932271803109013
Energy: 1.4172300454205229
Energy: 1.2502061583235686
Energy: 1.4691348436947733
Energy: 1.5790589535951258
Energy: 1.4691348436963678
Energy: 1.2502061583251636
Energy: 1.4691348436979628
Energy: 1.2500464269632672
Energy: 1.4694193017330976
Energy: 1.5795203886580853
Energy: 1.4694193017330976
Energy: 1.2500464269632672
Energy: 1.4694193017330976
Energy: 1.26198454468279
Energy: 1.405137432740086
Energy: 1.616455764581088
Energy: 1.405137432741681
Energy: 1.26198454468279
Energy: 1.4051374327432755
Energy: 1.5182164933287257
Energy: 1.4694416308408722
Energy: 1.6235718448829437
Energy: 1.4694416308392773
Energy: 1.5182164933287257
Energy: 1.4694416308392773
Energy: 1.5185345223475148
Energy: 1.4052692947409102
Energy: 1.5800401884584263
Energy: 1.4052692947456944
Energy: 1.5185345223666518
Energy: 1.4052692947472891

minimum gb energy = 1.2350754934433443 eV
minimum distance =  2.17766774956841 Angstroms
sigma value = 19


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

Energy: 1.6268254972726621
Energy: 1.5357871614419452
Energy: 1.3649572706536752
Energy: 1.5357871614428913
Energy: 1.6268254972736078
Energy: 1.5357871614428913
Energy: 1.3310013809877723
Energy: 1.5366807193032361
Energy: 1.4886091052510468
Energy: 1.53668071930229
Energy: 1.3310013809887178
Energy: 1.5366807193003982
Energy: 1.299787357909891
Energy: 1.530023985038814
Energy: 1.5044125443574932
Energy: 1.5300239850397601
Energy: 1.299787357909891
Energy: 1.5300239850397601
Energy: 1.4116026780710635
Energy: 1.5223453136203111
Energy: 1.4651136263687323
Energy: 1.5223453136174734
Energy: 1.4116026780720095
Energy: 1.5223453136146354
Energy: 1.3441409771505313
Energy: 1.5425402240359214
Energy: 1.6003519240175001
Energy: 1.5425402240349753
Energy: 1.3441409771514772
Energy: 1.5425402240349753
Energy: 1.6014598565260143
Energy: 1.5427222774045979
Energy: 1.3440500003900733
Energy: 1.5427222774036518
Energy: 1.6014598565250684
Energy: 1.5427222774036518
Energy: 1.4639738892710192
Energy: 1.5234484924555907
Energy: 1.3942921555948216
Energy: 1.5234484924546448
Energy: 1.4639738893646261
Energy: 1.5234484924546448
Energy: 1.4652343956028806
Energy: 1.5310428125241362
Energy: 1.2997646487249874
Energy: 1.5310428125241362
Energy: 1.4652343956161242
Energy: 1.5310428125241362
Energy: 1.4520623664892414
Energy: 1.535305408569882
Energy: 1.3416584156907188
Energy: 1.5353054085831253
Energy: 1.4520623664892414
Energy: 1.5353054085717737
Energy: 1.380774878502066
Energy: 1.5357871614428913
Energy: 1.6268254972726621
Energy: 1.5357871614419452
Energy: 1.38077487850112
Energy: 1.5357871614428913
Energy: 1.4886091051943113
Energy: 1.5366807192966143
Energy: 1.343065255241916
Energy: 1.5366807193041818
Energy: 1.4886091051810892
Energy: 1.5366807192985061
Energy: 1.5044125443574932
Energy: 1.5300239850397601
Energy: 1.299787357910837
Energy: 1.5300239850407058
Energy: 1.5044125443574932
Energy: 1.5300239850407058
Energy: 1.465113626358327
Energy: 1.522345313623149
Energy: 1.3237491430834982
Energy: 1.5223453136250409
Energy: 1.4651136263535973
Energy: 1.522345313619365
Energy: 1.6472957657715135
Energy: 1.5425402240359214
Energy: 1.344140977154315
Energy: 1.5425402240349753
Energy: 1.6472957657724594
Energy: 1.5425402240349753
Energy: 1.3440500003919653
Energy: 1.5427222774055438
Energy: 1.6014598565241225
Energy: 1.5427222774055438
Energy: 1.3440500003929112
Energy: 1.5427222774045979
Energy: 1.3942921555929297
Energy: 1.5234484924536988
Energy: 1.4639738901002581
Energy: 1.5234484924555907
Energy: 1.3942921555929297
Energy: 1.5234484924555907
Energy: 1.2997646487268792
Energy: 1.5310428125241362
Energy: 1.4652343951972373
Energy: 1.5310428125241362
Energy: 1.2997646487268792
Energy: 1.5310428125241362
Energy: 1.3416584156926108
Energy: 1.535305408590693
Energy: 1.452062366492079
Energy: 1.5353054085954227
Energy: 1.3416584156916647
Energy: 1.5353054085916389
Energy: 1.6268254972736078
Energy: 1.5357871614428913
Energy: 1.38077487850112
Energy: 1.5357871614419452
Energy: 1.6268254972736078
Energy: 1.5357871614419452
Energy: 1.34306525524097
Energy: 1.536680719299452
Energy: 1.4886091051073262
Energy: 1.53668071930229
Energy: 1.34306525524097
Energy: 1.53668071930229
Energy: 1.299787357910837
Energy: 1.5300239850397601
Energy: 1.5044125443574932
Energy: 1.5300239850397601
Energy: 1.299787357909891
Energy: 1.5300239850397601
Energy: 1.3237491430834982
Energy: 1.5223453136212572
Energy: 1.4651136263526512
Energy: 1.5223453136250409
Energy: 1.3237491430834982
Energy: 1.522345313623149
Energy: 1.3441409771495851
Energy: 1.5425402240359214
Energy: 1.6472957657715135
Energy: 1.5425402240359214
Energy: 1.3441409771524233
Energy: 1.5425402240368673
Energy: 1.5522420074902956
Energy: 1.5427222774036518
Energy: 1.3440500003919653
Energy: 1.5427222774045979
Energy: 1.552242007486512
Energy: 1.5427222774045979
Energy: 1.4639738890885143
Energy: 1.5234484924555907
Energy: 1.3942921555919838
Energy: 1.5234484924565368
Energy: 1.4639738893173495
Energy: 1.5234484924555907
Energy: 1.4652343952435676
Energy: 1.531042812525082
Energy: 1.2997646487249874
Energy: 1.531042812525082
Energy: 1.465234395109306
Energy: 1.531042812525082
Energy: 1.4520623664882952
Energy: 1.5353054085793416
Energy: 1.341658415689773
Energy: 1.5353054085925848
Energy: 1.452062366487349
Energy: 1.5353054085812332
Energy: 1.380774878506796
Energy: 1.5357871614419452
Energy: 1.6268254972726621
Energy: 1.5357871614428913
Energy: 1.3807748785058498
Energy: 1.5357871614428913
Energy: 1.4886091050628876
Energy: 1.5366807193070198
Energy: 1.343065255241916
Energy: 1.5366807193032361
Energy: 1.488609105054374
Energy: 1.5366807192985061
Energy: 1.5044125443565473
Energy: 1.5300239850407058
Energy: 1.299787357910837
Energy: 1.5300239850397601
Energy: 1.5044125443565473
Energy: 1.5300239850397601

minimum gb energy = 1.2997646487249874 eV
minimum distance =  2.16918522402508 Angstroms
sigma value = 27


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

Energy: 1.2673917208014278
Energy: 1.418201692596988
Energy: 1.5692670886584539
Energy: 1.4182016925967509
Energy: 1.2673917208007168
Energy: 1.4182016925967509
Energy: 1.2582337366520278
Energy: 1.3954666344497042
Energy: 1.3046722637899817
Energy: 1.3954666344501783
Energy: 1.2582337366520278
Energy: 1.395466634449467
Energy: 1.2894357903752363
Energy: 1.5187236000192768
Energy: 1.3788231142245626
Energy: 1.5187236000204354
Energy: 1.2894357903740779
Energy: 1.518723600019988
Energy: 1.264899999730913
Energy: 1.4208081016076142
Energy: 1.2874321065974095
Energy: 1.4208081016083247
Energy: 1.2648999997304653
Energy: 1.4208081016083247
Energy: 1.303874050012802
Energy: 1.4222239132466556
Energy: 1.452211537241976
Energy: 1.4222239132468661
Energy: 1.3038740500134867
Energy: 1.4222239132468661
Energy: 1.2905106157174173
Energy: 1.5712411333626255
Energy: 1.3022353868138
Energy: 1.5712411333628622
Energy: 1.2905106157185757
Energy: 1.5712411333614669
Energy: 1.302177367871267
Energy: 1.4007410762190484
Energy: 1.2873823028425377
Energy: 1.4007410762192853
Energy: 1.3021773678698714
Energy: 1.40074107621997
Energy: 1.2646740821404623
Energy: 1.4195942507137196
Energy: 1.3056243902340765
Energy: 1.4195942507148782
Energy: 1.2646740821404623
Energy: 1.4195942507139565
Energy: 1.287550711912467
Energy: 1.4212756529348014
Energy: 1.2617906261744798
Energy: 1.4212756529357229
Energy: 1.2875507119115455
Energy: 1.421275652935486
Energy: 1.2903726750313607
Energy: 1.631161853570273
Energy: 1.2901914073777125
Energy: 1.631161853569799
Energy: 1.2903726750304125
Energy: 1.631161853570036
Energy: 1.3020292715420911
Energy: 1.4214294635791758
Energy: 1.2875080073585936
Energy: 1.4214294635798606
Energy: 1.3020292715425386
Energy: 1.4214294635803344
Energy: 1.3055895660730774
Energy: 1.4196336152147773
Energy: 1.2646465917057097
Energy: 1.4196336152143036
Energy: 1.305589566073762
Energy: 1.4196336152145406

minimum gb energy = 1.2582337366520278 eV
minimum distance =  2.20329354564403 Angstroms
sigma value = 9


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

Energy: 1.673674145326724
Energy: 1.6239304722850019
Energy: 1.4449368012599784
Energy: 1.6239304722850019
Energy: 1.6736741453286772
Energy: 1.6239304722850019
Energy: 1.4751256796283885
Energy: 1.5710039319074949
Energy: 1.40015969131603
Energy: 1.5818735115482503
Energy: 1.475125679634899
Energy: 1.5581635889327925
Energy: 1.3678456198040683
Energy: 1.5647617604162072
Energy: 1.3940539276721875
Energy: 1.5647617604155561
Energy: 1.3678456198034172
Energy: 1.5647617604175093
Energy: 1.3317341710933033
Energy: 1.5480614256603749
Energy: 1.3029497359282767
Energy: 1.5480614256681875
Energy: 1.3317341710906991
Energy: 1.5480614256616771
Energy: 1.330488387018342
Energy: 1.5458364519398098
Energy: 1.3035806409127797
Energy: 1.5458364519378565
Energy: 1.3304883870202953
Energy: 1.5458364519385077
Energy: 1.3111533971249634
Energy: 1.51740391413984
Energy: 1.3941482020053952
Energy: 1.531448259867269
Energy: 1.3111533971223592
Energy: 1.517403914148304
Energy: 1.524710990911824
Energy: 1.5729029229753053
Energy: 1.4717718298663174
Energy: 1.5729029229766072
Energy: 1.5247109909098706
Energy: 1.5729029229753053
Energy: 1.4941697525177364
Energy: 1.5456136305147503
Energy: 1.4329087683447057
Energy: 1.545613630513448
Energy: 1.4941697525190387
Energy: 1.545613630513448
Energy: 1.4742061742312438
Energy: 1.5548771008478002
Energy: 1.4622154223161934
Energy: 1.5548771008491025
Energy: 1.47420617422278
Energy: 1.5548771008491025
Energy: 1.499264655066836
Energy: 1.568358882531755
Energy: 1.3296545400728181
Energy: 1.5683588825369634
Energy: 1.499264655066185
Energy: 1.568358882531755
Energy: 1.5262251746144848
Energy: 1.5634649932876878
Energy: 1.3942921330861515
Energy: 1.5634649932896412
Energy: 1.526225174618391
Energy: 1.5634649932883389
Energy: 1.3743122425503969
Energy: 1.5798712067599376
Energy: 1.365957185444962
Energy: 1.5798712067605887
Energy: 1.3743122425497458
Energy: 1.57987120676124
Energy: 1.3153881749634966
Energy: 1.5093576434207836
Energy: 1.308372046898274
Energy: 1.5093576434930207
Energy: 1.3153881749634966
Energy: 1.509357643495625
Energy: 1.4897580321727664
Energy: 1.5902796386328886
Energy: 1.3085442040287283
Energy: 1.5902796386296334
Energy: 1.4897580321727664
Energy: 1.5902796386302844
Energy: 1.3763540998816381
Energy: 1.613860065725232
Energy: 1.418991676601908
Energy: 1.613860065727185
Energy: 1.376354099880336
Energy: 1.6138600657180704
Energy: 1.4273721333313436
Energy: 1.5434538262754798
Energy: 1.365795610214619
Energy: 1.5434538262761308
Energy: 1.4273721333306928
Energy: 1.5434538262774329
Energy: 1.4952495447938827
Energy: 1.6054682493320083
Energy: 1.397017521337704
Energy: 1.6054682495161674
Energy: 1.4952495447945338
Energy: 1.6054682483792821
Energy: 1.3648708471120328
Energy: 1.581536546914453
Energy: 1.3862605637857117
Energy: 1.5815365469138016
Energy: 1.3648708471146371
Energy: 1.5815365469124998
Energy: 1.487351377035865
Energy: 1.6171498085442653
Energy: 1.3151216595687043
Energy: 1.6171498085501246
Energy: 1.487351377035865
Energy: 1.6171498085468694
Energy: 1.3101046769605154
Energy: 1.5977806217450847
Energy: 1.3100805939882754
Energy: 1.647688026772394
Energy: 1.3101046769585623
Energy: 1.6476880267710918
Energy: 1.3151164148189398
Energy: 1.6018573586974523
Energy: 1.488607466806752
Energy: 1.6018573586994054
Energy: 1.3151164148170162
Energy: 1.6018573587007077
Energy: 1.3857944870660799
Energy: 1.5832525601772545
Energy: 1.365050598586937
Energy: 1.5832525601753014
Energy: 1.3857944870660799
Energy: 1.5832525601753014
Energy: 1.4005985757151223
Energy: 1.586727862107512
Energy: 1.4983388751354647
Energy: 1.5867278593612846
Energy: 1.4005985757105648
Energy: 1.5867278609816944
Energy: 1.3713662427216708
Energy: 1.5449869197933859
Energy: 1.4275398705194544
Energy: 1.5449869197914325
Energy: 1.371366242722973
Energy: 1.544986919795339
Energy: 1.422536836075132
Energy: 1.6135409530161675
Energy: 1.3768343092288777
Energy: 1.613540953012261
Energy: 1.4225368360692725
Energy: 1.6135409530161675
Energy: 1.3085198370503277
Energy: 1.5900476115674393
Energy: 1.4898513356701344
Energy: 1.5900476115648352
Energy: 1.3085198370659532
Energy: 1.5900476115687414
Energy: 1.308344501817511
Energy: 1.5191822357032274
Energy: 1.3154952263539113
Energy: 1.5191822357103888
Energy: 1.308344501815558
Energy: 1.5191822357045295
Energy: 1.3667645221503466
Energy: 1.5495356426842568
Energy: 1.3743723217058146
Energy: 1.5495356426783975
Energy: 1.3667645221646696
Energy: 1.5495356426810016
Energy: 1.3943441513928339
Energy: 1.5669548336627885
Energy: 1.4187415799912775
Energy: 1.5669548336653927
Energy: 1.3943441513882764
Energy: 1.5669548336666947
Energy: 1.3296515924610561
Energy: 1.567865738932453
Energy: 1.4984952528796953
Energy: 1.5678657389331043
Energy: 1.3296515924617072
Energy: 1.5678657389337554
Energy: 1.3981345004104015
Energy: 1.5548771008451958
Energy: 1.477101260447838
Energy: 1.5548771008471491
Energy: 1.3981345003928525
Energy: 1.5548771008530087
Energy: 1.4153011806306772
Energy: 1.5461322003685813
Energy: 1.4932212567299046
Energy: 1.5461322003627516
Energy: 1.415301170308271
Energy: 1.5461322003679303
Energy: 1.4701384946367853
Energy: 1.5731700182360406
Energy: 1.6678569042467322
Energy: 1.5731700182360406
Energy: 1.4701384946361344
Energy: 1.5731700182347383
Energy: 1.3979243548019182
Energy: 1.510163916424836
Energy: 1.3112163407720765
Energy: 1.5101639164196274
Energy: 1.3979243548045224
Energy: 1.5101639164202783
Energy: 1.4285737841507453
Energy: 1.5460271353408945
Energy: 1.3304894706779224
Energy: 1.5460271353376394
Energy: 1.4285737841318649
Energy: 1.5460271353382902
Energy: 1.3032874817958602
Energy: 1.548879614949546
Energy: 1.3316308765381855
Energy: 1.5488796148864235
Energy: 1.3032874817926048
Energy: 1.5488796150022517
Energy: 1.3936142395312139
Energy: 1.564464872317936
Energy: 1.3678109089709103
Energy: 1.5644648723153316
Energy: 1.3936142395286097
Energy: 1.5644648723140293
Energy: 1.3991062379727486
Energy: 1.5581635889314902
Energy: 1.474868794907033
Energy: 1.5581635889308394
Energy: 1.3991062379903272
Energy: 1.5581635889314902
Energy: 1.5504326720219213
Energy: 1.6239304722830488
Energy: 1.6736741453293282
Energy: 1.6239304722830488
Energy: 1.5504326720896011
Energy: 1.6239304722830488
Energy: 1.400159691302358
Energy: 1.581873511546948
Energy: 1.4751256796173207
Energy: 1.5818735115515055
Energy: 1.4001596912899879
Energy: 1.5818735115489013
Energy: 1.3940539276721875
Energy: 1.5647617604175093
Energy: 1.3678456198040683
Energy: 1.5647617604175093
Energy: 1.3940539276741404
Energy: 1.5647617604168582
Energy: 1.302949735929579
Energy: 1.548061425678575
Energy: 1.3317341710893968
Energy: 1.5480614256720642
Energy: 1.30294973593023
Energy: 1.5480614256740175
Energy: 1.303580640904967
Energy: 1.545836451943065
Energy: 1.3304883870202953
Energy: 1.545836451941763
Energy: 1.3035806409069202
Energy: 1.545836451941763

minimum gb energy = 1.3029497359282767 eV
minimum distance =  2.16206372739861 Angstroms
sigma value = 57


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

Energy: 1.4555731973539814
Energy: 1.5125551826492305
Energy: 1.5169405608257196
Energy: 1.5125551826507126
Energy: 1.4555731973539814
Energy: 1.5125551826507126
Energy: 1.4519003789996545
Energy: 1.5258477920867908
Energy: 1.27989527681734
Energy: 1.5258475064160222
Energy: 1.4519003789996545
Energy: 1.5258471982491477
Energy: 1.1936165902870486
Energy: 1.4750889015081037
Energy: 1.3328932032193357
Energy: 1.4750889015155138
Energy: 1.1936165902855669
Energy: 1.4750889014740172
Energy: 1.216838345968454
Energy: 1.4872014465170722
Energy: 1.219208275195973
Energy: 1.4872014466104064
Energy: 1.216838345966972
Energy: 1.4872014473006956
Energy: 1.2170434047584993
Energy: 1.509015529011812
Energy: 1.2847413966015269
Energy: 1.509015528968867
Energy: 1.2170434047584993
Energy: 1.509015529005884
Energy: 1.2170550541548366
Energy: 1.4834483473546376
Energy: 1.1931495792845912
Energy: 1.4834483473442632
Energy: 1.2170550541533545
Energy: 1.4834483473442632
Energy: 1.2169497162745406
Energy: 1.4831079653363395
Energy: 1.192275219485835
Energy: 1.4831079654133716
Energy: 1.2169497162760228
Energy: 1.4831079653704264
Energy: 1.2170420221405762
Energy: 1.5068578215137494
Energy: 1.2175443320676422
Energy: 1.506857821527054
Energy: 1.2170420221420586
Energy: 1.5068578215181956
Energy: 1.21695769322347
Energy: 1.5087410196440576
Energy: 1.2833705800821207
Energy: 1.5087410196425757
Energy: 1.21695769322347
Energy: 1.5087410196425757
Energy: 1.1936009198542261
Energy: 1.4748162017794144
Energy: 1.3325087112631164
Energy: 1.4748162017823785
Energy: 1.1936009198542261
Energy: 1.4748162017808963
Energy: 1.4520040359195987
Energy: 1.5258479753162362
Energy: 1.2163471793373093
Energy: 1.5258480103832917
Energy: 1.4520040359195987
Energy: 1.5258477556243029
Energy: 1.4555731973539814
Energy: 1.51255518261218
Energy: 1.283307321237897
Energy: 1.51255518261218
Energy: 1.4555731973539814
Energy: 1.512555182624036
Energy: 1.4519003790011364
Energy: 1.5258469124598841
Energy: 1.2229110827142486
Energy: 1.5258474152123942
Energy: 1.4519003789996545
Energy: 1.525846137088979
Energy: 1.1936165902870486
Energy: 1.4750889013288455
Energy: 1.3328932032148895
Energy: 1.475088901269598
Energy: 1.1936165902855669
Energy: 1.4750889013999493
Energy: 1.216838345966972
Energy: 1.487201444229828
Energy: 1.219208275194491
Energy: 1.4872014458934069
Energy: 1.216838345968454
Energy: 1.4872014455082474
Energy: 1.2170434047584993
Energy: 1.5090155289481184
Energy: 1.1966780569806366
Energy: 1.5090155289362623
Energy: 1.2170434047599812
Energy: 1.5090155289510825
Energy: 1.2170550541518728
Energy: 1.4834483473191025
Energy: 1.1931495792845912
Energy: 1.483448347292426
Energy: 1.2170550541533545
Energy: 1.4834483473546376
Energy: 1.2169497162745406
Energy: 1.4831079653289292
Energy: 1.192275219485835
Energy: 1.4831079653467136
Energy: 1.2169497162730587
Energy: 1.483107965308181
Energy: 1.2170420221420586
Energy: 1.506857821525572
Energy: 1.2175443320676422
Energy: 1.506857821507821
Energy: 1.2170420221405762
Energy: 1.5068578215196435

minimum gb energy = 1.192275219485835 eV
minimum distance =  2.15462307158873 Angstroms
sigma value = 11


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

Energy: 1.2055668652472966
Energy: 1.4447602897244234
Energy: 1.4139991083816335
Energy: 1.4447602897233378
Energy: 1.205566865246211
Energy: 1.444760289722252
Energy: 1.7330633004531726
Energy: 1.4186791115532937
Energy: 1.13459999998952
Energy: 1.4186791040181281
Energy: 1.7330633004510017
Energy: 1.418679112695905
Energy: 1.1782608179440537
Energy: 1.398235358144042
Energy: 1.25965446599965
Energy: 1.3982353581527274
Energy: 1.1782608179820504
Energy: 1.3982353581353573
Energy: 1.3076417919282985
Energy: 1.399287894235614
Energy: 1.126039408571411
Energy: 1.399287894235614
Energy: 1.3076417919261272
Energy: 1.3992878942377855
Energy: 1.1247165306018208
Energy: 1.4671557454374202
Energy: 1.2476313596054371
Energy: 1.4671557454363346
Energy: 1.1247165306029066
Energy: 1.4671557454287354
Energy: 1.1372427864075643
Energy: 1.4303750556829344
Energy: 1.1258634635423763
Energy: 1.4303750556861914
Energy: 1.1372427864053931
Energy: 1.4303750556851058
Energy: 1.137263503945664
Energy: 1.4692290439441849
Energy: 1.1320888843495471
Energy: 1.4692290439441849
Energy: 1.1372635039434928
Energy: 1.4692290439441849
Energy: 1.5138323467666246
Energy: 1.4642267537756282
Energy: 1.1486306684098602
Energy: 1.4642267537756282
Energy: 1.5138323467633679
Energy: 1.4642267537745424
Energy: 1.5023023902042654
Energy: 1.46662439757444
Energy: 1.3065641335900957
Energy: 1.4666243975733542
Energy: 1.5023023901988375
Energy: 1.4666243975755255
Energy: 1.136895539199505
Energy: 1.4790554415171386
Energy: 1.1258179371878632
Energy: 1.4790554415171386
Energy: 1.1368955391951625
Energy: 1.4790554415138817
Energy: 1.1376198461816365
Energy: 1.4260469965983067
Energy: 1.1317200164654926
Energy: 1.4260469965993923
Energy: 1.1376198461783795
Energy: 1.4260469966004778
Energy: 1.12548027184351
Energy: 1.4403524386158784
Energy: 1.1259973745314193
Energy: 1.4403524386158784
Energy: 1.12548027184351
Energy: 1.4403524386169637
Energy: 1.498497147696212
Energy: 1.310403331297713
Energy: 1.13562065623428
Energy: 1.310403331271658
Energy: 1.498497147698383
Energy: 1.3104033313237677
Energy: 1.1273256121518722
Energy: 1.4099298806915301
Energy: 1.1467668853242634
Energy: 1.4099298806915301
Energy: 1.1273256121529578
Energy: 1.4099298806904446
Energy: 1.4778132719295551
Energy: 1.415839052201007
Energy: 1.1317582063133897
Energy: 1.4158390169807946
Energy: 1.4778132719273838
Energy: 1.4158390341020524
Energy: 1.1498886939223083
Energy: 1.4390509629324617
Energy: 1.3531637539773032
Energy: 1.4390509629324617
Energy: 1.1498886939168804
Energy: 1.4390509629324617
Energy: 1.7417706413252512
Energy: 1.4279126733785203
Energy: 1.1355094317599321
Energy: 1.4279126733166894
Energy: 1.7417706413274225
Energy: 1.427912673415431
Energy: 1.1279199873896733
Energy: 1.4106016707729037
Energy: 1.1500025544606642
Energy: 1.4106016707750748
Energy: 1.1279199799337085
Energy: 1.4106016707718179
Energy: 1.3047710952242537
Energy: 1.393513619679102
Energy: 1.1319347906527106
Energy: 1.3935136196736742
Energy: 1.3047710952209968
Energy: 1.3935136196801878
Energy: 1.1255748962500505
Energy: 1.467025324746662
Energy: 1.1382551659789635
Energy: 1.4670253247531757
Energy: 1.1255748962522216
Energy: 1.4670253247499188
Energy: 1.5454638757091899
Energy: 1.4268935389755588
Energy: 1.1262218879616024
Energy: 1.4268935389723019
Energy: 1.5454638757102754
Energy: 1.4268935389723019
Energy: 1.137183574528539
Energy: 1.4655199236679683
Energy: 1.1292394474947929
Energy: 1.4655199236668828
Energy: 1.1371835745263679
Energy: 1.4655199236647114
Energy: 1.5036533898072293
Energy: 1.462634285495987
Energy: 1.1483175352768016
Energy: 1.4626342854970729
Energy: 1.5036533898072293
Energy: 1.4626342854970729
Energy: 1.1259984087839583
Energy: 1.4690414393237083
Energy: 1.4751525851003402
Energy: 1.469041439328051
Energy: 1.1259984087828727
Energy: 1.4690414393638764
Energy: 1.1366388795043725
Energy: 1.4036908455814716
Energy: 1.1456926645120824
Energy: 1.403690845583643
Energy: 1.1366388795043725
Energy: 1.4036908455825572
Energy: 1.1370383005109996
Energy: 1.4266208300594694
Energy: 1.1290224146076657
Energy: 1.4266208300616403
Energy: 1.137038300509914
Energy: 1.4266208300605547

minimum gb energy = 1.1247165306018208 eV
minimum distance =  2.20871849026554 Angstroms
sigma value = 41


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

Energy: 1.5105327111696185
Energy: 1.3993259403662666
Energy: 1.3448485086828943
Energy: 1.3993259403491534
Energy: 1.510532771091561
Energy: 1.3993259403508647
Energy: 1.7035291569361488
Energy: 1.2707512952911955
Energy: 1.0414217444919822
Energy: 1.2707563656953411
Energy: 1.7035291569370044
Energy: 1.2707469963984266
Energy: 1.1133498292299107
Energy: 1.3319319287854388
Energy: 1.0742560857957397
Energy: 1.3319319287845828
Energy: 1.1133498292299107
Energy: 1.3319319287845828
Energy: 1.5199293600274049
Energy: 1.2432860701791322
Energy: 1.042402961835245
Energy: 1.243286105640361
Energy: 1.519929360136889
Energy: 1.2432859396588298
Energy: 1.0934937642348423
Energy: 1.2799554011969025
Energy: 1.0585939393961104
Energy: 1.2799554012584706
Energy: 1.0934937642374094
Energy: 1.2799554012935523
Energy: 1.3255622488281797
Energy: 1.3091858911467145
Energy: 1.042359555933907
Energy: 1.3091858911467145
Energy: 1.325562248832458
Energy: 1.3091858911467145
Energy: 1.0507249893692616
Energy: 1.3190437142168876
Energy: 1.0428175544467015
Energy: 1.3190437142168876
Energy: 1.0507249893692616
Energy: 1.3190437142168876
Energy: 1.3775163661080374
Energy: 1.3253243084066466
Energy: 1.0655897083855337
Energy: 1.3253243084066466
Energy: 1.3775163661944194
Energy: 1.3253243084040796
Energy: 1.0649284552798115
Energy: 1.3198331020217915
Energy: 1.2484786095136942
Energy: 1.3198330907518634
Energy: 1.0649284552772447
Energy: 1.3198331292313603
Energy: 1.3350168735905148
Energy: 1.3189364315775254
Energy: 1.3248512140895297
Energy: 1.3189364315792365
Energy: 1.335016876812311
Energy: 1.3189364315792365
Energy: 1.3334056329916484
Energy: 1.365315153443162
Energy: 1.32480043040082
Energy: 1.3653151534440178
Energy: 1.333405632975391
Energy: 1.3653151534448733
Energy: 1.05361181364004
Energy: 1.3376235841451425
Energy: 1.065557534291075
Energy: 1.33762358414172
Energy: 1.05361181364004
Energy: 1.3447459049385369
Energy: 1.0604346010300647
Energy: 1.3097211083237594
Energy: 1.2477230991439052
Energy: 1.3097211083237594
Energy: 1.0604346010326315
Energy: 1.3097211083237594
Energy: 1.0435069464543913
Energy: 1.3187718130188324
Energy: 1.041376086145741
Energy: 1.3187718130196882
Energy: 1.0435069464569584
Energy: 1.3187718130196882
Energy: 1.3348234379052657
Energy: 1.3092247413594054
Energy: 1.04233053420868
Energy: 1.309224741360261
Energy: 1.334823437880452
Energy: 1.309224741360261
Energy: 1.0642806221973626
Energy: 1.3452755932795764
Energy: 1.041529847291391
Energy: 1.3452755932812488
Energy: 1.0642806181237274
Energy: 1.3452755932812488
Energy: 1.3077272136018505
Energy: 1.335398255086313
Energy: 1.0579852149262254
Energy: 1.3353982550871686
Energy: 1.3077272136009952
Energy: 1.3353982550880241
Energy: 1.0959236963880667
Energy: 1.3186960810517312
Energy: 1.0517059849310304
Energy: 1.3186960810525867
Energy: 1.095923696389778
Energy: 1.3186960810517312
Energy: 1.7103423661883894
Energy: 1.2590965746567755
Energy: 1.0421330168146294
Energy: 1.2591102118942752
Energy: 1.7103423661883894
Energy: 1.2588459809835864
Energy: 1.3250555549632224
Energy: 1.3530261924741294
Energy: 1.375282160388431
Energy: 1.3530261924741294
Energy: 1.3250555549692116
Energy: 1.3530261924749851
Energy: 1.6967311852347449
Energy: 1.2818927727874758
Energy: 1.048886640692435
Energy: 1.2818925495318905
Energy: 1.6967311852338893
Energy: 1.2818929518503468
Energy: 1.066640223140243
Energy: 1.3248901530787973
Energy: 1.0518178567993335
Energy: 1.3248901530796529
Energy: 1.0666402233001717
Energy: 1.3248901530779418
Energy: 1.5124372118009157
Energy: 1.2703855872252083
Energy: 1.0423595836711785
Energy: 1.2703855872123735
Energy: 1.5124372117957818
Energy: 1.270385587227736
Energy: 1.0423495730102428
Energy: 1.298793551308574
Energy: 1.1903456384232511
Energy: 1.2987935513034403
Energy: 1.0423495729845733
Energy: 1.2987935513102855
Energy: 1.19215160272434
Energy: 1.3088709235349738
Energy: 1.0440641747600676
Energy: 1.3088709235358296
Energy: 1.192151602725196
Energy: 1.3088709235366849
Energy: 1.043407423816843
Energy: 1.2884120931421792
Energy: 1.1773422021203155
Energy: 1.288412093147313
Energy: 1.0434074238176987
Energy: 1.2884120931515912
Energy: 1.3755650325259523
Energy: 1.3250568766414859
Energy: 1.0668860264924704
Energy: 1.3250568766406303
Energy: 1.3755650325250968
Energy: 1.3250568766389188
Energy: 1.0541228761357702
Energy: 1.2977181871995205
Energy: 1.5039571063500914
Energy: 1.297717856515967
Energy: 1.0541228761357702
Energy: 1.297718226624939
Energy: 1.3360200426441722
Energy: 1.3183737837701626
Energy: 1.324770168586248
Energy: 1.318373783769307
Energy: 1.3360200428434221
Energy: 1.318373783769307
Energy: 1.043040738360794
Energy: 1.319377614725203
Energy: 1.3246965520052556
Energy: 1.3193776147260587
Energy: 1.0430407383599383
Energy: 1.3193776147234917
Energy: 1.0518416760058797
Energy: 1.318626097522554
Energy: 1.072315659618194
Energy: 1.3186260975234094
Energy: 1.051841676005024
Energy: 1.3186260975234094
Energy: 1.053529317266823
Energy: 1.3676488458028675
Energy: 1.307085490980051
Energy: 1.3676488458028675
Energy: 1.053529317266823
Energy: 1.367648845803723
Energy: 1.0425150708786222
Energy: 1.3186995942878206
Energy: 1.0420026975404302
Energy: 1.3186995942878206
Energy: 1.0425150708786222
Energy: 1.3186995942878206

minimum gb energy = 1.041376086145741 eV
minimum distance =  2.20408322074743 Angstroms
sigma value = 33


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

Energy: 1.3030684351939992
Energy: 1.1918966008977652
Energy: 1.227818301514717
Energy: 1.1918966008983656
Energy: 1.303068435213761
Energy: 1.1918966008983656
Energy: 1.8296076650464819
Energy: 1.143241236083959
Energy: 0.9320549512883665
Energy: 1.1432412376631755
Energy: 1.8296076650464819
Energy: 1.1432412366644282
Energy: 1.2916969839543282
Energy: 1.1901574749246955
Energy: 1.0857099570297517
Energy: 1.1901574749246955
Energy: 1.2916969839549286
Energy: 1.1901574749246955
Energy: 1.7005341835775258
Energy: 1.1270797352986313
Energy: 0.9324760227755134
Energy: 1.1270797357421856
Energy: 1.7005341835775258
Energy: 1.1270797356629736
Energy: 0.9877586419114138
Energy: 1.1753294576912312
Energy: 0.9396976767601329
Energy: 1.1753294576930329
Energy: 0.9877586418724357
Energy: 1.1753294576918318
Energy: 1.3786656780965436
Energy: 1.133596003409804
Energy: 0.9325387629840186
Energy: 1.1335960034080026
Energy: 1.3786656780941418
Energy: 1.1335960034086032
Energy: 0.9634444052108351
Energy: 1.148757798334404
Energy: 0.9316599824227053
Energy: 1.148757798334404
Energy: 0.9634444051940211
Energy: 1.1487577983338035
Energy: 1.2480348528094354
Energy: 1.1385047934144823
Energy: 0.9403368433204573
Energy: 1.1385047934126808
Energy: 1.2480348526767784
Energy: 1.1385047933934644
Energy: 0.9487516839528505
Energy: 1.1754253295861177
Energy: 1.0640488350423056
Energy: 1.1754253295873185
Energy: 0.948751683951049
Energy: 1.1754253295837156
Energy: 1.119420666740857
Energy: 1.1678137617336712
Energy: 1.2107635517552213
Energy: 1.1678137617336712
Energy: 1.1194206667456612
Energy: 1.1678137617330708
Energy: 0.9563921075970196
Energy: 1.1486378589166164
Energy: 1.121112406199037
Energy: 1.1486378589154156
Energy: 0.9563921075982208
Energy: 1.1486378589154156
Energy: 1.4265434949400464
Energy: 1.1832768112828174
Energy: 1.1409343089794466
Energy: 1.1832768112816163
Energy: 1.4265434949352422
Energy: 1.1832768112822172
Energy: 1.1209938154154957
Energy: 1.1643217030943709
Energy: 1.3275562396465215
Energy: 1.1643217030925694
Energy: 1.1209938154118926
Energy: 1.16432170309317
Energy: 1.160399742920789
Energy: 1.1807520290034537
Energy: 1.3881126327589133
Energy: 1.1807520290028533
Energy: 1.1603997429237916
Energy: 1.1807520290040543
Energy: 1.12797420702987
Energy: 1.1791469469122031
Energy: 1.4107601040704614
Energy: 1.1791469469104017
Energy: 1.1279742070274679
Energy: 1.179146946911603
Energy: 1.1552716683468016
Energy: 1.183765592401032
Energy: 1.1399213325804467
Energy: 1.183765592401032
Energy: 1.1552716683522064
Energy: 1.1837655924004316
Energy: 1.1208557059099467
Energy: 1.166062546525184
Energy: 1.25541375187107
Energy: 1.166062546525184
Energy: 1.1208557059063435
Energy: 1.16606254652573
Energy: 0.9321034526249579
Energy: 1.1838470926244906
Energy: 1.1195553547295305
Energy: 1.1838470926232896
Energy: 0.9321034526249579
Energy: 1.1838470926226892
Energy: 1.1339157916403195
Energy: 1.1627339725786972
Energy: 1.1199770784521188
Energy: 1.1627339725774966
Energy: 1.1339157916439224
Energy: 1.1627339725774966
Energy: 0.9417184285661259
Energy: 1.1832233822702167
Energy: 0.9415130997869541
Energy: 1.1832233822690157
Energy: 0.9417184285643244
Energy: 1.183223382269616
Energy: 1.1124398610292356
Energy: 1.1627996518002441
Energy: 1.0457373148745268
Energy: 1.1627996517996435
Energy: 1.1124398610052155
Energy: 1.1627996518002441
Energy: 0.948843993423887
Energy: 1.1805418603629878
Energy: 0.9323090637744723
Energy: 1.1805418603635882
Energy: 0.9488439934226861
Energy: 1.1805418603647893
Energy: 1.3888843877871933
Energy: 1.1740608816996765
Energy: 0.9313605122777269
Energy: 1.1740608816984754
Energy: 1.3888843877871933
Energy: 1.1740608816984754
Energy: 0.9592258685195992
Energy: 1.1838693006693395
Energy: 0.9319764399180419
Energy: 1.1838693006669376
Energy: 0.9592258685165969
Energy: 1.183869300667538
Energy: 1.3863260225380398
Energy: 1.1640524944858117
Energy: 1.0933755206224434
Energy: 1.1640524944840103
Energy: 1.3863260225266303
Energy: 1.1640524944840103
Energy: 1.2743450729175427
Energy: 1.1837892575920348
Energy: 0.9359998993814027
Energy: 1.1837892575914346
Energy: 1.2743450729133392
Energy: 1.1837892575914346
Energy: 1.830058873720991
Energy: 1.142060561892145
Energy: 0.931714068233214
Energy: 1.1420605618843387
Energy: 1.830058873722192
Energy: 1.1420605618855397
Energy: 1.1721005237525086
Energy: 1.1832350235207951
Energy: 1.1659048861338637
Energy: 1.1832350235189935
Energy: 1.172100524853342
Energy: 1.183235023519594
Energy: 1.5280366341307572
Energy: 1.154501186608448
Energy: 1.0253445340428864
Energy: 1.1545011866090487
Energy: 1.5280366341253528
Energy: 1.1545011866078476
Energy: 1.1417720643474152
Energy: 1.1831492986092993
Energy: 1.1387969473769648
Energy: 1.1831492986111007
Energy: 1.1417720643396085
Energy: 1.1831492986105003
Energy: 1.5325130142101948
Energy: 1.1170023264422861
Energy: 0.9321250185123525
Energy: 1.1170022714917398
Energy: 1.5325130142107952
Energy: 1.1170022954352028
Energy: 0.9730818745899685
Energy: 1.1678568513489793
Energy: 1.1495163957090815
Energy: 1.1678568513483787
Energy: 0.9730818745953732
Energy: 1.1678568513489793
Energy: 1.2468611108981813
Energy: 1.1336691096932148
Energy: 0.9412011013844603
Energy: 1.1336691096932148
Energy: 1.2468611108963799
Energy: 1.1336691096950162
Energy: 0.9475619272894971
Energy: 1.136867732099786
Energy: 1.4135976203021885
Energy: 1.136867732099786
Energy: 0.9475619272852935
Energy: 1.1368677321003864
Energy: 1.4140831672117802
Energy: 1.1370711511093978
Energy: 0.9523175856202707
Energy: 1.1370711511081968
Energy: 1.4140831672117802
Energy: 1.1370711511081968
Energy: 0.9415733735632493
Energy: 1.1341922794976986
Energy: 1.2465631586145236
Energy: 1.1341922794976986
Energy: 0.9415733735626489
Energy: 1.134192279498299
Energy: 1.1488728298794966
Energy: 1.167644141502353
Energy: 0.9730412421271716
Energy: 1.1676441415017527
Energy: 1.1488728298782955
Energy: 1.1676441415029537
Energy: 0.9316111591397133
Energy: 1.1020667230940309
Energy: 1.532081474086193
Energy: 1.102066727247117
Energy: 0.9316111591409142
Energy: 1.1020667255604102
Energy: 1.138796947379967
Energy: 1.1831345399275077
Energy: 1.271749588145558
Energy: 1.183134539926907
Energy: 1.1387969473805677
Energy: 1.1831345399275077
Energy: 1.1251165172947741
Energy: 1.1543457596009612
Energy: 1.523670368420435
Energy: 1.1543457596027626
Energy: 1.125116517295975
Energy: 1.1543457596021625
Energy: 1.1661822966733086
Energy: 1.183238740613808
Energy: 1.1715103779680331
Energy: 1.1832387406156095
Energy: 1.1661822966595514
Energy: 1.183238740615009
Energy: 0.9315036083047558
Energy: 1.145694197889803
Energy: 1.8282604726233005
Energy: 1.1456941978988104
Energy: 0.9315036083071577
Energy: 1.1456941979006119
Energy: 0.9360159587513381
Energy: 1.1835869026588541
Energy: 1.2453294409777345
Energy: 1.1835869026594545
Energy: 0.9360159587525392
Energy: 1.183586902660055
Energy: 1.1229985216410376
Energy: 1.164004100889371
Energy: 1.3816542239642537
Energy: 1.1640041008899717
Energy: 1.1229985217977145
Energy: 1.164004100889371
Energy: 0.9320716364335134
Energy: 1.180048612373492
Energy: 0.9625772862346428
Energy: 1.1800486123746927
Energy: 0.9320716364293099
Energy: 1.180048612374092
Energy: 0.9313828376143991
Energy: 1.1740608816960734
Energy: 1.3851265834526136
Energy: 1.1740608816966738
Energy: 0.9313828376162007
Energy: 1.174060881697875
Energy: 0.9328135707827214
Energy: 1.183944285498008
Energy: 0.9491819348333883
Energy: 1.1839442854974076
Energy: 0.93281357078092
Energy: 1.1839442854968072

minimum gb energy = 0.9313605122777269 eV
minimum distance =  2.21514200899897 Angstroms
sigma value = 67


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

Energy: 0.3826170813136624
Energy: 0.32125930640033273
Energy: 1.0508650813415483
Energy: 0.32125930640192896
Energy: 0.3826170813136624
Energy: 0.3212593064015413
Energy: 0.30465663506578
Energy: 0.73556957198518
Energy: 0.7480880907270987
Energy: 0.7355695719859782
Energy: 0.30465663506578
Energy: 0.7355695719855905
Energy: 0.3826170813136624
Energy: 0.32125930639912414
Energy: 1.0508650812705622
Energy: 0.3212593064007432
Energy: 0.38261708131327477
Energy: 0.32125930640033273
Energy: 0.30465663506498186
Energy: 0.7355695719843819
Energy: 0.748088090612376
Energy: 0.73556957198518
Energy: 0.30465663506498186
Energy: 0.7355695719843819
Energy: 0.3826170813136624
Energy: 0.3212593064011309
Energy: 1.0508650813447635
Energy: 0.3212593064011309
Energy: 0.38261708131327477
Energy: 0.32125930640192896
Energy: 0.30465663506536955
Energy: 0.7355695719843819
Energy: 0.7480880906240055
Energy: 0.7355695719863886
Energy: 0.30465663506578
Energy: 0.73556957198518
Energy: 0.38261708131327477
Energy: 0.3212593064007432
Energy: 1.0508650812312266
Energy: 0.3212593063995346
Energy: 0.38261708131327477
Energy: 0.32125930640033273

minimum gb energy = 0.30465663506498186 eV
minimum distance =  2.39733078607954 Angstroms
sigma value = 3


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

Energy: 1.5174591618252842
Energy: 1.19137709347036
Energy: 0.9985815537462399
Energy: 1.1913770934758217
Energy: 1.517459157083572
Energy: 1.1913770934758217
Energy: 1.8645966249560222
Energy: 0.9208194700666159
Energy: 0.9128194897982012
Energy: 0.9208194700731697
Energy: 1.8645966249571142
Energy: 0.9208194700731697
Energy: 1.3699040677866139
Energy: 1.1712183957512807
Energy: 1.1660171798850831
Energy: 1.1712183957534652
Energy: 1.3699040677767833
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Energy: 1.2152627763766397
Energy: 1.1436580520278763
Energy: 0.9671597266659443
Energy: 1.1436580520273298
Energy: 0.9197002778012476
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Energy: 1.4603677529371402
Energy: 1.0589107225956205
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Energy: 1.4823668732779036
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Energy: 1.1619052840387574
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Energy: 0.9637812568425012
Energy: 1.6614713608193077
Energy: 0.9637812568523318
Energy: 0.9135150907117894
Energy: 0.9637812568435935
Energy: 0.9072652147129039
Energy: 1.1685105387706929
Energy: 1.4313705114577033
Energy: 1.1685105387630468
Energy: 0.9072652147129039
Energy: 1.1685105387630468
Energy: 0.9071979230626979
Energy: 0.9679823393297327
Energy: 1.5304184318894616
Energy: 0.9679823393171711
Energy: 0.9071979230648824
Energy: 0.9679823393586784
Energy: 0.9633790099713317
Energy: 1.1614845924376391
Energy: 1.4847772421259797
Energy: 1.1614845924381854
Energy: 0.9633790099653241
Energy: 1.1614845924376391
Energy: 0.9173282414858954
Energy: 0.9552696546495391
Energy: 1.6007116161604502
Energy: 0.9552696546326083
Energy: 0.9173282414858954
Energy: 0.9552696546637389
Energy: 0.9561040185618603
Energy: 1.1440998814461139
Energy: 1.214011329742448
Energy: 1.1440998814434327
Energy: 0.9561040185591295
Energy: 1.1440998814445247
Energy: 0.9741091733863034
Energy: 1.0898563804221282
Energy: 1.343759498339666
Energy: 1.089856380419944
Energy: 0.9741091733830266
Energy: 1.089856380421036
Energy: 1.1917518364987776
Energy: 1.134210988803417
Energy: 1.1944275764585237
Energy: 1.134210988795771
Energy: 1.191751836500416
Energy: 1.134210988795771

minimum gb energy = 0.899597307330776 eV
minimum distance =  2.25051067670944 Angstroms
sigma value = 81


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

Energy: 1.5137611776338542
Energy: 1.340769510164861
Energy: 1.057028427811542
Energy: 1.3407695101686088
Energy: 1.5137611776368525
Energy: 1.3407695101686088
Energy: 1.7706593039522938
Energy: 1.0327815308704547
Energy: 1.0160731957815392
Energy: 1.0327815308674564
Energy: 1.7706593039537928
Energy: 1.0327815308674564
Energy: 1.4394748021017687
Energy: 1.316194383215394
Energy: 1.193525362485674
Energy: 1.3161943832161433
Energy: 1.4394748020695367
Energy: 1.316194383215394
Energy: 1.3850054041189093
Energy: 1.0749026999973048
Energy: 1.0203136478917731
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Energy: 1.0939897033372112
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Energy: 1.2430783095259528
Energy: 1.2517832514934975
Energy: 1.0873248951419066
Energy: 1.2517832514942473
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Energy: 1.2737706665316704
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Energy: 1.08714647706131
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Energy: 1.0868976489023627
Energy: 1.3027837495626915
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Energy: 1.3027837495649404
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Energy: 1.3127828473889522
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Energy: 1.087097493423509
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Energy: 1.4064627753401355
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Energy: 1.3025368557406785
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Energy: 1.4061507233557846
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Energy: 1.4065681136432682
Energy: 1.3016162929872763
Energy: 1.3850762062390654
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Energy: 1.0755331967564015
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Energy: 1.3850762062383155
Energy: 1.3020671818259386
Energy: 1.385190985193673
Energy: 1.293617705502234
Energy: 1.0874260781809337
Energy: 1.2936177054992355
Energy: 1.3851909851944226
Energy: 1.2936177054992355
Energy: 1.0868974533071203
Energy: 1.2508426266444215
Energy: 1.4022257429992198
Energy: 1.2508426266429222
Energy: 1.086897453305621
Energy: 1.2508426266436719
Energy: 1.086837083066648
Energy: 1.3042142912224135
Energy: 1.1179591275629994
Energy: 1.3042142912254118
Energy: 1.0868370830658984
Energy: 1.3042142912254118
Energy: 1.0861539694126676
Energy: 1.217731146116188
Energy: 1.395243820217127
Energy: 1.217731146117687
Energy: 1.0861539694119178
Energy: 1.2177311461191862
Energy: 1.0876818584306038
Energy: 1.3007339256398618
Energy: 1.416565878075575
Energy: 1.3007339256421104
Energy: 1.0876818584306038
Energy: 1.3007339256421104
Energy: 1.0143486670532622
Energy: 1.2932029479536116
Energy: 1.5982157608018281
Energy: 1.2932029479506133
Energy: 1.014348667051763
Energy: 1.2932029479521123
Energy: 1.0086521731151137
Energy: 1.3026101561161352
Energy: 1.3569280411325406
Energy: 1.3026101561161352
Energy: 1.0086521731173625
Energy: 1.3026101561161352
Energy: 1.026976685375033
Energy: 1.082791177504675
Energy: 1.5103711226414471
Energy: 1.0827911824721888
Energy: 1.0269766853742832
Energy: 1.0827911835428643
Energy: 1.0937829160009427
Energy: 1.3009177080505323
Energy: 1.4067696286724412
Energy: 1.3009177080505323
Energy: 1.093782915998694
Energy: 1.3009177080505323
Energy: 1.0229489610526001
Energy: 1.1278235436290691
Energy: 1.5891303275404154
Energy: 1.128068008839955
Energy: 1.0229489610518507
Energy: 1.1270406655071972
Energy: 1.0763803146109532
Energy: 1.2513028937363555
Energy: 1.1163928245037262
Energy: 1.2513028937348565
Energy: 1.0763803146139517
Energy: 1.251302893734107
Energy: 1.10657369292344
Energy: 1.2839946836221487
Energy: 1.2419313851831142
Energy: 1.2839947073763338
Energy: 1.1065736929241896
Energy: 1.2839946753878884

minimum gb energy = 1.0033911652679288 eV
minimum distance =  2.14834398783792 Angstroms
sigma value = 43


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

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Energy: 1.4152915646067186
Energy: 1.5022887498630544
Energy: 1.4152915646067186
Energy: 1.5078466194042095
Energy: 1.4152915646067186
Energy: 1.6825538699362246
Energy: 1.1259457475875438
Energy: 1.0846261377823374
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Energy: 1.3969501003360754
Energy: 1.0777664409258791
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Energy: 1.0793303772023053
Energy: 1.3502638566849954
Energy: 1.067558835498892
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Energy: 1.0793303772032259
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Energy: 1.4317275262991336
Energy: 1.2256922994282753
Energy: 1.0852256177642123
Energy: 1.2256922994273547
Energy: 1.4317275263009748
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Energy: 1.4318416312850515
Energy: 1.3426869304401678
Energy: 1.361642478221497
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Energy: 1.4318416312850515
Energy: 1.3426869304401678
Energy: 1.466884002262129
Energy: 1.3986522848140217
Energy: 1.076005869063029
Energy: 1.3986522848140217
Energy: 1.4668840022602878
Energy: 1.3986522848140217
Energy: 1.4674131116171225
Energy: 1.4007462585542916
Energy: 1.0767173497293694
Energy: 1.4007462585542916
Energy: 1.467413111618964
Energy: 1.4007462585542916
Energy: 1.4311411804408822
Energy: 1.4051573086589928
Energy: 1.0838097555657316
Energy: 1.4051573086589928
Energy: 1.4311411804390406
Energy: 1.4051573086589928
Energy: 1.4317268039283717
Energy: 1.4312142626215485
Energy: 1.083023387681379
Energy: 1.4312142626206277
Energy: 1.4317268039274509
Energy: 1.4312142626215485
Energy: 1.0782006933611896
Energy: 1.3499827158475062
Energy: 1.069006531128986
Energy: 1.3499827158484268
Energy: 1.0782006933602688
Energy: 1.3499827158475062
Energy: 1.0793664472863362
Energy: 1.4039301142223835
Energy: 1.0787787806681823
Energy: 1.403930114224225
Energy: 1.079366447287257
Energy: 1.403930114224225
Energy: 1.0927290560982452
Energy: 1.3849017636267653
Energy: 1.0886882358275716
Energy: 1.3849017636267653
Energy: 1.0927290561000866
Energy: 1.3849017636267653
Energy: 1.0870221617697702
Energy: 1.4344369704012714
Energy: 1.1261708181986068
Energy: 1.4344369704003506
Energy: 1.0870221617716118
Energy: 1.4344369704003506
Energy: 1.080277707816327
Energy: 1.3881984426583458
Energy: 1.4329919647608635
Energy: 1.3881984426583458
Energy: 1.080277707816327
Energy: 1.3881984426583458
Energy: 1.0766146107661831
Energy: 1.3997763155150054
Energy: 1.4705745568431667
Energy: 1.3997763155150054
Energy: 1.0766146107652623
Energy: 1.3997763155140848
Energy: 1.0907070442199047
Energy: 1.3855952942195353
Energy: 1.3325988964426376
Energy: 1.3855952942186145
Energy: 1.0907070442189841
Energy: 1.3855952942186145
Energy: 1.1006158006896343
Energy: 1.3426860650233976
Energy: 1.1261815529915558
Energy: 1.342686065022477
Energy: 1.1006158006887135
Energy: 1.342686065022477
Energy: 1.0810926332002737
Energy: 1.2299629444573013
Energy: 1.265174303092892
Energy: 1.2299629444591424
Energy: 1.0810926332011945
Energy: 1.2299629444582216
Energy: 1.0896496959794502
Energy: 1.3499338264411864
Energy: 1.0785300798128565
Energy: 1.3499338264402658
Energy: 1.0896496959794502
Energy: 1.3499338264393448

minimum gb energy = 1.067558835498892 eV
minimum distance =  2.20141860979879 Angstroms
sigma value = 57


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

Energy: 1.2541558942970714
Energy: 1.506612567258914
Energy: 1.161985900428028
Energy: 1.5066125672601058
Energy: 1.2541558942970714
Energy: 1.5066125672624902
Energy: 1.4355117737976442
Energy: 1.2475709815499396
Energy: 1.1623552996079451
Energy: 1.2475709815499396
Energy: 1.4355117737988363
Energy: 1.2475709815499396
Energy: 1.179376587726561
Energy: 1.4996041266724953
Energy: 1.3595870919300326
Energy: 1.4996041267296913
Energy: 1.1793765877277531
Energy: 1.499604126684417
Energy: 1.1835589979782977
Energy: 1.1769842438814782
Energy: 1.166273309592341
Energy: 1.1769842438790936
Energy: 1.1835589979794896
Energy: 1.1769842438790936
Energy: 1.162278538995039
Energy: 1.187372092171906
Energy: 1.1827642033279206
Energy: 1.187372092171906
Energy: 1.162278538995039
Energy: 1.187372092171906
Energy: 1.169710138290531
Energy: 1.4882369547968686
Energy: 1.162332466083956
Energy: 1.4882369547968686
Energy: 1.1697101382893391
Energy: 1.4882369547968686
Energy: 1.1721851662529188
Energy: 1.3558330383236723
Energy: 1.4508694358265537
Energy: 1.3558330386775768
Energy: 1.1721851662529188
Energy: 1.3558330391911473
Energy: 1.1694417950526088
Energy: 1.5148624702870823
Energy: 1.2331990113956046
Energy: 1.5148624702882745
Energy: 1.1694417950514169
Energy: 1.5148624702882745
Energy: 1.1625572778819853
Energy: 1.2070052183909612
Energy: 1.3189393122967894
Energy: 1.2070052183909612
Energy: 1.1625572778819853
Energy: 1.2070052183921536
Energy: 1.1762377864910476
Energy: 1.4823395929974097
Energy: 1.162420825774793
Energy: 1.4823395929962173
Energy: 1.1762377864898557
Energy: 1.4823395929974097
Energy: 1.1720451947434722
Energy: 1.161601136608261
Energy: 1.1618168289640767
Energy: 1.1616011366070689
Energy: 1.1720451947434722
Energy: 1.1616011366070689
Energy: 1.1625753685985354
Energy: 1.352650424131681
Energy: 1.1623885062069974
Energy: 1.352650424131681
Energy: 1.1625753686021119
Energy: 1.3526504241304886
Energy: 1.1627762099608085
Energy: 1.4880008691365538
Energy: 1.1984831531799118
Energy: 1.4880008691389384
Energy: 1.1627762099608085
Energy: 1.4880008691389384
Energy: 1.6494158642985417
Energy: 1.528755497065743
Energy: 1.166238858650795
Energy: 1.5287554970669355
Energy: 1.6494158642985417
Energy: 1.5287554970669355
Energy: 1.6594462826593197
Energy: 1.4939629907879695
Energy: 1.1677348999369415
Energy: 1.4939629907879695
Energy: 1.6594462826593197
Energy: 1.4939629907867773
Energy: 1.1626803539245387
Energy: 1.5207509060181084
Energy: 1.1623394596511858
Energy: 1.5207509060204927
Energy: 1.1626803539293074
Energy: 1.5207509060204927
Energy: 1.1630948524936624
Energy: 1.3536374659756538
Energy: 1.1716856472480044
Energy: 1.3536374659875754
Energy: 1.1630948524948546
Energy: 1.3536374659768458
Energy: 1.16292057591426
Energy: 1.3706624313916773
Energy: 1.16283334456153
Energy: 1.3706624313845244
Energy: 1.162920575915452
Energy: 1.3706624313845244
Energy: 1.1716898241776
Energy: 1.3533887999469962
Energy: 1.1631853650471697
Energy: 1.3533887999458043
Energy: 1.1716898241776
Energy: 1.3533887999458043
Energy: 1.162306484751004
Energy: 1.5203917504997342
Energy: 1.1626772937672167
Energy: 1.5203917504985418
Energy: 1.1623064847521962
Energy: 1.5203917504985418
Energy: 1.1676739030555614
Energy: 1.493965397700621
Energy: 1.6566275456758728
Energy: 1.4939653977030056
Energy: 1.1676739030567533
Energy: 1.4939653977030056
Energy: 1.166291328627842
Energy: 1.3452114787020502
Energy: 1.649376402994474
Energy: 1.3452113924898699
Energy: 1.1662913286266496
Energy: 1.3452114046085877
Energy: 1.207679346397139
Energy: 1.487923512595688
Energy: 1.1628102072215944
Energy: 1.4879235125944956
Energy: 1.2076793463983313
Energy: 1.4879235125944956
Energy: 1.1623337879224824
Energy: 1.3528104920809119
Energy: 1.1625805821345097
Energy: 1.3528104920809119
Energy: 1.162333787920098
Energy: 1.3528104920773356

minimum gb energy = 1.1616011366070689 eV
minimum distance =  2.19488799252477 Angstroms
sigma value = 17


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

Energy: 1.2758544773223004
Energy: 1.2758743929148737
Energy: 1.8437093603648824
Energy: 1.2758743929182457
Energy: 1.2758544773223004
Energy: 1.2758743929165597
Energy: 1.2990271903167692
Energy: 1.276468809491785
Energy: 1.2685431298640184
Energy: 1.276468809491785
Energy: 1.2990271903184554
Energy: 1.276468809491785
Energy: 1.3027180962166034
Energy: 1.2821019052081644
Energy: 1.4736643633038264
Energy: 1.2821019052064782
Energy: 1.3027180962166034
Energy: 1.2821019052064782
Energy: 1.275748791754296
Energy: 1.2722049117941063
Energy: 1.2677244996120307
Energy: 1.2722049117941063
Energy: 1.275748791754296
Energy: 1.2722049117941063
Energy: 1.2683435672726662
Energy: 1.2763535346350174
Energy: 1.2655136191731975
Energy: 1.2763535346350174
Energy: 1.2683435672726662
Energy: 1.2763535346350174
Energy: 1.2651333560695275
Energy: 1.2760280900669343
Energy: 1.2618187239996173
Energy: 1.27602809006862
Energy: 1.2651333560695275
Energy: 1.27602809006862
Energy: 1.2692915185913238
Energy: 1.364554644158683
Energy: 1.2979284905271258
Energy: 1.364554644158683
Energy: 1.2692915185930098
Energy: 1.3645546441603689
Energy: 1.2678012764221844
Energy: 1.3954527554312561
Energy: 1.2676251441845447
Energy: 1.3954527554312561
Energy: 1.2678012764221844
Energy: 1.3954527554312561
Energy: 1.268097740766773
Energy: 1.2708649050036303
Energy: 1.341964299871432
Energy: 1.2708649050036303
Energy: 1.268097740766773
Energy: 1.2708649050036303
Energy: 1.2620237302537565
Energy: 1.2465535376912582
Energy: 1.2683457819099073
Energy: 1.246553537692944
Energy: 1.2620237302554425
Energy: 1.246553537692944
Energy: 1.2626918233585918
Energy: 1.6414677930542207
Energy: 1.265533567970956
Energy: 1.6414677930542207
Energy: 1.2626918233602777
Energy: 1.6414677930542207
Energy: 1.2685264110860928
Energy: 1.2685649432765431
Energy: 1.2654235182320392
Energy: 1.2685649432765431
Energy: 1.2685264110877787
Energy: 1.2685649432765431
Energy: 1.268221202071551
Energy: 1.3971678365859186
Energy: 1.2687073913986662
Energy: 1.3971678365859186
Energy: 1.268221202071551
Energy: 1.3971678365859186
Energy: 1.2691716962872237
Energy: 1.2701977227973915
Energy: 1.27115140393059
Energy: 1.2701977227973915
Energy: 1.2691716962872237
Energy: 1.2701977227973915
Energy: 1.2691552197144689
Energy: 1.4875800788647484
Energy: 1.2618610314996719
Energy: 1.4875800788630626
Energy: 1.2691552197144689
Energy: 1.4875800788647484
Energy: 1.2666722197205877
Energy: 1.476971386553761
Energy: 1.2643921688196333
Energy: 1.4769713865605048
Energy: 1.2666722197222735
Energy: 1.4769713865554468
Energy: 1.265817631140761
Energy: 1.268745759922635
Energy: 1.268251113455774
Energy: 1.268745759924321
Energy: 1.265817631142447
Energy: 1.268745759924321

minimum gb energy = 1.2465535376912582 eV
minimum distance =  2.21841938725865 Angstroms
sigma value = 17


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

Energy: 1.7007519468561967
Energy: 1.699494020036655
Energy: 1.5687445042100412
Energy: 1.6994940199995454
Energy: 1.7007519468601031
Energy: 1.6994940200327489
Energy: 1.5404276491836901
Energy: 1.3076597571622925
Energy: 1.295913537503646
Energy: 1.3076597571622925
Energy: 1.5404276490711173
Energy: 1.3076597571655477
Energy: 1.3074297785027633
Energy: 1.3547935558736588
Energy: 1.3278305624497428
Energy: 1.354793555959568
Energy: 1.3074297785034144
Energy: 1.3547935557910045
Energy: 1.3259973931815665
Energy: 1.5936617336015193
Energy: 1.3486788872093198
Energy: 1.593661733604775
Energy: 1.3259973931893791
Energy: 1.5936617336015193
Energy: 1.3003048328892584
Energy: 1.345897427015471
Energy: 1.5374209661435443
Energy: 1.3458974271710133
Energy: 1.3003048328886073
Energy: 1.3458974270929165
Energy: 1.3486711265602527
Energy: 1.6114258304304034
Energy: 1.3705258159271703
Energy: 1.6114258304369142
Energy: 1.3486711265641593
Energy: 1.6114258304369142
Energy: 1.2947227075670167
Energy: 1.352153357635668
Energy: 1.5305965960517451
Energy: 1.3521534438819995
Energy: 1.2947227075663656
Energy: 1.3521532705329362
Energy: 1.674479064775205
Energy: 1.4636198946253478
Energy: 1.2985884252977216
Energy: 1.4634390398612194
Energy: 1.674479064775856
Energy: 1.4615612908794267
Energy: 1.3725013741687737
Energy: 1.6063272669193618
Energy: 1.3109815818681598
Energy: 1.6063272669167872
Energy: 1.3725013741674714
Energy: 1.606327266923268
Energy: 1.6642340072401378
Energy: 1.346736551406167
Energy: 1.2937708161923844
Energy: 1.3467624338538509
Energy: 1.6642340072407593
Energy: 1.3470876526710112
Energy: 1.3451294424269193
Energy: 1.6718149009031715
Energy: 1.3402805626502077
Energy: 1.6718149009050953
Energy: 1.3451294424269193
Energy: 1.6718149009018695
Energy: 1.3073443973384127
Energy: 1.602156510435601
Energy: 1.3004408170746253
Energy: 1.602156510425184
Energy: 1.3073443973397147
Energy: 1.6021565104323454
Energy: 1.2998846388231002
Energy: 1.4942161871706017
Energy: 1.7024338743394658
Energy: 1.4942161829803398
Energy: 1.2998846388231002
Energy: 1.494216181296807
Energy: 1.3076460387201927
Energy: 1.5752543104944832
Energy: 1.6792064261131365
Energy: 1.575254529134687
Energy: 1.3076460387195417
Energy: 1.5752542246633454
Energy: 1.3056830343152908
Energy: 1.6312444467242035
Energy: 1.3444440041725563
Energy: 1.6312444467229017
Energy: 1.3056830343133377
Energy: 1.6312444467235525
Energy: 1.3490557126021814
Energy: 1.6852106025166957
Energy: 1.3005855750989648
Energy: 1.6785168316194325
Energy: 1.3490557126021814
Energy: 1.6852106025811202
Energy: 1.3444642303415577
Energy: 1.571441260477234
Energy: 1.3143736080176658
Energy: 1.5714412609685713
Energy: 1.3444642303415577
Energy: 1.5714412603021897
Energy: 1.6512552929433348
Energy: 1.5386200167631596
Energy: 1.3109893556358732
Energy: 1.5386200166701185
Energy: 1.6512552930663245
Energy: 1.5386200167358453
Energy: 1.6607186542344095
Energy: 1.5189600193622115
Energy: 1.2947016596313639
Energy: 1.5189607277962063
Energy: 1.6607186542370138
Energy: 1.5189598133305249
Energy: 1.2966825603328533
Energy: 1.5348664041970965
Energy: 1.2966580114641444
Energy: 1.6217882139449422
Energy: 1.2966825603282959
Energy: 1.5348664041359272
Energy: 1.294585940239126
Energy: 1.5209780505247765
Energy: 1.518400934025752
Energy: 1.5209780509698891
Energy: 1.2945859402371727
Energy: 1.5209780441036835
Energy: 1.3110451985965603
Energy: 1.5390445728583018
Energy: 1.6523352816533527
Energy: 1.539044572862208
Energy: 1.3110451985985137
Energy: 1.5390445728596038
Energy: 1.3192191528958999
Energy: 1.5728341915600081
Energy: 1.3443462300504576
Energy: 1.5728341916244324
Energy: 1.3192191528926447
Energy: 1.572834191433112
Energy: 1.300601464218176
Energy: 1.6515079244364759
Energy: 1.3499442602846368
Energy: 1.6515079244423059
Energy: 1.3006014642207802
Energy: 1.6515079244410036
Energy: 1.3433810079347177
Energy: 1.6311281397388588
Energy: 1.2983648736567917
Energy: 1.6311281397440671
Energy: 1.3433810079425306
Energy: 1.631128139740812
Energy: 1.679545219938126
Energy: 1.5757442381788316
Energy: 1.3077196227781764
Energy: 1.5758158225952823
Energy: 1.6795452199420322
Energy: 1.5757688481711214
Energy: 1.7038663656059196
Energy: 1.467773102754365
Energy: 1.2997971960372943
Energy: 1.4677731300181016
Energy: 1.7038663656059196
Energy: 1.467773095169723
Energy: 1.3004818642466505
Energy: 1.604820939955745
Energy: 1.307130823449882
Energy: 1.604820939955745
Energy: 1.3004818642453484
Energy: 1.6048209399518385
Energy: 1.3409391738269119
Energy: 1.6672391158477295
Energy: 1.3452048967084949
Energy: 1.667239115843172
Energy: 1.3409391738125886
Energy: 1.667239115840568
Energy: 1.293869679201363
Energy: 1.346762433855153
Energy: 1.663391417024179
Energy: 1.3467624338558042
Energy: 1.2938696791981077
Energy: 1.346762433855153
Energy: 1.3105697640574798
Energy: 1.607702197334865
Energy: 1.3727025498103476
Energy: 1.6077021973361671
Energy: 1.3105697640620375
Energy: 1.6077021973355161
Energy: 1.29863491301988
Energy: 1.4756378827912013
Energy: 1.6788116348391482
Energy: 1.4756521016820083
Energy: 1.2986349130159736
Energy: 1.475627462702765
Energy: 1.529518824701337
Energy: 1.3527963713321118
Energy: 1.2947780364070738
Energy: 1.352796371414115
Energy: 1.5295188247000346
Energy: 1.3527963714076043
Energy: 1.3705452123595145
Energy: 1.6059687473718887
Energy: 1.3496028298157534
Energy: 1.6059687488796963
Energy: 1.3705452123595145
Energy: 1.6059687481768854
Energy: 1.5365702785469686
Energy: 1.3458974263425787
Energy: 1.300630118376315
Energy: 1.3458974258460625
Energy: 1.5365702783081507
Energy: 1.3458974265065846
Energy: 1.3482246980019603
Energy: 1.600615296743763
Energy: 1.329291865534131
Energy: 1.60061529674181
Energy: 1.348224697999356
Energy: 1.6006152967411589
Energy: 1.3212512949854014
Energy: 1.3514894242628765
Energy: 1.3074227025693792
Energy: 1.351489424479588
Energy: 1.3212481731083383
Energy: 1.3514894243429263
Energy: 1.2959620606241709
Energy: 1.306827986649666
Energy: 1.5325202760693784
Energy: 1.3068279866451085
Energy: 1.2959620606248219
Energy: 1.306827986649015
Energy: 1.5609331742187431
Energy: 1.699494019924704
Energy: 1.7007519466739909
Energy: 1.6994940199292612
Energy: 1.5609331742200452
Energy: 1.6994940199019466
Energy: 1.295913537504948
Energy: 1.3076597571570843
Energy: 1.540427648954638
Energy: 1.3076597571570843
Energy: 1.295913537503646
Energy: 1.3076597571629436
Energy: 1.3278305314805714
Energy: 1.3547935635741586
Energy: 1.3074297785001592
Energy: 1.354793564085649
Energy: 1.3278305327456548
Energy: 1.3547935623429
Energy: 1.348678887212575
Energy: 1.5936617335911027
Energy: 1.3259973931913323
Energy: 1.5936617335891494
Energy: 1.3486788872080175
Energy: 1.593661733597613
Energy: 1.5374209637318095
Energy: 1.3458974277781788
Energy: 1.3003048328931648
Energy: 1.3458974273610318
Energy: 1.5374209642927796
Energy: 1.3458974275855264

minimum gb energy = 1.2937708161923844 eV
minimum distance =  2.19573430114328 Angstroms
sigma value = 57


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

Energy: 1.4088933029243713
Energy: 1.664599850977446
Energy: 1.6224544984804234
Energy: 1.6645998509615447
Energy: 1.4088933029243713
Energy: 1.6645998509721454
Energy: 1.3789354361250556
Energy: 1.3147790527238719
Energy: 1.3142098012203398
Energy: 1.3147790527270522
Energy: 1.3789354361229356
Energy: 1.3147790527270522
Energy: 1.291574999839735
Energy: 1.383775346767866
Energy: 1.5152751058622702
Energy: 1.3837753465209663
Energy: 1.2915749998365549
Energy: 1.3837753462730067
Energy: 1.3897415813536014
Energy: 1.3748933428398338
Energy: 1.3661793185676918
Energy: 1.3748933428536145
Energy: 1.389741581350421
Energy: 1.3748933428525547
Energy: 1.2938187217614818
Energy: 1.3623894536383634
Energy: 1.3959375923724986
Energy: 1.3623894536415435
Energy: 1.2938187217657222
Energy: 1.3623894536404833
Energy: 1.3878030516456799
Energy: 1.3732838497221218
Energy: 1.3664335230107623
Energy: 1.3732838497263622
Energy: 1.3878030516435595
Energy: 1.3732838497221218
Energy: 1.2937264141331712
Energy: 1.3707633911393569
Energy: 1.6047813086652778
Energy: 1.370763390982515
Energy: 1.2937264141352915
Energy: 1.3707633909782746
Energy: 1.647218477312219
Energy: 1.334248875578677
Energy: 1.3143618570692954
Energy: 1.3342488761900477
Energy: 1.6472184773143392
Energy: 1.3342488760650077
Energy: 1.4035544515682
Energy: 1.6662046576589908
Energy: 1.3244129735480974
Energy: 1.6662046576579306
Energy: 1.4035544515650196
Energy: 1.6662046576600507
Energy: 1.3520144951188586
Energy: 1.3139356694553448
Energy: 1.3140139279811613
Energy: 1.3139356694564048
Energy: 1.3520144951061859
Energy: 1.3139356694564048
Energy: 1.2937954225294908
Energy: 1.5394349977477184
Energy: 1.360798649469954
Energy: 1.5394349977445383
Energy: 1.2937954225294908
Energy: 1.5394349977466582
Energy: 1.3623101513721132
Energy: 1.362340161947722
Energy: 1.3603845560174332
Energy: 1.3623401619519624
Energy: 1.3623101513689333
Energy: 1.3623401619530222
Energy: 1.2971059365457456
Energy: 1.557501529116947
Energy: 1.3725058993485344
Energy: 1.557501529115887
Energy: 1.2971059365457456
Energy: 1.557501529116947
Energy: 1.3719662501461127
Energy: 1.438792098322221
Energy: 1.360548734347803
Energy: 1.438792098321161
Energy: 1.371966250147173
Energy: 1.438792098321161
Energy: 1.298951982840087
Energy: 1.372562413044009
Energy: 1.327034500862258
Energy: 1.372562412400788
Energy: 1.2989519828390268
Energy: 1.3725624132643588
Energy: 1.6406921250870186
Energy: 1.5651530678973713
Energy: 1.3129713921775237
Energy: 1.5651530687291881
Energy: 1.6406921159755326
Energy: 1.565153069150903
Energy: 1.4009876904561493
Energy: 1.564372226363785
Energy: 1.317437911192172
Energy: 1.5643708199440118
Energy: 1.4009876904550893
Energy: 1.5643693044629892
Energy: 1.3743486843235453
Energy: 1.581765148427883
Energy: 1.3145875943722811
Energy: 1.581765148427883
Energy: 1.3743486843235453
Energy: 1.5817651484321231
Energy: 1.2989675027138436
Energy: 1.511119267784153
Energy: 1.3645957345850857
Energy: 1.5111192679250458
Energy: 1.2989675027127838
Energy: 1.5111192676813745
Energy: 1.3810614906450716
Energy: 1.7097920192524754
Energy: 1.3610001132327711
Energy: 1.7097920192482352
Energy: 1.3810614906471914
Energy: 1.7097920192514153
Energy: 1.3034111829851804
Energy: 1.52835694344998
Energy: 1.3647708588262228
Energy: 1.5283569434478599
Energy: 1.30341118297988
Energy: 1.52835694344998
Energy: 1.3018308029727008
Energy: 1.4978294017314757
Energy: 1.3610901754237639
Energy: 1.4978294017304155
Energy: 1.3018308029737609
Energy: 1.4978294017335958
Energy: 1.3011898848362247
Energy: 1.3663229841867053
Energy: 1.3175562383063633
Energy: 1.3663229813575741
Energy: 1.3011898848277441
Energy: 1.3663229829363541
Energy: 1.4016955025317788
Energy: 1.5604531288894372
Energy: 1.3141080808205283
Energy: 1.5604530951581859
Energy: 1.401695502530719
Energy: 1.5604532215470823
Energy: 1.405169195736519
Energy: 1.56010502225497
Energy: 1.3132148003431932
Energy: 1.5601050222655708
Energy: 1.4051691957322787
Energy: 1.5601050221511314
Energy: 1.3011891186840658
Energy: 1.3706108831999744
Energy: 1.3218398833903697
Energy: 1.3706095959903581
Energy: 1.3011891186872464
Energy: 1.3706103491338322
Energy: 1.2988123460084937
Energy: 1.4969327632713574
Energy: 1.359852648797525
Energy: 1.4969327634472804
Energy: 1.2988123460031935
Energy: 1.4969327633052796

minimum gb energy = 1.2915749998365549 eV
minimum distance =  2.14559603011647 Angstroms
sigma value = 43


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

Energy: 1.46507103116906
Energy: 1.6693640685333184
Energy: 1.4236791511640272
Energy: 1.66936406853718
Energy: 1.4650710311682875
Energy: 1.6693640685356355
Energy: 1.3916950734354363
Energy: 1.344466077630821
Energy: 1.32273872148945
Energy: 1.3444660776293116
Energy: 1.3916950734354363
Energy: 1.3444660776293116
Energy: 1.3251928665053887
Energy: 1.425213267655002
Energy: 1.5964421417458443
Energy: 1.4252132676580918
Energy: 1.325192866506934
Energy: 1.4252132676596363
Energy: 1.4378839082346953
Energy: 1.632859369077815
Energy: 1.4113571050824107
Energy: 1.6328593690701265
Energy: 1.4378839082200554
Energy: 1.6328593690593132
Energy: 1.3227762681696662
Energy: 1.3901064909745242
Energy: 1.4172224447805284
Energy: 1.3901064911134806
Energy: 1.3227762681688937
Energy: 1.3901064903383713
Energy: 1.3968122597843762
Energy: 1.4021700255419896
Energy: 1.333878643898981
Energy: 1.4021700251745168
Energy: 1.3968122597874657
Energy: 1.4021700252609872
Energy: 1.3345590185783671
Energy: 1.3942696539678783
Energy: 1.3471127857285767
Energy: 1.394269653969423
Energy: 1.3345590185768224
Energy: 1.3942696539709676
Energy: 1.4421280581522709
Energy: 1.3899613436480986
Energy: 1.3249204065835405
Energy: 1.389961343652733
Energy: 1.4421280581522709
Energy: 1.3899613436519604
Energy: 1.4099543828245233
Energy: 1.6352654280344503
Energy: 1.4056660547533064
Energy: 1.6352654272932903
Energy: 1.409954382826068
Energy: 1.6352654297846425
Energy: 1.5195948458823954
Energy: 1.4064812182074171
Energy: 1.3232190498050664
Energy: 1.4064812109163771
Energy: 1.5195948456592854
Energy: 1.4064812224010397
Energy: 1.324102387710876
Energy: 1.366836072933964
Energy: 1.6337573040237738
Energy: 1.366836072936281
Energy: 1.3241023877101032
Energy: 1.366836072936281
Energy: 1.3436470759496744
Energy: 1.6587345025332636
Energy: 1.456231127433745
Energy: 1.6587253733951284
Energy: 1.3436470759458126
Energy: 1.658740645515321
Energy: 1.3266362934298195
Energy: 1.3432015374180433
Energy: 1.4099181644452463
Energy: 1.3432015374149537
Energy: 1.326636293430592
Energy: 1.3432015374141817
Energy: 1.4088235619293916
Energy: 1.4934031974589042
Energy: 1.32336758239513
Energy: 1.496358799471946
Energy: 1.408823561923985
Energy: 1.502163632357158
Energy: 1.4083256720486708
Energy: 1.6468987512753681
Energy: 1.3461182439779251
Energy: 1.6468987512691888
Energy: 1.4083256720494433
Energy: 1.6468987512784574
Energy: 1.3968005999078752
Energy: 1.5318890336381705
Energy: 1.3267655440067794
Energy: 1.531889033709966
Energy: 1.3968005999078752
Energy: 1.5318890336466666
Energy: 1.3362676455058045
Energy: 1.5239192375031536
Energy: 1.409094678021189
Energy: 1.5239192375286417
Energy: 1.3362676455050324
Energy: 1.5239192375849895
Energy: 1.342344358342284
Energy: 1.3975248526621296
Energy: 1.3384990467583138
Energy: 1.397524852654406
Energy: 1.3423443583407393
Energy: 1.3975248526613573
Energy: 1.345253382548971
Energy: 1.4723196355836705
Energy: 1.410468653000482
Energy: 1.4723218284061859
Energy: 1.3452533825505157
Energy: 1.4740783439622716
Energy: 1.3254405711616961
Energy: 1.595501244161067
Energy: 1.4092758179569322
Energy: 1.5955012441618395
Energy: 1.3254405711624686
Energy: 1.5955012441618395
Energy: 1.3233037160266683
Energy: 1.4051273563065088
Energy: 1.3440257213473343
Energy: 1.4051273563119155
Energy: 1.3233037160251235
Energy: 1.405127356323501
Energy: 1.7988060369250018
Energy: 1.515381998416714
Energy: 1.326117769082072
Energy: 1.515383931451075
Energy: 1.7988060369280914
Energy: 1.5153798424214708
Energy: 1.800712757220275
Energy: 1.5459124752138398
Energy: 1.3430377530206128
Energy: 1.545912475214612
Energy: 1.8007127572171853
Energy: 1.5459124752153846
Energy: 1.325367819247656
Energy: 1.5648794223802995
Energy: 1.3457067695271565
Energy: 1.5648794223826168
Energy: 1.3253678192461111
Energy: 1.5648794223779823
Energy: 1.3234826099922525
Energy: 1.5955436908283012
Energy: 1.4081029263119387
Energy: 1.5955436908283012
Energy: 1.3234826099899353
Energy: 1.595543690827529
Energy: 1.3482239945671437
Energy: 1.5800238672115394
Energy: 1.4080502783682407
Energy: 1.578355035372817
Energy: 1.3482239945625096
Energy: 1.5815640274903566
Energy: 1.3562197694930644
Energy: 1.532053301946529
Energy: 1.3944795156303988
Energy: 1.5320533019496185
Energy: 1.3562197694915195
Energy: 1.5320533019480735
Energy: 1.3935288109190807
Energy: 1.7502352147897153
Energy: 1.3936245350778487
Energy: 1.7502352147881706
Energy: 1.39352881092217
Energy: 1.7502352147881706
Energy: 1.3966213203513953
Energy: 1.5375850897752745
Energy: 1.3330708496930477
Energy: 1.5375850897683234
Energy: 1.3966213203390379
Energy: 1.5375850897706405
Energy: 1.4078770085649777
Energy: 1.574145551092624
Energy: 1.3480318371273556
Energy: 1.5741455486090306
Energy: 1.4078770085665224
Energy: 1.5741455322350852
Energy: 1.408546653591233
Energy: 1.595379596355899
Energy: 1.323426787237428
Energy: 1.5953795963551265
Energy: 1.4085466535873712
Energy: 1.5953795963551265
Energy: 1.3465071007424765
Energy: 1.5901591131635782
Energy: 1.3252667109786456
Energy: 1.5901591131589439
Energy: 1.3465071007424765
Energy: 1.5901591131612611
Energy: 1.3429231840057456
Energy: 1.5460447034491833
Energy: 1.6263910287749865
Energy: 1.5460447034499554
Energy: 1.3429231840057456
Energy: 1.5460447034499554
Energy: 1.32617308447328
Energy: 1.530834658791177
Energy: 1.799744966430426
Energy: 1.5308346562790056
Energy: 1.32617308447328
Energy: 1.5308346572671838
Energy: 1.3440678871222589
Energy: 1.4089211346061947
Energy: 1.323372675873151
Energy: 1.4089211323148163
Energy: 1.3440678871099012
Energy: 1.4089211383157865
Energy: 1.409176665423736
Energy: 1.5956873363527244
Energy: 1.325418434146171
Energy: 1.595687336353497
Energy: 1.4091766654229636
Energy: 1.595687336353497

minimum gb energy = 1.32273872148945 eV
minimum distance =  2.2221017952649 Angstroms
sigma value = 81


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

Energy: 1.3355773364326475
Energy: 1.3403576348539255
Energy: 1.6765273915733112
Energy: 1.3403576348536352
Energy: 1.3355773364320993
Energy: 1.3403576348525064
Energy: 1.560636444643329
Energy: 1.3401329908184483
Energy: 1.3356800282661339
Energy: 1.3401329908136108
Energy: 1.560636444643329
Energy: 1.340132990818706
Energy: 1.3356900991072367
Energy: 1.340247226453563
Energy: 1.560633357700117
Energy: 1.3402472264521441
Energy: 1.3356900991058176
Energy: 1.3402472264526923
Energy: 1.662233878325086
Energy: 1.3403576348527968
Energy: 1.335577336431809
Energy: 1.340357634853345
Energy: 1.6622338783247956
Energy: 1.3403576348522164
Energy: 1.3356800282664238
Energy: 1.3401329908170292
Energy: 1.5606364446430712
Energy: 1.340132990816739
Energy: 1.3356800282661339
Energy: 1.3401329908141915
Energy: 1.5606333576995688
Energy: 1.3402472264532728
Energy: 1.3356900991063982
Energy: 1.3402472264524345
Energy: 1.5606333576995688
Energy: 1.3402472264526923
Energy: 1.335577336431809
Energy: 1.340357634851378
Energy: 1.6622338783247956
Energy: 1.3403576348525064
Energy: 1.3355773364326475
Energy: 1.3403576348527968
Energy: 1.5606364446444898
Energy: 1.34013299081503
Energy: 1.3356800282664238
Energy: 1.3401329908184483
Energy: 1.5606364446439094
Energy: 1.3401329908178676
Energy: 1.3356900991072367
Energy: 1.3402472264524345
Energy: 1.5606333576998592
Energy: 1.340247226453563
Energy: 1.3356900991063982
Energy: 1.3402472264532728
Energy: 1.6979552570038754
Energy: 1.3403576348522164
Energy: 1.335577336431809
Energy: 1.3403576348516681
Energy: 1.6979552570030043
Energy: 1.3403576348527968

minimum gb energy = 1.335577336431809 eV
minimum distance =  2.22103436122217 Angstroms
sigma value = 3


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

Energy: 1.7824887815584047
Energy: 1.7508561837885521
Energy: 1.8331356765305453
Energy: 1.7508561837860046
Energy: 1.7824887815677077
Energy: 1.750856183787703
Energy: 1.5582268532254595
Energy: 1.4308438114745075
Energy: 1.3078024655051765
Energy: 1.4308438161602337
Energy: 1.5582268532263088
Energy: 1.4308438089406428
Energy: 1.3264043218462747
Energy: 1.3238202621457424
Energy: 1.5565180366398013
Energy: 1.32382026214829
Energy: 1.3264043218471238
Energy: 1.32382026214829
Energy: 1.5947793836337987
Energy: 1.712824048919329
Energy: 1.4532077103836647
Energy: 1.7128240489295197
Energy: 1.594779383345211
Energy: 1.7128240489150828
Energy: 1.4119341270247958
Energy: 1.4214312415087278
Energy: 1.671067985211209
Energy: 1.4214312415154833
Energy: 1.411934127025645
Energy: 1.4214312415129353
Energy: 1.534190559686411
Energy: 1.3685103061618082
Energy: 1.291609758064399
Energy: 1.3685103061643562
Energy: 1.5341905466461607
Energy: 1.3685103061626576
Energy: 1.4130391106917024
Energy: 1.4230402060447556
Energy: 1.411124279600629
Energy: 1.423040206032017
Energy: 1.413039110690853
Energy: 1.4230402060379617
Energy: 1.4217805728210766
Energy: 1.7204845488497977
Energy: 1.4450296771904132
Energy: 1.7204845488523455
Energy: 1.4217805729314394
Energy: 1.7204845488497977
Energy: 1.323851231195327
Energy: 1.4651072136103924
Energy: 1.696465300192305
Energy: 1.4651072136078447
Energy: 1.323851231195327
Energy: 1.465107213608694
Energy: 1.3274951947215032
Energy: 1.3438099921448265
Energy: 1.3078471441452917
Energy: 1.3438099921431284
Energy: 1.3274951947215032
Energy: 1.3438099921465252
Energy: 1.6473172124110949
Energy: 1.5809354081870852
Energy: 1.4365370473322996
Energy: 1.5809354081887836
Energy: 1.6473172124093964
Energy: 1.5809354081870852
Energy: 1.6530509318902125
Energy: 1.4411564018915282
Energy: 1.3092960780085687
Energy: 1.4411564748123424
Energy: 1.6530509319903843
Energy: 1.4411563905617266
Energy: 1.3251881822587648
Energy: 1.3705498903722535
Energy: 1.3077649775256766
Energy: 1.3705498903714046
Energy: 1.3251881822596139
Energy: 1.3705498903722535
Energy: 1.3254307939206866
Energy: 1.5638996238452072
Energy: 1.442983257734482
Energy: 1.5638996237781557
Energy: 1.3254307939206866
Energy: 1.5638996238435088
Energy: 1.4128320315152785
Energy: 1.3349561131047927
Energy: 1.4423726513895876
Energy: 1.3349561130996972
Energy: 1.4128320315178262
Energy: 1.3349561131039434
Energy: 1.4145113399284657
Energy: 1.4533177883759123
Energy: 1.2952552763893845
Energy: 1.4533177883767616
Energy: 1.414511339925069
Energy: 1.4533177883733646
Energy: 1.4141034472265392
Energy: 1.419131946230134
Energy: 1.2953674347606188
Energy: 1.4191319462411356
Energy: 1.4141034472265392
Energy: 1.4191319462360785
Energy: 1.412898966407287
Energy: 1.516486154174405
Energy: 1.4503207551347042
Energy: 1.5164861541778019
Energy: 1.4128989664438045
Energy: 1.5164861541778019
Energy: 1.3261646582592228
Energy: 1.5911086881359133
Energy: 1.4493875890677301
Energy: 1.5911086881325165
Energy: 1.3261646582600721
Energy: 1.5911086881325165
Energy: 1.326037016652209
Energy: 1.5513292676261814
Energy: 1.3087697160874932
Energy: 1.5513292676202364
Energy: 1.3260370166530582
Energy: 1.5513292676202364
Energy: 1.7367520220079549
Energy: 1.3402657226597308
Energy: 1.3075862186155354
Energy: 1.3402657226597308
Energy: 1.7367520220062567
Energy: 1.3402657226605796
Energy: 1.7579978083742407
Energy: 1.5098555108846792
Energy: 1.4262015943312714
Energy: 1.5098555108940208
Energy: 1.7579978083691452
Energy: 1.5098555108948701
Energy: 1.3251172887014337
Energy: 1.3438478667402622
Energy: 1.308547558456066
Energy: 1.3438478516042007
Energy: 1.3251172886997356
Energy: 1.343847847383627
Energy: 1.3250069077427205
Energy: 1.5358317424912902
Energy: 1.6915466119973013
Energy: 1.5358317424522254
Energy: 1.3250069077418711
Energy: 1.535831742489592
Energy: 1.4280094102187084
Energy: 1.5426173148258282
Energy: 1.4505019503982246
Energy: 1.5426173148266775
Energy: 1.4280094101270289
Energy: 1.5426173148224311
Energy: 1.4093316251965222
Energy: 1.5709500177897746
Energy: 1.367148291339178
Energy: 1.5709743111055803
Energy: 1.4093316251965222
Energy: 1.570906807985706
Energy: 1.4271747698369657
Energy: 1.5679959905886767
Energy: 1.2937015701934216
Energy: 1.5679959905920737
Energy: 1.4271747699328912
Energy: 1.5679959905929228
Energy: 1.4094488966863896
Energy: 1.4779175146479628
Energy: 1.6927920905557736
Energy: 1.4779175146522092
Energy: 1.4094488966804446
Energy: 1.4779175146513597
Energy: 1.452062882287384
Energy: 1.7108165470240904
Energy: 1.4495512714591756
Energy: 1.7108165469688899
Energy: 1.4520626954515403
Energy: 1.7108165472066
Energy: 1.3254406747543712
Energy: 1.3277732652130136
Energy: 1.5522564887386137
Energy: 1.327773265213863
Energy: 1.3254406747552205
Energy: 1.327773265213863
Energy: 1.56004476952885
Energy: 1.4323209628821894
Energy: 1.30762583414527
Energy: 1.4323209532127696
Energy: 1.5600447695271515
Energy: 1.4323209648269126
Energy: 1.6530263147769464
Energy: 1.6628982166671826
Energy: 1.4159050202430192
Energy: 1.6628982166773734
Energy: 1.6530263147557152
Energy: 1.662898216676524
Energy: 1.6459683094958988
Energy: 1.4309793292813007
Energy: 1.3090361589496353
Energy: 1.430979329287245
Energy: 1.645968309496748
Energy: 1.4309793292838482

minimum gb energy = 1.291609758064399 eV
minimum distance =  2.16534775882156 Angstroms
sigma value = 67


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

Energy: 1.4656890220156278
Energy: 1.8137828790546888
Energy: 1.7909970222903489
Energy: 1.8137828790558992
Energy: 1.4656890220144179
Energy: 1.8137828790558992
Energy: 1.6163520907912463
Energy: 1.4045370920609854
Energy: 1.295840660514618
Energy: 1.4045370925278535
Energy: 1.6163520909061482
Energy: 1.404537091383675
Energy: 1.290845148958346
Energy: 1.3653153832776008
Energy: 1.4595078964124137
Energy: 1.3653153832727607
Energy: 1.2908451489571358
Energy: 1.3653153832739706
Energy: 1.620504449890479
Energy: 1.569674868783727
Energy: 1.3990260348009795
Energy: 1.569674868781307
Energy: 1.6205044497658965
Energy: 1.5696748687849373
Energy: 1.3978976401941958
Energy: 1.56821455828032
Energy: 1.658593350751149
Energy: 1.56821455828153
Energy: 1.3978976401941958
Energy: 1.5682145582730593
Energy: 1.407082885043407
Energy: 1.4901545374818455
Energy: 1.2750456335795195
Energy: 1.4901545374794252
Energy: 1.4070828850385668
Energy: 1.4901545374794252
Energy: 1.2823552829994658
Energy: 1.2979239682719717
Energy: 1.2906448713555236
Energy: 1.2979239683045884
Energy: 1.2823552830006757
Energy: 1.2979239681316581
Energy: 1.3964232635967855
Energy: 1.5478266406011385
Energy: 1.6629064311338002
Energy: 1.5478266300213095
Energy: 1.3964232617970227
Energy: 1.547826622999974
Energy: 1.3912985980784505
Energy: 1.4058309252991037
Energy: 1.6627863851736213
Energy: 1.4058309252736922
Energy: 1.3912985980796606
Energy: 1.4058309252736922
Energy: 1.3957369687570438
Energy: 1.4754114275844208
Energy: 1.2946324389532637
Energy: 1.475411427585631
Energy: 1.3957369687594636
Energy: 1.475411427588051
Energy: 1.3923565558308133
Energy: 1.4814370093904035
Energy: 1.3079094210038982
Energy: 1.4814370093952438
Energy: 1.3923565558356534
Energy: 1.4814370093952438
Energy: 1.4069838443687805
Energy: 1.5106275131528286
Energy: 1.3972979463518567
Energy: 1.5106275131491984
Energy: 1.4069838443675706
Energy: 1.5106275131467783
Energy: 1.2927776392341215
Energy: 1.2975291298428382
Energy: 1.3918446259455421
Energy: 1.2975291318953965
Energy: 1.2927776392365415
Energy: 1.297529133892346
Energy: 1.2909527494633148
Energy: 1.4528054836752122
Energy: 1.3961769265882507
Energy: 1.4528054836764224
Energy: 1.2909527494621598
Energy: 1.4528054836776323
Energy: 1.7234678584266125
Energy: 1.681884884586985
Energy: 1.3923007875392108
Energy: 1.6818848845857746
Energy: 1.7234678584278225
Energy: 1.6818848845845646
Energy: 1.8318114226786881
Energy: 1.6242056561947658
Energy: 1.4143334104898377
Energy: 1.624205655131552
Energy: 1.8318114226798983
Energy: 1.6242056560943297
Energy: 1.293053309607993
Energy: 1.2981619860448674
Energy: 1.2826027499135446
Energy: 1.2981619860484974
Energy: 1.293053309607993
Energy: 1.2981619860484974
Energy: 1.2751588845071682
Energy: 1.5867591040275506
Energy: 1.4153054164229073
Energy: 1.586759104029971
Energy: 1.2751588845071682
Energy: 1.5867591040311806
Energy: 1.690590058013033
Energy: 1.800646752690241
Energy: 1.397132682621709
Energy: 1.8006467526890306
Energy: 1.690590058013033
Energy: 1.8006467526878207
Energy: 1.4017429796527197
Energy: 1.7442218896776025
Energy: 1.584739089333457
Energy: 1.744221889669132
Energy: 1.4017429796539298
Energy: 1.7442218896715522
Energy: 1.5720564230958016
Energy: 1.4506189439332011
Energy: 1.2785677933724489
Energy: 1.4506189428736178
Energy: 1.5720564232433754
Energy: 1.4506189441690553
Energy: 1.2915263720298864
Energy: 1.4107945009431813
Energy: 1.6559166389167765
Energy: 1.4107945009431813
Energy: 1.2915263720262562
Energy: 1.4107945009431813
Energy: 1.636699180368987
Energy: 1.7210760608194269
Energy: 1.3322668435410412
Energy: 1.721076060821847
Energy: 1.636699180366567
Energy: 1.7210760607976456

minimum gb energy = 1.2750456335795195 eV
minimum distance =  2.1750682255443 Angstroms
sigma value = 33


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

Energy: 1.5281158092873042
Energy: 1.775628246611888
Energy: 1.7328639766076144
Energy: 1.7756282466257058
Energy: 1.5281158092857687
Energy: 1.7756282466203324
Energy: 1.7180222180583797
Energy: 1.5015195058197095
Energy: 1.2433216494344679
Energy: 1.5015195062271556
Energy: 1.718022218059915
Energy: 1.501519506091352
Energy: 1.2389575176975418
Energy: 1.3089484263128357
Energy: 1.5822806638337128
Energy: 1.308948426316674
Energy: 1.2389575176975418
Energy: 1.3089484263182092
Energy: 1.2913530165598652
Energy: 1.4768413824875617
Energy: 1.255689896213753
Energy: 1.476841382497541
Energy: 1.2913530165567946
Energy: 1.4768413824668352
Energy: 1.471523783837343
Energy: 1.5537334814179047
Energy: 1.4474011951597348
Energy: 1.5537334814179047
Energy: 1.47152378383504
Energy: 1.55373348141944
Energy: 1.4540695396126184
Energy: 1.343543624583883
Energy: 1.2372588632362096
Energy: 1.3435436245861858
Energy: 1.4540695396141534
Energy: 1.3435436245815802
Energy: 1.2353565818412007
Energy: 1.258468949037804
Energy: 1.2451650494853592
Energy: 1.2584689490385714
Energy: 1.2353565818412007
Energy: 1.258468949037804
Energy: 1.2436969121612458
Energy: 1.2363277296485198
Energy: 1.4538100023401792
Energy: 1.2363277296469843
Energy: 1.2436969121650843
Energy: 1.2363277296492874
Energy: 1.4351427854037306
Energy: 1.4439989534936135
Energy: 1.4522383409548536
Energy: 1.4439989534974516
Energy: 1.4351427854029626
Energy: 1.443998953492078
Energy: 1.2520360997361004
Energy: 1.2549852993127872
Energy: 1.231066616147041
Energy: 1.2549852993112522
Energy: 1.2520360997376356
Energy: 1.254985299313555
Energy: 1.2278959792785302
Energy: 1.250798222735657
Energy: 1.2520142376432541
Energy: 1.2507982227348895
Energy: 1.2278959792777626
Energy: 1.2507982227333543
Energy: 1.23208130418742
Energy: 1.3150351088428271
Energy: 1.709125595268879
Energy: 1.3150351088443621
Energy: 1.2320813041897225
Energy: 1.3150351088435945
Energy: 1.4578094100450234
Energy: 1.5684451312359982
Energy: 1.519811742597898
Energy: 1.5684451312383012
Energy: 1.4578094099844139
Energy: 1.56844513123216
Energy: 1.2431520660517092
Energy: 1.244047447487947
Energy: 1.2348874006676769
Energy: 1.2440474474864116
Energy: 1.2431520660517092
Energy: 1.244047447485644
Energy: 1.452083276316748
Energy: 1.3080066995926727
Energy: 1.2318365418550878
Energy: 1.3080066996133644
Energy: 1.452083276317516
Energy: 1.308006699594208
Energy: 1.2556942739445287
Energy: 1.4791629979981278
Energy: 1.6214219360936122
Energy: 1.4791630195064744
Energy: 1.2556942739422257
Energy: 1.4791630031559466
Energy: 1.7018583999850252
Energy: 1.773738206888154
Energy: 1.486854892817157
Energy: 1.7737382068850833
Energy: 1.7018583999842576
Energy: 1.773738206884316
Energy: 1.2310149443957452
Energy: 1.2594906983933265
Energy: 1.5972912692486625
Energy: 1.2594906983948617
Energy: 1.2310149443957452
Energy: 1.2594906983933265
Energy: 1.4531389963907104
Energy: 1.2584610858495637
Energy: 1.234915073663198
Energy: 1.258461085851099
Energy: 1.4531389955159768
Energy: 1.2584610858487961
Energy: 1.4617858643794077
Energy: 1.5554031329539255
Energy: 1.2449847703268182
Energy: 1.5554031328802662
Energy: 1.4617858643878519
Energy: 1.5554031329347342
Energy: 1.6481938623029324
Energy: 1.4215123106362166
Energy: 1.251145475201364
Energy: 1.4215123106745642
Energy: 1.6481938623044676
Energy: 1.4215123106737966
Energy: 1.2282370249201204
Energy: 1.4740081526078141
Energy: 1.4402859066689833
Energy: 1.474008152605511
Energy: 1.2282370249193528
Energy: 1.474008152605511
Energy: 1.2444186444464653
Energy: 1.3987911130202626
Energy: 1.2353369049284797
Energy: 1.398791113019495
Energy: 1.244418644447233
Energy: 1.3987911130156567
Energy: 1.5126144488943432
Energy: 1.594506871297213
Energy: 1.226663218110469
Energy: 1.594506871297213
Energy: 1.5126144488943432
Energy: 1.5945068712979809
Energy: 1.7216576576719869
Energy: 1.3202068324321652
Energy: 1.2281284786295377
Energy: 1.3202068324329328
Energy: 1.7216576576712193
Energy: 1.3202068324337006
Energy: 1.257351224925198
Energy: 1.4009350708117747
Energy: 1.231877434449748
Energy: 1.4009350708378745
Energy: 1.2573512249290364
Energy: 1.4009350708355717
Energy: 1.2327932698314858
Energy: 1.4708391919752202
Energy: 1.4371121520436954
Energy: 1.4708391919752202
Energy: 1.232793269830718
Energy: 1.470839191975988
Energy: 1.4570544671050665
Energy: 1.4186097927680132
Energy: 1.2523268071289881
Energy: 1.418609792589989
Energy: 1.4570544671058339
Energy: 1.4186097929299168
Energy: 1.4587073676901263
Energy: 1.235748947531717
Energy: 1.2477093138730264
Energy: 1.235748947530182
Energy: 1.4587073676916618
Energy: 1.235748947530182
Energy: 1.2517863651672914
Energy: 1.2591654825610854
Energy: 1.2308816818819883
Energy: 1.2591654825603178
Energy: 1.2517863651665238
Energy: 1.259165482561853
Energy: 1.231259504272889
Energy: 1.427494259692646
Energy: 1.6483382481353441
Energy: 1.427494259688808
Energy: 1.2312595042744243
Energy: 1.427494259693414
Energy: 1.45394884636379
Energy: 1.7870461871955572
Energy: 1.478976808453167
Energy: 1.7870461871963248
Energy: 1.4539488484569885
Energy: 1.7870461871986278
Energy: 1.2540604526175663
Energy: 1.4786743042421373
Energy: 1.544592647706257
Energy: 1.4786743042490462
Energy: 1.254060452618334
Energy: 1.4786743042436725
Energy: 1.6104751398447854
Energy: 1.3092059723364924
Energy: 1.2317316367037405
Energy: 1.3092059723349572
Energy: 1.610475139845553
Energy: 1.3092059723357248
Energy: 1.2394135330419902
Energy: 1.4999163320448627
Energy: 1.5498057672580328
Energy: 1.4999163656206522
Energy: 1.2394135330427578
Energy: 1.499916400979615
Energy: 1.4696843859081732
Energy: 1.568127473445138
Energy: 1.5221290225764543
Energy: 1.568127473429785
Energy: 1.4696843847257528
Energy: 1.5681274734336235
Energy: 1.2352361670895708
Energy: 1.6338761170407734
Energy: 1.6820051926349802
Energy: 1.6338747344405726
Energy: 1.235236167088803
Energy: 1.6338764355118873

minimum gb energy = 1.226663218110469 eV
minimum distance =  2.16297039254183 Angstroms
sigma value = 41


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

Energy: 1.1218541345480766
Energy: 1.0816955966553892
Energy: 1.6356382766419997
Energy: 1.081695596653293
Energy: 1.1218541345459807
Energy: 1.081695596653293
Energy: 1.618751761771892
Energy: 1.0762075884008657
Energy: 1.0762658441932058
Energy: 1.0762075884029618
Energy: 1.618751761771892
Energy: 1.0762075884029618
Energy: 1.1224925824256722
Energy: 1.2561438921705659
Energy: 1.26510786654619
Energy: 1.2561438921705659
Energy: 1.1224925824235763
Energy: 1.2561438921705659
Energy: 1.6612355306041031
Energy: 1.0764769233022933
Energy: 1.0763212659515289
Energy: 1.0764769233001972
Energy: 1.6612355306041031
Energy: 1.0764769233022933
Energy: 1.1183010051302125
Energy: 1.465755046056073
Energy: 1.0789558395819012
Energy: 1.465755046056073
Energy: 1.1183010051134452
Energy: 1.465755046058169
Energy: 1.117125223554516
Energy: 1.136452063071401
Energy: 1.0762544811555976
Energy: 1.136452063071401
Energy: 1.1171252137500054
Energy: 1.136452063071401
Energy: 1.6614699331898517
Energy: 1.0771150942009569
Energy: 1.0814043907915916
Energy: 1.0771150942009569
Energy: 1.6614699331898517
Energy: 1.0771150942009569
Energy: 1.1235111757255711
Energy: 1.0816380877976042
Energy: 1.0766073051485234
Energy: 1.081638087791316
Energy: 1.1235111757255711
Energy: 1.081638087793412
Energy: 1.5969895747726888
Energy: 1.1379433618087615
Energy: 1.0816472319931756
Energy: 1.1379433618066657
Energy: 1.5969895747747844
Energy: 1.1379433618066657
Energy: 1.1243712346266252
Energy: 1.4644936123465093
Energy: 1.0798465646617457
Energy: 1.4644936123465093
Energy: 1.1243712346287211
Energy: 1.4644936123465093
Energy: 1.6352563709282617
Energy: 1.0807942132272932
Energy: 1.081990671243226
Energy: 1.080794213225197
Energy: 1.6352563709303574
Energy: 1.080794213225197
Energy: 1.134737276407021
Energy: 1.2553829500145928
Energy: 1.6667204736095698
Energy: 1.2553829500208327
Energy: 1.134737276409117
Energy: 1.2553829500208327
Energy: 1.6355277402551953
Energy: 1.080761684561973
Energy: 1.0819703268337795
Energy: 1.0807616845640688
Energy: 1.6355277402551953
Energy: 1.080761684561973
Energy: 1.124348672053835
Energy: 1.4641913452159967
Energy: 1.0798663425665136
Energy: 1.464191345213901
Energy: 1.124348672053835
Energy: 1.464191345211805

minimum gb energy = 1.0762075884008657 eV
minimum distance =  2.19159596784847 Angstroms
sigma value = 11


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

Energy: 1.5972192884038887
Energy: 1.317500465745191
Energy: 1.7941191579779747
Energy: 1.3175004657433498
Energy: 1.5972192884388556
Energy: 1.3175004657405873
Energy: 1.5540397165569897
Energy: 1.6024561811297848
Energy: 1.2795367921486602
Energy: 1.602456181131626
Energy: 1.5540397165569897
Energy: 1.602456181131626
Energy: 1.2805681406992644
Energy: 1.4436384221588119
Energy: 1.2798156419585147
Energy: 1.4436384221578908
Energy: 1.2805681406983436
Energy: 1.4436384221578908
Energy: 1.2906722398401655
Energy: 1.322465827430809
Energy: 1.2813917203952787
Energy: 1.322465827430809
Energy: 1.2906722398447694
Energy: 1.322465827430809
Energy: 1.5000807731837327
Energy: 1.4897691374254425
Energy: 1.2896685169483892
Energy: 1.4897691375736168
Energy: 1.5000807731828119
Energy: 1.489769135447679
Energy: 1.321453448765604
Energy: 1.5035360654451901
Energy: 1.4774902120706788
Energy: 1.503536065446111
Energy: 1.321453448765604
Energy: 1.5035360654442693
Energy: 1.2956719885082129
Energy: 1.6081074905275379
Energy: 1.343040698652644
Energy: 1.6081074905275379
Energy: 1.295671988514658
Energy: 1.6081074905266173
Energy: 1.2814922501112578
Energy: 1.3234651489571276
Energy: 1.3796000830911788
Energy: 1.323465148958969
Energy: 1.281492250110337
Energy: 1.3234651489580482
Energy: 1.5549038714913963
Energy: 1.383246931488581
Energy: 1.2801822188235168
Energy: 1.3832469314895015
Energy: 1.5549038714904755
Energy: 1.383246931488581
Energy: 1.2800182540292047
Energy: 1.5468948414627557
Energy: 1.374917718643766
Energy: 1.5468948414618349
Energy: 1.2800182540282843
Energy: 1.546894841463676
Energy: 1.4877094328400586
Energy: 1.642587411317007
Energy: 1.547607116942815
Energy: 1.6425874113124033
Energy: 1.4877094328400586
Energy: 1.6425874113280345
Energy: 1.280818273545089
Energy: 1.4853834413713458
Energy: 1.5416639091795898
Energy: 1.485383441374108
Energy: 1.2808182735460099
Energy: 1.4853834413731872
Energy: 1.2805277900415577
Energy: 1.4430447031793103
Energy: 1.5098037459195184
Energy: 1.4430447031802311
Energy: 1.2805277900424783
Energy: 1.4430447031802311
Energy: 1.2895888609038928
Energy: 1.3855725901543623
Energy: 1.2915322417561101
Energy: 1.385572590155283
Energy: 1.2895888609029724
Energy: 1.3855725901543623
Energy: 1.2804002359797448
Energy: 1.5354452168666177
Energy: 1.4779934459638415
Energy: 1.5354452168656973
Energy: 1.2804002359797448
Energy: 1.5354452168675385
Energy: 1.5632697728990426
Energy: 1.5829125651204898
Energy: 1.3231770108859715
Energy: 1.5829125651204898
Energy: 1.5632697728990426
Energy: 1.5829125651195692
Energy: 1.3429449519654904
Energy: 1.5827996226641483
Energy: 1.4577495908677822
Energy: 1.5827996222637997
Energy: 1.342944951966411
Energy: 1.5827996228647832
Energy: 1.4777859882017097
Energy: 1.5353563751734525
Energy: 1.2800687650226565
Energy: 1.5353563751734525
Energy: 1.4777859882007889
Energy: 1.5353563751725317
Energy: 1.290229034038084
Energy: 1.4438562844733243
Energy: 1.289705053775557
Energy: 1.4438562844733243
Energy: 1.290229034038084
Energy: 1.4438562844733243
Energy: 1.2796636837303532
Energy: 1.443122803837939
Energy: 1.2794679607376487
Energy: 1.443122803837939
Energy: 1.2796636837294328
Energy: 1.4431228038388595
Energy: 1.4941609036452173
Energy: 1.4458990558952323
Energy: 1.2798835318930573
Energy: 1.4458990558887872
Energy: 1.4941609036479795
Energy: 1.4458990558878664
Energy: 1.5420734985638964
Energy: 1.64240188086568
Energy: 1.4861355398740836
Energy: 1.6424018808666008
Energy: 1.5420734985684998
Energy: 1.6424018808666008
Energy: 1.491897485840845
Energy: 1.5473705615277291
Energy: 1.3031552071261001
Energy: 1.5473705615277291
Energy: 1.491897485842686
Energy: 1.5473705615286497
Energy: 1.2791582168080204
Energy: 1.3837932304484728
Energy: 1.5882615242407614
Energy: 1.3837932304484728
Energy: 1.2791582168080204
Energy: 1.3837932304503142
Energy: 1.2800588688992498
Energy: 1.3222340933253065
Energy: 1.2806277246714204
Energy: 1.322234093324386
Energy: 1.2800588688983292
Energy: 1.3222340933253065
Energy: 1.3256289768435672
Energy: 1.4891410509913399
Energy: 1.2896513626266541
Energy: 1.4891410509904188
Energy: 1.3256289768426464
Energy: 1.4891410509904188
Energy: 1.4785475400395054
Energy: 1.534775307658958
Energy: 1.5006224537588482
Energy: 1.5347753076580373
Energy: 1.4785475400376638
Energy: 1.5347753076598787
Energy: 1.289756008340373
Energy: 1.4901218160596243
Energy: 1.3215520098571198
Energy: 1.4901218160605452
Energy: 1.2897560083385313
Energy: 1.4901218160596243
Energy: 1.2819353144383216
Energy: 1.3214271463992646
Energy: 1.2966480231595061
Energy: 1.3214271464001854
Energy: 1.2819353144383216
Energy: 1.3214271464001854
Energy: 1.2799415104894916
Energy: 1.4440333457318457
Energy: 1.2820659695137318
Energy: 1.4440333457327665
Energy: 1.279941510488571
Energy: 1.4440333457318457
Energy: 1.2792241378300382
Energy: 1.6020440474425506
Energy: 1.5545375430387203
Energy: 1.6020440474425506
Energy: 1.2792241378309586
Energy: 1.6020440474416298

minimum gb energy = 1.2791582168080204 eV
minimum distance =  2.17453135005026 Angstroms
sigma value = 57


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

Energy: 1.3841744432888656
Energy: 1.4067904475128554
Energy: 1.4570615302699739
Energy: 1.4067904475161324
Energy: 1.384174443290504
Energy: 1.4067904475161324
Energy: 1.4015652721132157
Energy: 1.545134064400332
Energy: 1.3299480473767191
Energy: 1.3834183467253154
Energy: 1.4015652721115774
Energy: 1.3997160507850586
Energy: 1.3245762326670616
Energy: 1.4205167206561533
Energy: 1.3309102183014012
Energy: 1.4205167206561533
Energy: 1.3245762326670616
Energy: 1.4205167206561533
Energy: 1.3300877970609755
Energy: 1.5271450874041366
Energy: 1.330140542125789
Energy: 1.4487524531495346
Energy: 1.3300877970626137
Energy: 1.5017087338053061
Energy: 1.3309568921733925
Energy: 1.4206705109024245
Energy: 1.3341986428999262
Energy: 1.4206705109024245
Energy: 1.3309568921733925
Energy: 1.4206705109024245
Energy: 1.3300910861532733
Energy: 1.3833882626961596
Energy: 1.4044053694603438
Energy: 1.3833882626961596
Energy: 1.3300910861549118
Energy: 1.3833882626961596
Energy: 1.5794241366594983
Energy: 1.4067904475177333
Energy: 1.3841744432888656
Energy: 1.4067904475144937
Energy: 1.5794241366611366
Energy: 1.4067904475161324
Energy: 1.329948047379996
Energy: 1.3834183467253154
Energy: 1.4015652721115774
Energy: 1.3834183467253154
Energy: 1.329948047379996
Energy: 1.3834183467253154
Energy: 1.3309102182997627
Energy: 1.4205167206561533
Energy: 1.3245762326670616
Energy: 1.4205167206561533
Energy: 1.3309102183014012
Energy: 1.4205167206561533
Energy: 1.330140542125789
Energy: 1.5016915566537057
Energy: 1.3300877970626137
Energy: 1.5016914180912264
Energy: 1.330140542125789
Energy: 1.4487520340966922
Energy: 1.3341986428999262
Energy: 1.420670510904063
Energy: 1.3309568921733925
Energy: 1.4206705109024245
Energy: 1.3341986428999262
Energy: 1.4206705109024245
Energy: 1.4044053694603438
Energy: 1.383388262694521
Energy: 1.3300910861549118
Energy: 1.383388262694521
Energy: 1.4044053694587428
Energy: 1.3833882626961596
Energy: 1.384174443290504
Energy: 1.4067904475161324
Energy: 1.5794241366529447
Energy: 1.4067904475161324
Energy: 1.384174443290504
Energy: 1.4067904475161324
Energy: 1.401565272109939
Energy: 1.3834183467253154
Energy: 1.329948047379996
Energy: 1.3834183467253154
Energy: 1.4015652721115774
Energy: 1.3834183467253154
Energy: 1.3245762326654231
Energy: 1.4205167206561533
Energy: 1.3309102183014012
Energy: 1.4205167206561533
Energy: 1.3245762326637847
Energy: 1.4205167206561533
Energy: 1.3300877970626137
Energy: 1.4487515728987754
Energy: 1.3301405421274275
Energy: 1.4487516075168665
Energy: 1.3300877970626137
Energy: 1.4487515568376483
Energy: 1.330956892175031
Energy: 1.4206705109024245
Energy: 1.3341986428999262
Energy: 1.420670510904063
Energy: 1.330956892175031
Energy: 1.420670510904063

minimum gb energy = 1.3245762326637847 eV
minimum distance =  2.19749810227586 Angstroms
sigma value = 9


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

Energy: 1.6457096926837347
Energy: 1.6411893375254907
Energy: 1.7449802750204852
Energy: 1.6411893375254907
Energy: 1.6457096926837347
Energy: 1.6411893375241529
Energy: 1.5316421408226575
Energy: 1.5086976394981515
Energy: 1.4073026883515272
Energy: 1.5086976394968141
Energy: 1.5316421408213197
Energy: 1.5086976394954763
Energy: 1.3901396981131713
Energy: 1.546873552860051
Energy: 1.4076733610923429
Energy: 1.546873552860051
Energy: 1.3901396981131713
Energy: 1.546873552860051
Energy: 1.3904092708225353
Energy: 1.427092896700894
Energy: 1.4355345566335411
Energy: 1.4270928967035696
Energy: 1.3904092708211975
Energy: 1.4270928967035696
Energy: 1.4145605165423663
Energy: 1.474814636712744
Energy: 1.3545148855532363
Energy: 1.474814636710068
Energy: 1.4145605165423663
Energy: 1.4748146367087303
Energy: 1.3907701223673787
Energy: 1.4266314924117063
Energy: 1.6175126666485649
Energy: 1.4266314924063552
Energy: 1.3907701223700544
Energy: 1.4266314924050174
Energy: 1.396486543516962
Energy: 1.5096474245448468
Energy: 1.4083399708988755
Energy: 1.5096474245475222
Energy: 1.3964865435182998
Energy: 1.5096474245461846
Energy: 1.4488703312741964
Energy: 1.4986074242149432
Energy: 1.408961883865962
Energy: 1.498607424224308
Energy: 1.4488703312741964
Energy: 1.498607424221632
Energy: 1.4481985648772688
Energy: 1.4748733644235419
Energy: 1.408083854725862
Energy: 1.4748733644195287
Energy: 1.4481985648786067
Energy: 1.4748733644195287
Energy: 1.3547160424428668
Energy: 1.6331805342455668
Energy: 1.4062043719324713
Energy: 1.6331805342455668
Energy: 1.354716042441529
Energy: 1.633180534244229
Energy: 1.3895151860094201
Energy: 1.549984087023789
Energy: 1.4751419402909765
Energy: 1.5499840870264647
Energy: 1.3895151860080823
Energy: 1.5499840870264647
Energy: 1.3926875974628647
Energy: 1.4272433326878113
Energy: 1.4363125547952877
Energy: 1.4272433326864737
Energy: 1.3926875974601893
Energy: 1.4272433326851357
Energy: 1.3894046448345443
Energy: 1.472082362480717
Energy: 1.4159688367376737
Energy: 1.4720823624793793
Energy: 1.389404644835882
Energy: 1.4720823624793793
Energy: 1.3923805928035995
Energy: 1.4284351016568657
Energy: 1.414267576215327
Energy: 1.4284351016568657
Energy: 1.3923805928049373
Energy: 1.4284351016582035
Energy: 1.516266858414121
Energy: 1.5157347307277886
Energy: 1.4312005585575436
Energy: 1.5157347307277886
Energy: 1.5162668584114456
Energy: 1.5157347307291265
Energy: 1.5318322906500983
Energy: 1.523689712551521
Energy: 1.4005406263039957
Energy: 1.5236897125541968
Energy: 1.5318322906500983
Energy: 1.5236897125541968
Energy: 1.4699707046182258
Energy: 1.6278206284850327
Energy: 1.4548460242719594
Energy: 1.6278206284863705
Energy: 1.4699707046155503
Energy: 1.6278206284863705
Energy: 1.4680264775888259
Energy: 1.5627798587334476
Energy: 1.406476383731406
Energy: 1.5627798587334476
Energy: 1.4680264775901637
Energy: 1.562779858736123
Energy: 1.3903392660482208
Energy: 1.4277398200937954
Energy: 1.4076216364574055
Energy: 1.4277398200937954
Energy: 1.3903392660495588
Energy: 1.4277398200951332
Energy: 1.3908050146040443
Energy: 1.4812572108928497
Energy: 1.3978897153445429
Energy: 1.481257210891512
Energy: 1.3908050146027067
Energy: 1.4812572108928497
Energy: 1.3906123021666525
Energy: 1.4268167574716857
Energy: 1.4007721416482795
Energy: 1.426816757470348
Energy: 1.3906123021653145
Energy: 1.426816757470348

minimum gb energy = 1.3545148855532363 eV
minimum distance =  2.19992873530083 Angstroms
sigma value = 27


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

Energy: 1.4747697026696325
Energy: 1.5872122610642456
Energy: 1.4462963725443285
Energy: 1.5872122610653734
Energy: 1.4747697026696325
Energy: 1.5872122610642456
Energy: 1.3605050677579937
Energy: 1.4968227514896366
Energy: 1.3656954012777405
Energy: 1.4968227514873813
Energy: 1.360505067760249
Energy: 1.4968227514873813
Energy: 1.368705689856956
Energy: 1.524189569684849
Energy: 1.3656483101737305
Energy: 1.5241895696871044
Energy: 1.3687056898580838
Energy: 1.5241895696859766
Energy: 1.3734275526236208
Energy: 1.4264831187896203
Energy: 1.3654663917106418
Energy: 1.4264831187873648
Energy: 1.3734275526213655
Energy: 1.4264831187873648
Energy: 1.360443029056901
Energy: 1.4916744724127178
Energy: 1.3665590367365879
Energy: 1.4916744724104625
Energy: 1.3604430290557732
Energy: 1.49167447241159
Energy: 1.3799813918643036
Energy: 1.4099609304925131
Energy: 1.3729906133433405
Energy: 1.4099609304936407
Energy: 1.3799813918643036
Energy: 1.4099609304936407
Energy: 1.3741859402978365
Energy: 1.4456429179158279
Energy: 1.3665011443006074
Energy: 1.4456429179169554
Energy: 1.3741859402978365
Energy: 1.4456429179180832
Energy: 1.362892139001848
Energy: 1.437715691847727
Energy: 1.3663667705691496
Energy: 1.437715691847727
Energy: 1.362892139001848
Energy: 1.437715691847727
Energy: 1.418557214315802
Energy: 1.4235348568566
Energy: 1.4468204349871192
Energy: 1.4235348568577277
Energy: 1.4185572143169298
Energy: 1.4235348568566
Energy: 1.36292051466684
Energy: 1.5183886686240409
Energy: 1.4247053684145103
Energy: 1.518388668622913
Energy: 1.3629205146679677
Energy: 1.5183886686251684
Energy: 1.3629252802631642
Energy: 1.518145009618955
Energy: 1.4247417334929184
Energy: 1.5181450096144702
Energy: 1.3629252802620366
Energy: 1.5181450096167255
Energy: 1.417825819588147
Energy: 1.4235401868476916
Energy: 1.446923587031848
Energy: 1.4235401868488191
Energy: 1.4178258195904023
Energy: 1.4235401868488191
Energy: 1.362905302066562
Energy: 1.4377557472096452
Energy: 1.3664285805535767
Energy: 1.4377557472085174
Energy: 1.3629053020654345
Energy: 1.4377557472085174
Energy: 1.3741926622308918
Energy: 1.4456892400790928
Energy: 1.3665241718622538
Energy: 1.4456892400802204
Energy: 1.3741926622320195
Energy: 1.4456892400802204
Energy: 1.3799840091817532
Energy: 1.4096411280770276
Energy: 1.376611308228696
Energy: 1.4096411280747723
Energy: 1.3799840091806257
Energy: 1.4096411280747723
Energy: 1.3604127985566068
Energy: 1.4916744724104625
Energy: 1.366479231629548
Energy: 1.4916744724104625
Energy: 1.3604127985566068
Energy: 1.4916744724127178
Energy: 1.373413817913133
Energy: 1.4266665688542066
Energy: 1.3937065855126165
Energy: 1.4266665688542066
Energy: 1.3734138179109034
Energy: 1.426666568853079
Energy: 1.3687715992191045
Energy: 1.5243895206813016
Energy: 1.3656458418211024
Energy: 1.5243895206813016
Energy: 1.3687715992191045
Energy: 1.5243895206801739
Energy: 1.3606062941527612
Energy: 1.4967260407907441
Energy: 1.3656963926186125
Energy: 1.4967260407918719
Energy: 1.360606294153889
Energy: 1.4967260407907441
Energy: 1.4747697026696325
Energy: 1.5872122610653734
Energy: 1.4677567946650945
Energy: 1.5872122610631179
Energy: 1.474769702668505
Energy: 1.5872122610642456
Energy: 1.3605050677579937
Energy: 1.4968227514873813
Energy: 1.3656954012777405
Energy: 1.4968227514930192
Energy: 1.3605050677591213
Energy: 1.4968227514862535
Energy: 1.3687056898558285
Energy: 1.5241895696859766
Energy: 1.3656483101737305
Energy: 1.524189569684849
Energy: 1.368705689856956
Energy: 1.5241895696837213
Energy: 1.3734275526224933
Energy: 1.4264831187873648
Energy: 1.3654663917106418
Energy: 1.4264831187884925
Energy: 1.3734275526224933
Energy: 1.4264831187884925
Energy: 1.3604430290580287
Energy: 1.4916744724104625
Energy: 1.3665590367365879
Energy: 1.4916744724127178
Energy: 1.3604430290580287
Energy: 1.4916744724127178
Energy: 1.379981391865431
Energy: 1.4099609304925131
Energy: 1.3729906133467236
Energy: 1.4099609304913854
Energy: 1.379981391865431
Energy: 1.4099609304925131

minimum gb energy = 1.3604127985566068 eV
minimum distance =  2.20272449104858 Angstroms
sigma value = 19


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

Energy: 1.5769134943652308
Energy: 1.3516651517960252
Energy: 1.5366507994757526
Energy: 1.351665151797972
Energy: 1.5769134943662042
Energy: 1.351665151797972
Energy: 1.437022781362122
Energy: 1.433303505919523
Energy: 1.318093627288365
Energy: 1.433303505916603
Energy: 1.437022781362122
Energy: 1.4333035059185497
Energy: 1.311943609785355
Energy: 1.483954376244544
Energy: 1.3183111565333627
Energy: 1.4839543762464908
Energy: 1.3119436097834083
Energy: 1.4839543762464908
Energy: 1.348565023826451
Energy: 1.5011918251431235
Energy: 1.3377418230610052
Energy: 1.5011918251431235
Energy: 1.348565023826451
Energy: 1.5011918251431235
Energy: 1.346571780087376
Energy: 1.3914949276591928
Energy: 1.3375471229090543
Energy: 1.391494927660166
Energy: 1.346571780087376
Energy: 1.391494927660166
Energy: 1.3156484817297593
Energy: 1.4023226816383594
Energy: 1.337975019975971
Energy: 1.4023226816393326
Energy: 1.3156484817287861
Energy: 1.4023226816383594
Energy: 1.3267387774681074
Energy: 1.4345527312208972
Energy: 1.3266609803099254
Energy: 1.4345527312218707
Energy: 1.3267387774681074
Energy: 1.434552731222844
Energy: 1.3272362109342792
Energy: 1.402032393484275
Energy: 1.3380144848639242
Energy: 1.4020323934833017
Energy: 1.3272362109342792
Energy: 1.4020323934833017
Energy: 1.3482916273968366
Energy: 1.4509901097462596
Energy: 1.3599536059017299
Energy: 1.4509901097462596
Energy: 1.34829162739489
Energy: 1.4509901097462596
Energy: 1.3445990647352428
Energy: 1.5688547301543474
Energy: 1.3186783740659704
Energy: 1.5688547301543474
Energy: 1.3445990647352428
Energy: 1.5688547301543474
Energy: 1.3231558475595198
Energy: 1.5337426775214902
Energy: 1.3183128816832446
Energy: 1.5337426775195433
Energy: 1.3231558475585465
Energy: 1.5337426775195433
Energy: 1.3478860435153008
Energy: 1.4880859582613988
Energy: 1.320830760765158
Energy: 1.4880859582613988
Energy: 1.3478860435153008
Energy: 1.4880859582604256
Energy: 1.3475460103044383
Energy: 1.4469419354251953
Energy: 1.3184678047860467
Energy: 1.4469419354232484
Energy: 1.3475460103034649
Energy: 1.446941935424222
Energy: 1.3301717349304503
Energy: 1.5341333274129845
Energy: 1.4598359713194715
Energy: 1.5341333274129845
Energy: 1.3301717349285036
Energy: 1.5341333274129845
Energy: 1.3482992960984168
Energy: 1.5078008048808549
Energy: 1.3211380129338894
Energy: 1.5078008048808549
Energy: 1.3482992960984168
Energy: 1.5078008048818283
Energy: 1.3490681722915892
Energy: 1.3911908572911376
Energy: 1.2994617643146997
Energy: 1.3911908572930844
Energy: 1.349068172290616
Energy: 1.391190857292111
Energy: 1.3123968062492433
Energy: 1.4015815672826828
Energy: 1.3319688877340974
Energy: 1.4015815672817094
Energy: 1.3123968062502165
Energy: 1.4015815672817094
Energy: 1.3257103939241945
Energy: 1.4355882645193176
Energy: 1.2976252680818297
Energy: 1.4355882645767029
Energy: 1.3257103939232213
Energy: 1.4355882643334683
Energy: 1.3123687138617957
Energy: 1.4017224468585954
Energy: 1.3320686030388118
Energy: 1.4017224468595688
Energy: 1.3123687138627693
Energy: 1.4017224468595688
Energy: 1.348764197277466
Energy: 1.4507151919763694
Energy: 1.3278397168353866
Energy: 1.4507151919763694
Energy: 1.3487641972764925
Energy: 1.4507151919763694
Energy: 1.348332085405755
Energy: 1.5011898769950913
Energy: 1.3185219969957884
Energy: 1.501189876996065
Energy: 1.3483320854038081
Energy: 1.501189876996065
Energy: 1.3316182964901266
Energy: 1.4570474271147864
Energy: 1.459941695634956
Energy: 1.4570474271147864
Energy: 1.3316182964891532
Energy: 1.4570474271147864
Energy: 1.3813144083652038
Energy: 1.5267118000360465
Energy: 1.3191351134349891
Energy: 1.5267118000360465
Energy: 1.381314408366177
Energy: 1.5267118000360465
Energy: 1.3812064357836369
Energy: 1.3395385036755958
Energy: 1.3185713930749474
Energy: 1.3395385036755958
Energy: 1.3812064357846103
Energy: 1.3395385036755958
Energy: 1.4442223788159494
Energy: 1.5108562721903636
Energy: 1.3437867471162521
Energy: 1.5108562721903636
Energy: 1.4442223788169228
Energy: 1.5108562721903636
Energy: 1.3498379909870353
Energy: 1.4925704589686792
Energy: 1.3180196518057927
Energy: 1.4925704589686792
Energy: 1.3498379909870353
Energy: 1.4925704589667326
Energy: 1.348610926396161
Energy: 1.4637515101013574
Energy: 1.3275709365268435
Energy: 1.463751510102331
Energy: 1.3486109263971344
Energy: 1.463751510102331
Energy: 1.3273888613013058
Energy: 1.4021458411820655
Energy: 1.3381615115024683
Energy: 1.4021458411849856
Energy: 1.3273888613013058
Energy: 1.4021458411849856
Energy: 1.3259531232766273
Energy: 1.4301266993646733
Energy: 1.3339369339405984
Energy: 1.4301266993675936
Energy: 1.3259531232756538
Energy: 1.4301266993666202

minimum gb energy = 1.2976252680818297 eV
minimum distance =  2.18563165724411 Angstroms
sigma value = 101


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

Energy: 1.4942786923948739
Energy: 1.4048197325266496
Energy: 1.4795282305770894
Energy: 1.404819732537773
Energy: 1.4942786923991522
Energy: 1.4048197325292167
Energy: 1.284649921746531
Energy: 1.4000182148802431
Energy: 1.2836990122733054
Energy: 1.4000182148819547
Energy: 1.2846499217456753
Energy: 1.4000182148802431
Energy: 1.256766335565868
Energy: 1.4226383612955271
Energy: 1.2843880689661946
Energy: 1.4226383612972384
Energy: 1.256766335565868
Energy: 1.4226383612980942
Energy: 1.3006168601409316
Energy: 1.379484018376464
Energy: 1.2815761387601696
Energy: 1.370330498660828
Energy: 1.300616860141787
Energy: 1.3854226712394224
Energy: 1.251562117291276
Energy: 1.355319992467714
Energy: 1.257111437502126
Energy: 1.3553199924685695
Energy: 1.2515621172887093
Energy: 1.3553199924694252
Energy: 1.2569679315042137
Energy: 1.423043980566531
Energy: 1.250719745906579
Energy: 1.423043980566531
Energy: 1.2569679315042137
Energy: 1.4230439805673865
Energy: 1.2569584141094463
Energy: 1.4350661414695405
Energy: 1.2515421794300972
Energy: 1.4350661414695405
Energy: 1.2569584141094463
Energy: 1.4350661414703962
Energy: 1.2562587959066258
Energy: 1.4892671541267215
Energy: 1.2567515559485911
Energy: 1.4132628041219335
Energy: 1.2562587959049145
Energy: 1.4892671541250104
Energy: 1.2515072519442483
Energy: 1.4040740090438428
Energy: 1.2570932227896785
Energy: 1.4040740090429868
Energy: 1.2515072519442483
Energy: 1.404074009045554
Energy: 1.2506559358077813
Energy: 1.3890155029275628
Energy: 1.2515667511157087
Energy: 1.3890155029284184
Energy: 1.2506559358077813
Energy: 1.3890155029284184
Energy: 1.3041446346326842
Energy: 1.3807389855457903
Energy: 1.3348057416009933
Energy: 1.3807389855483574
Energy: 1.3041446346309729
Energy: 1.3807389855483574
Energy: 1.2838481003675373
Energy: 1.421969604323696
Energy: 1.2506479085595625
Energy: 1.4219696043228403
Energy: 1.283848100368393
Energy: 1.4219696043228403
Energy: 1.2844018365315142
Energy: 1.4242247334931526
Energy: 1.2990005933494186
Energy: 1.4242247334931526
Energy: 1.2844018365315142
Energy: 1.4242247334931526
Energy: 1.298784856482937
Energy: 1.27996936657434
Energy: 1.2835118574250517
Energy: 1.3210579750760283
Energy: 1.2987848564820814
Energy: 1.27996936657434
Energy: 1.2598336969497228
Energy: 1.6137228543500965
Energy: 1.28377814065333
Energy: 1.6137228543492408
Energy: 1.2598336969514339
Energy: 1.6137228543500965
Energy: 1.3347397862651251
Energy: 1.4218144972429858
Energy: 1.2558759877351486
Energy: 1.4218144972421303
Energy: 1.3347397862659809
Energy: 1.4218144972421303
Energy: 1.251607842899424
Energy: 1.4291968298286173
Energy: 1.298232041684451
Energy: 1.4291968298192048
Energy: 1.2516078429002797
Energy: 1.4291968298260502
Energy: 1.2564899800373044
Energy: 1.3543173534115502
Energy: 1.2505419350631841
Energy: 1.3543173534098392
Energy: 1.2564899800373044
Energy: 1.3543173534106945
Energy: 1.260926952024234
Energy: 1.3875907391261364
Energy: 1.2572298182182868
Energy: 1.3875907391278475
Energy: 1.2609269520233783
Energy: 1.3875907391287032
Energy: 1.2516138888132617
Energy: 1.4330497407050824
Energy: 1.2510015834246337
Energy: 1.4330497407050824
Energy: 1.2516138888132617
Energy: 1.4330497407050824
Energy: 1.2671916348491736
Energy: 1.3545699777263684
Energy: 1.2569637842526238
Energy: 1.3545699777263684
Energy: 1.2671916348500294
Energy: 1.3545699777263684
Energy: 1.2506952652080785
Energy: 1.4238315655790283
Energy: 1.2507224247090112
Energy: 1.4238315655781728
Energy: 1.2506952652089343
Energy: 1.4238315655781728
Energy: 1.2731708080336477
Energy: 1.3879432957480078
Energy: 1.2513145947844544
Energy: 1.3879432957480078
Energy: 1.2731708080319362
Energy: 1.3879432957480078
Energy: 1.300648321895861
Energy: 1.4291870329391199
Energy: 1.2974627287609386
Energy: 1.4291870329399756
Energy: 1.300648321899284
Energy: 1.4291870329399756
Energy: 1.251481857081217
Energy: 1.542432469038747
Energy: 1.2504506444906778
Energy: 1.5424324690378912
Energy: 1.2514818570820727
Energy: 1.5424324690370355
Energy: 1.2785048240006562
Energy: 1.42186544410961
Energy: 1.3347590143568768
Energy: 1.42186544410961
Energy: 1.2785048240006562
Energy: 1.4218654441104652
Energy: 1.2841294094352311
Energy: 1.4655356828784385
Energy: 1.2509741230189626
Energy: 1.4655356828784385
Energy: 1.2841294094360867
Energy: 1.4655356828784385
Energy: 1.2836717312255883
Energy: 1.4685456407311337
Energy: 1.2513849487612467
Energy: 1.4685456407319897
Energy: 1.2836717312255883
Energy: 1.4685456407319897
Energy: 1.3595888293349976
Energy: 1.3686141798282891
Energy: 1.3685747231727738
Energy: 1.3686141798282891
Energy: 1.359588829334142
Energy: 1.3686141798274336
Energy: 1.2507748454839989
Energy: 1.3894797799452383
Energy: 1.2513247605538593
Energy: 1.3894797799452383
Energy: 1.2507748454839989
Energy: 1.3894797799443828
Energy: 1.2982195385272302
Energy: 1.4306862498488568
Energy: 1.2557409054436002
Energy: 1.4306862498488568
Energy: 1.2982195385280468
Energy: 1.430686249848001
Energy: 1.2785157228113535
Energy: 1.3883094952640844
Energy: 1.2507778266288954
Energy: 1.3883094952649402
Energy: 1.2785157228130646
Energy: 1.3883094952649402
Energy: 1.2514650555905502
Energy: 1.3971805207300068
Energy: 1.2731877005439007
Energy: 1.3971805207300068
Energy: 1.251465055589695
Energy: 1.3971805207308625

minimum gb energy = 1.2504506444906778 eV
minimum distance =  2.1969845842447 Angstroms
sigma value = 33


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

Energy: 0.01449702973016324
Energy: 0.015075244944422092
Energy: 1.3642989264422671
Energy: 0.015075244944422092
Energy: 0.01449702973016324
Energy: 0.015075244944422092
Energy: 0.014532201460059575
Energy: 0.7894973358251683
Energy: 0.014532201459348644
Energy: 0.7894973358265902
Energy: 0.014532201459348644
Energy: 0.7894973358231147
Energy: 1.481210978552715
Energy: 0.015075244944422092
Energy: 0.014497029729452311
Energy: 0.015075244944422092
Energy: 1.4812109785533867
Energy: 0.015075244944422092
Energy: 0.014532201458637711
Energy: 0.7894973358217323
Energy: 0.014532201458637711
Energy: 0.789497335823786
Energy: 0.014532201459348644
Energy: 0.7894973358231147

minimum gb energy = 0.014497029729452311 eV
minimum distance =  2.41754767536091 Angstroms
sigma value = 1