Model name: model_name=EAM_Dynamo_MendelevHanSon_2007_VFe__MO_249706810527_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=2.855312779545784
cohesive_energy=4.013297914062382
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: 0.012434284733528539
Energy: 0.012643439866200522
Energy: 0.4125037832942757
Energy: 0.012643439864245633
Energy: 0.012434284734031225
Energy: 0.012643439866703209
Energy: 0.012643439864720392
Energy: 2.161153046461616
Energy: 0.012643439862262818
Energy: 2.653284022846018
Energy: 0.012643439871115672
Energy: 2.161153046463096
Energy: 0.412503783295728
Energy: 0.012643439867177968
Energy: 0.012434284734505984
Energy: 0.012643439863268189
Energy: 0.412503783295728
Energy: 0.012643439863742948
Energy: 0.012643439867680652
Energy: 2.653284022846018
Energy: 0.012643439862262818
Energy: 2.65348224847635
Energy: 0.012643439867177968
Energy: 2.161153046463571
Energy: 0.012434284734031225
Energy: 0.012643439870138228
Energy: 0.4125037832947505
Energy: 0.012643439872093118
Energy: 0.012434284734031225
Energy: 0.012643439869635544
Energy: 0.012643439866200522
Energy: 2.1611530464650515
Energy: 0.012643439861788057
Energy: 2.161153046458181
Energy: 0.012643439872093118
Energy: 2.161153046466029

minimum gb energy = 0.012434284733528539 eV
minimum distance =  2.45365679340303 Angstroms
sigma value = 1


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

Energy: 1.287723915889048
Energy: 1.3497215435173378
Energy: 1.2214640573998805
Energy: 1.3497215435173378
Energy: 1.287723915890258
Energy: 1.3497215435173378
Energy: 1.2432081304003217
Energy: 1.3151880929769044
Energy: 1.2836488149141523
Energy: 1.3151880929781143
Energy: 1.2432081304003217
Energy: 1.3151880929781143
Energy: 1.1297947865233269
Energy: 1.3159815452922634
Energy: 1.284160641109296
Energy: 1.3159815452922634
Energy: 1.1297947865233269
Energy: 1.3159815452910535
Energy: 1.310455424401586
Energy: 1.2799476175779185
Energy: 1.1333945436433372
Energy: 1.2799476175803386
Energy: 1.310455424401586
Energy: 1.2799476175742883
Energy: 1.303944735143292
Energy: 1.3382734319207898
Energy: 1.2679938866494878
Energy: 1.3382734319195801
Energy: 1.3039447351360318
Energy: 1.3382734319195801
Energy: 1.2807466735761202
Energy: 1.3197845173892817
Energy: 1.1362485127424435
Energy: 1.3197845173904919
Energy: 1.28074667357733
Energy: 1.3197845173917018
Energy: 1.2795342676733663
Energy: 1.314499344878876
Energy: 1.1355795737369714
Energy: 1.314499344880086
Energy: 1.2795342676733663
Energy: 1.314499344880086
Energy: 1.327426811270535
Energy: 1.3394869540852699
Energy: 1.1331644624054802
Energy: 1.3394869540852699
Energy: 1.3274268112717447
Energy: 1.33948695408406
Energy: 1.3382615840774401
Energy: 1.26912080836063
Energy: 1.1319140487910573
Energy: 1.26912080836063
Energy: 1.3382615840762302
Energy: 1.26912080835942
Energy: 1.2800321939092099
Energy: 1.3134286527499968
Energy: 1.136632083302742
Energy: 1.3134286527512071
Energy: 1.2800321939092099
Energy: 1.3134286527512071
Energy: 1.1301492513860032
Energy: 1.2748486354039599
Energy: 1.241566272572401
Energy: 1.2748486354051698
Energy: 1.130149251388423
Energy: 1.2748486354088
Energy: 1.134500772853266
Energy: 1.3378299729735776
Energy: 1.134453679107404
Energy: 1.3378299729723677
Energy: 1.134500772853266
Energy: 1.3378299729723677
Energy: 1.2414229417986418
Energy: 1.2748486353930695
Energy: 1.2429239481902767
Energy: 1.274848635374919
Energy: 1.2414229417986418
Energy: 1.2748486353930695
Energy: 1.1366863066470931
Energy: 1.3133426871995688
Energy: 1.2800443017346383
Energy: 1.3133426872007785
Energy: 1.1366863066470931
Energy: 1.3133426872007785
Energy: 1.1320126492779823
Energy: 1.270202172105858
Energy: 1.3372124912119963
Energy: 1.2702021721046477
Energy: 1.1320126492779823
Energy: 1.270202172105858
Energy: 1.1332287620133124
Energy: 1.3397627251811424
Energy: 1.327209068618929
Energy: 1.339762725178722
Energy: 1.1332287620133124
Energy: 1.3397627251799322
Energy: 1.1355087499343817
Energy: 1.3145279418242246
Energy: 1.27885488812439
Energy: 1.3145279418242246
Energy: 1.1355087499355918
Energy: 1.3145279418242246
Energy: 1.1359789458407892
Energy: 1.3198251523519895
Energy: 1.2826918030724084
Energy: 1.3198251523519895
Energy: 1.1359789458407892
Energy: 1.3198251523519895
Energy: 1.3098294071084489
Energy: 1.3383330702519118
Energy: 1.3045775528724444
Energy: 1.3383330702531218
Energy: 1.3098294071084489
Energy: 1.338333070250702
Energy: 1.1320367857411957
Energy: 1.2875396922071414
Energy: 1.3106930408110404
Energy: 1.2875396922059315
Energy: 1.132036785742406
Energy: 1.2875396922059315
Energy: 1.2835336334731837
Energy: 1.315960832004997
Energy: 1.1297826972176261
Energy: 1.315960832004997
Energy: 1.2835336334731837
Energy: 1.315960832004997
Energy: 1.2808650787373548
Energy: 1.313807446584202
Energy: 1.2431897816327804
Energy: 1.313807446584202
Energy: 1.2808650787385647
Energy: 1.313807446584202
Energy: 1.2675441186050993
Energy: 1.3497215435161276
Energy: 1.287723915891468
Energy: 1.3497215435173378
Energy: 1.2675441186050993
Energy: 1.3497215435173378

minimum gb energy = 1.1297826972176261 eV
minimum distance =  2.23355894618199 Angstroms
sigma value = 33


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

Energy: 1.7663288620324649
Energy: 1.413263642395664
Energy: 1.2769093898502986
Energy: 1.4132636423970406
Energy: 1.7663288620317767
Energy: 1.413263642395664
Energy: 1.3242063910739978
Energy: 1.3730366239092262
Energy: 1.3699282669653803
Energy: 1.373036623905785
Energy: 1.3242063910753743
Energy: 1.373036623908538
Energy: 1.1945468200904596
Energy: 1.4041361712158378
Energy: 1.3641983664224868
Energy: 1.4041361712179026
Energy: 1.1945468200904596
Energy: 1.4041361712179026
Energy: 1.3111336771217743
Energy: 1.3599320709917337
Energy: 1.3894915956815004
Energy: 1.359932070989669
Energy: 1.3111336771224626
Energy: 1.359932070989669
Energy: 1.30047993510225
Energy: 1.3836335623176812
Energy: 1.3507740611593702
Energy: 1.3836335623197145
Energy: 1.3004799351043148
Energy: 1.3836335623204028
Energy: 1.353392613719523
Energy: 1.385326121019762
Energy: 1.2006261455327472
Energy: 1.3853261210156327
Energy: 1.353392613721588
Energy: 1.3853261210163208
Energy: 1.2787247791925889
Energy: 1.3859721170529635
Energy: 1.2905348533727072
Energy: 1.3859721170508987
Energy: 1.2787247791925889
Energy: 1.3859721170481458
Energy: 1.2229144876326417
Energy: 1.3999598852597426
Energy: 1.3049035953793677
Energy: 1.3999598852618074
Energy: 1.2229144876319535
Energy: 1.3999598852618074
Energy: 1.3084747658635774
Energy: 1.3291380804989932
Energy: 1.2744253471787117
Energy: 1.3291380805010582
Energy: 1.3084747658642657
Energy: 1.3291380805017465
Energy: 1.2827670969321627
Energy: 1.4041999076864697
Energy: 1.285875755787005
Energy: 1.4041999076912874
Energy: 1.2827670969328508
Energy: 1.4041999076912874
Energy: 1.2496975425608197
Energy: 1.4798802565958085
Energy: 1.4587872588355728
Energy: 1.4798802565985616
Energy: 1.2496975425601315
Energy: 1.4798802565985616
Energy: 1.4575020634445488
Energy: 1.395714408473921
Energy: 1.2411563088508542
Energy: 1.395714408473233
Energy: 1.4575020634438605
Energy: 1.395714408473233
Energy: 1.3811045272353064
Energy: 1.3553386307963906
Energy: 1.2695546783107352
Energy: 1.3553386307901962
Energy: 1.3811045272359948
Energy: 1.3553386307908846
Energy: 1.2840872245594512
Energy: 1.4035566570313296
Energy: 1.3073941180437412
Energy: 1.4035566570306417
Energy: 1.2840872245594512
Energy: 1.4035566570299531
Energy: 1.3648049865339358
Energy: 1.3975753505916177
Energy: 1.3366483968179776
Energy: 1.397575350592306
Energy: 1.3648049865332479
Energy: 1.397575350592306
Energy: 1.364865947453558
Energy: 1.4114279115771324
Energy: 1.269262935179971
Energy: 1.411427911578509
Energy: 1.3648659474521814
Energy: 1.4114279115778208
Energy: 1.3702849447151695
Energy: 1.38349321859618
Energy: 1.286767702743847
Energy: 1.3834932185968682
Energy: 1.3702849447144811
Energy: 1.38349321859618
Energy: 1.3752152450294226
Energy: 1.3822972580729327
Energy: 1.4308603086160017
Energy: 1.3822972580701798
Energy: 1.3752152450287343
Energy: 1.382297258070868
Energy: 1.2001744172614104
Energy: 1.4008867599538584
Energy: 1.2749781361722297
Energy: 1.4008867599572998
Energy: 1.2001744172614104
Energy: 1.4008867599572998
Energy: 1.3121053832162832
Energy: 1.3343223867763492
Energy: 1.355407247241762
Energy: 1.334322386777726
Energy: 1.3121053832135303
Energy: 1.334322386775661
Energy: 1.4580030809404454
Energy: 1.4321815288767135
Energy: 1.2443422906358947
Energy: 1.4321815288794664
Energy: 1.458003080939757
Energy: 1.4321815288794664
Energy: 1.2675679207984563
Energy: 1.3789615663805674
Energy: 1.4273302134247057
Energy: 1.3789615663833203
Energy: 1.2675679208012096
Energy: 1.3789615663826322
Energy: 1.2857319044009867
Energy: 1.385337417475808
Energy: 1.3510224984824961
Energy: 1.3853374174751196
Energy: 1.2857319044016753
Energy: 1.3853374174744313
Energy: 1.4349212857504028
Energy: 1.377444367793741
Energy: 1.3750082316851748
Energy: 1.377444367793741
Energy: 1.4349212857510907
Energy: 1.377444367793741
Energy: 1.3165929290917038
Energy: 1.3947385049730643
Energy: 1.3639673021399683
Energy: 1.3947385049716876
Energy: 1.3165929290923921
Energy: 1.3947385049730643
Energy: 1.3703999378043188
Energy: 1.422447881125871
Energy: 1.1967380626619228
Energy: 1.422447881123118
Energy: 1.3703999378091365
Energy: 1.422447881123118
Energy: 1.2923414285428059
Energy: 1.4067123323535038
Energy: 1.2240453050131874
Energy: 1.4067123323548805
Energy: 1.2923414285366113
Energy: 1.4067123323548805
Energy: 1.3241642755700735
Energy: 1.3919279214333369
Energy: 1.3638550643533829
Energy: 1.3919279214340254
Energy: 1.3241642755693852
Energy: 1.3919279214333369
Energy: 1.4727545693939867
Energy: 1.3782907834287317
Energy: 1.2700623535374085
Energy: 1.378290783424602
Energy: 1.4727545693953632
Energy: 1.3782907834252904
Energy: 1.2856218127447312
Energy: 1.3857811615530282
Energy: 1.3702083326775545
Energy: 1.3857811615523397
Energy: 1.2856218127447312
Energy: 1.3857811615523397
Energy: 1.2509336533836035
Energy: 1.378961566381944
Energy: 1.4172241840565585
Energy: 1.3789615663833203
Energy: 1.250933653382227
Energy: 1.3789615663826322
Energy: 1.4578189239541024
Energy: 1.432279640618363
Energy: 1.2015871677929346
Energy: 1.4322796406231808
Energy: 1.4578189239541024
Energy: 1.4322796406231808
Energy: 1.262187544031484
Energy: 1.3321714887651581
Energy: 1.3602220699243284
Energy: 1.3321714887617166
Energy: 1.262187544031484
Energy: 1.3321714887637814
Energy: 1.2002950081335375
Energy: 1.3863998802322235
Energy: 1.4160230423153741
Energy: 1.3863998802281254
Energy: 1.2002950081328496
Energy: 1.3863998802288136
Energy: 1.371011132144909
Energy: 1.3824659682578533
Energy: 1.3543696464965709
Energy: 1.382465968256477
Energy: 1.3710111321442209
Energy: 1.3824659682571652
Energy: 1.3719380774050942
Energy: 1.3831487266020916
Energy: 1.2871180140570901
Energy: 1.38314872660278
Energy: 1.3719380774050942
Energy: 1.38314872660278
Energy: 1.3676422723791757
Energy: 1.3913545578270192
Energy: 1.3016687701232332
Energy: 1.3913545578228896
Energy: 1.3676422723784876
Energy: 1.3913545578222013
Energy: 1.3629463814308322
Energy: 1.3950359668190522
Energy: 1.3755770377454293
Energy: 1.3950359668135464
Energy: 1.3629463814308322
Energy: 1.3950359668135464
Energy: 1.2822809228270866
Energy: 1.4038652020925182
Energy: 1.307493726274688
Energy: 1.4038652020883886
Energy: 1.282280922827775
Energy: 1.4038652020883886
Energy: 1.4090474331666363
Energy: 1.352908571740996
Energy: 1.254198539878503
Energy: 1.3529085717368667
Energy: 1.409047433163195
Energy: 1.3529085717430611
Energy: 1.4572351064225886
Energy: 1.395157062546984
Energy: 1.3076449878746008
Energy: 1.395157062542166
Energy: 1.4572351064225886
Energy: 1.3951570625414778

minimum gb energy = 1.1945468200904596 eV
minimum distance =  2.21729622205165 Angstroms
sigma value = 51


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

Energy: 1.6447552209318232
Energy: 1.5074377600058664
Energy: 1.3797206919268075
Energy: 1.5074377600042719
Energy: 1.6447552209318232
Energy: 1.5074377600042719
Energy: 1.320463076261172
Energy: 1.421704520449453
Energy: 1.465180554741597
Energy: 1.421704520449453
Energy: 1.320463076261172
Energy: 1.421704520449453
Energy: 1.2530242874948532
Energy: 1.425754777941208
Energy: 1.510032837623051
Energy: 1.4257547779396134
Energy: 1.2530242874948532
Energy: 1.4257547779396134
Energy: 1.264459252602173
Energy: 1.4199925470110246
Energy: 1.4691511075655124
Energy: 1.4199925470110246
Energy: 1.2644592526005785
Energy: 1.4199925470110246
Energy: 1.2889274397113089
Energy: 1.4199019942935747
Energy: 1.3315740221913934
Energy: 1.4199019942935747
Energy: 1.2889274397113089
Energy: 1.4199019942920164
Energy: 1.4588554286796556
Energy: 1.3663769129617913
Energy: 1.4820161178691027
Energy: 1.3663769129617913
Energy: 1.4588554286796556
Energy: 1.3663769129586019
Energy: 1.4587141072462468
Energy: 1.3655929979017754
Energy: 1.3230983577765807
Energy: 1.3655929978969912
Energy: 1.4587141072462468
Energy: 1.3655929978985857
Energy: 1.2840708095308535
Energy: 1.434246998819329
Energy: 1.2505408876891406
Energy: 1.434246998819329
Energy: 1.2840708095308535
Energy: 1.434246998819329
Energy: 1.459297685648335
Energy: 1.4729241425539665
Energy: 1.2072878583476632
Energy: 1.4729241425555613
Energy: 1.459297685659498
Energy: 1.4729241425555613
Energy: 1.2551718057543704
Energy: 1.4258257391521119
Energy: 1.2507466516516703
Energy: 1.4258257391521119
Energy: 1.2551718057543704
Energy: 1.4258257391537066
Energy: 1.4916060418849117
Energy: 1.3664689224003845
Energy: 1.467805413475681
Energy: 1.3664689224003845
Energy: 1.4916060418849117
Energy: 1.3664689224003845
Energy: 1.6448279915508512
Energy: 1.5082690918436448
Energy: 1.48143682207914
Energy: 1.508269091846834
Energy: 1.6448279915508512
Energy: 1.508269091846834
Energy: 1.408818759744138
Energy: 1.4256304206068848
Energy: 1.4655461484918886
Energy: 1.4256304206068848
Energy: 1.408818759744138
Energy: 1.4256304206068848
Energy: 1.2549398840966408
Energy: 1.4256002122125413
Energy: 1.4695092721860656
Energy: 1.425600212214136
Energy: 1.2549398840966408
Energy: 1.425600212214136
Energy: 1.2532313033209386
Energy: 1.4259772192627118
Energy: 1.4669569896233103
Energy: 1.4259772192627118
Energy: 1.2532313033209386
Energy: 1.4259772192627118
Energy: 1.2905857147146484
Energy: 1.4209941606565533
Energy: 1.4681035786433607
Energy: 1.4209941606581478
Energy: 1.2905857147146484
Energy: 1.4209941606581478
Energy: 1.4586862328725323
Energy: 1.4261456061422646
Energy: 1.4829279538957139
Energy: 1.4261456061422646
Energy: 1.4586862328725323
Energy: 1.4261456061422646
Energy: 1.4592193311147934
Energy: 1.3682577593934568
Energy: 1.4397748115307154
Energy: 1.368257759391862
Energy: 1.4592193311068198
Energy: 1.3682577593934568

minimum gb energy = 1.2072878583476632 eV
minimum distance =  2.20706093658375 Angstroms
sigma value = 19


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

Energy: 1.5669674848101243
Energy: 1.5466196910522745
Energy: 1.4240670096885715
Energy: 1.5466196910522745
Energy: 1.5669674848110704
Energy: 1.5466196910541663
Energy: 1.2781019139447747
Energy: 1.4693039785129243
Energy: 1.4392717319229593
Energy: 1.4693039785072486
Energy: 1.2781019139457208
Energy: 1.46930397851387
Energy: 1.2289932001776283
Energy: 1.4810297902614833
Energy: 1.3952771959604922
Energy: 1.4810297902614833
Energy: 1.2289932001776283
Energy: 1.4810297902614833
Energy: 1.287685596724889
Energy: 1.4690211085663725
Energy: 1.3952036551592462
Energy: 1.4690211085673184
Energy: 1.287685596723943
Energy: 1.4690211085663725
Energy: 1.309798684873881
Energy: 1.5475615657214365
Energy: 1.538253495895049
Energy: 1.54756156572995
Energy: 1.309798684873881
Energy: 1.54756156572995
Energy: 1.5895658807221804
Energy: 1.5495926189108225
Energy: 1.3097352982215769
Energy: 1.549592618906093
Energy: 1.5895658807221804
Energy: 1.5495926189098765
Energy: 1.396466917486736
Energy: 1.469737532371178
Energy: 1.248655206521188
Energy: 1.4697375323740158
Energy: 1.3964669174924116
Energy: 1.469737532371178
Energy: 1.3960601991962485
Energy: 1.4809246745065765
Energy: 1.2290870189781529
Energy: 1.4809246745056306
Energy: 1.396060199199086
Energy: 1.4809246745056306
Energy: 1.439272210370174
Energy: 1.505766906370187
Energy: 1.2944914528437295
Energy: 1.5057669063730246
Energy: 1.43927221037112
Energy: 1.505766906369241
Energy: 1.4240670096885715
Energy: 1.5466196910541663
Energy: 1.5669674848110704
Energy: 1.5466196910541663
Energy: 1.4240670096885715
Energy: 1.5466196910522745
Energy: 1.4392717319191757
Energy: 1.4693039785129243
Energy: 1.294902892934729
Energy: 1.4693039785176538
Energy: 1.4392717319182295
Energy: 1.469303978515762
Energy: 1.3952771959642756
Energy: 1.4810297902605372
Energy: 1.2289932001757367
Energy: 1.4810297902605372
Energy: 1.3952771959652217
Energy: 1.4810297902605372
Energy: 1.3952036551583002
Energy: 1.4690211085663725
Energy: 1.4110456132029294
Energy: 1.4690211085663725
Energy: 1.3952036551611378
Energy: 1.4690211085673184
Energy: 1.48004970429812
Energy: 1.54756156572995
Energy: 1.3097986848748266
Energy: 1.5475615657308959
Energy: 1.48004970429812
Energy: 1.54756156572995
Energy: 1.3097352982206307
Energy: 1.5495926189079847
Energy: 1.5895658807212343
Energy: 1.5495926189070386
Energy: 1.3097352982206307
Energy: 1.5495926189070386
Energy: 1.248655206520242
Energy: 1.469737532371178
Energy: 1.3964669174772768
Energy: 1.4697375323702324
Energy: 1.248655206521188
Energy: 1.4697375323721242
Energy: 1.2290870189790772
Energy: 1.4809246745065765
Energy: 1.3960601991943564
Energy: 1.4809246745065765
Energy: 1.2290870189790772
Energy: 1.4809246745065765
Energy: 1.2944914528427836
Energy: 1.505766906370187
Energy: 1.43927221037112
Energy: 1.5057669063711328
Energy: 1.2944914528427836
Energy: 1.505766906370187
Energy: 1.5669674848214539
Energy: 1.5466196910522745
Energy: 1.4516144433930152
Energy: 1.5466196910522745
Energy: 1.5669674848101243
Energy: 1.5466196910532202
Energy: 1.294902892933783
Energy: 1.469303978516708
Energy: 1.4392717319191757
Energy: 1.469303978516708
Energy: 1.294902892933783
Energy: 1.469303978516708
Energy: 1.2289932001766823
Energy: 1.4810297902614833
Energy: 1.3952771959623838
Energy: 1.4810297902614833
Energy: 1.2289932001776283
Energy: 1.4810297902614833
Energy: 1.4110456132019835
Energy: 1.4690211085673184
Energy: 1.395203655160192
Energy: 1.4690211085663725
Energy: 1.4110456132019835
Energy: 1.4690211085673184
Energy: 1.3097986848748266
Energy: 1.5475615657308959
Energy: 1.48004970429812
Energy: 1.5475615657290043
Energy: 1.309798684873881
Energy: 1.5475615657223827
Energy: 1.5895658807221804
Energy: 1.5495926189117684
Energy: 1.3097352982206307
Energy: 1.5495926189089309
Energy: 1.5895658807221804
Energy: 1.5495926189070386
Energy: 1.3964669174498452
Energy: 1.4697375323702324
Energy: 1.248655206521188
Energy: 1.469737532371178
Energy: 1.3964669174536288
Energy: 1.4697375323702324
Energy: 1.3960601991924648
Energy: 1.4809246745046847
Energy: 1.2290870189781529
Energy: 1.4809246745065765
Energy: 1.3960601991943564
Energy: 1.4809246745065765
Energy: 1.439272210370174
Energy: 1.5057669063739707
Energy: 1.2944914528446754
Energy: 1.5057669063711328
Energy: 1.43927221037112
Energy: 1.5057669063739707
Energy: 1.4777468822483801
Energy: 1.5466196910513286
Energy: 1.5669674848110704
Energy: 1.5466196910541663
Energy: 1.4777468822493263
Energy: 1.5466196910541663
Energy: 1.4392717319182295
Energy: 1.4693039785185997
Energy: 1.294902892934729
Energy: 1.4693039785176538
Energy: 1.4392717319163377
Energy: 1.4693039785185997
Energy: 1.3952771959652217
Energy: 1.4810297902605372
Energy: 1.2289932001757367
Energy: 1.4810297902605372
Energy: 1.3952771959652217
Energy: 1.4810297902605372

minimum gb energy = 1.2289932001757367 eV
minimum distance =  2.19814821204386 Angstroms
sigma value = 27


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

Energy: 1.1959095502030073
Energy: 1.3744767193977152
Energy: 1.50268483801967
Energy: 1.3744767193977152
Energy: 1.195909550203481
Energy: 1.3744767193979257
Energy: 1.183421313238653
Energy: 1.3748648707841318
Energy: 1.2248662572790376
Energy: 1.3748648707839213
Energy: 1.183421313237047
Energy: 1.3748648707839213
Energy: 1.2121428390558675
Energy: 1.5126351344720237
Energy: 1.2251194824448106
Energy: 1.512635134473656
Energy: 1.212142839056315
Energy: 1.5126351344729714
Energy: 1.1930136808260123
Energy: 1.3746174342201196
Energy: 1.2102810438017013
Energy: 1.374617434220567
Energy: 1.1930136808257754
Energy: 1.3746174342208042
Energy: 1.2264855934604861
Energy: 1.3824218294380437
Energy: 1.3842883025262886
Energy: 1.3824218294382806
Energy: 1.2264855934606969
Energy: 1.3824218294387283
Energy: 1.209960819712777
Energy: 1.5265579454116682
Energy: 1.224751298182607
Energy: 1.526557945410036
Energy: 1.2099608197125398
Energy: 1.5265579454098253
Energy: 1.2246746017717491
Energy: 1.3428564068627178
Energy: 1.2099722042279983
Energy: 1.3428564068552926
Energy: 1.2246746017713015
Energy: 1.3428564068671147
Energy: 1.1935030468763836
Energy: 1.382284873500609
Energy: 1.2282472172375294
Energy: 1.3822848735020044
Energy: 1.1935030468761465
Energy: 1.3822848735015303
Energy: 1.209964395386549
Energy: 1.3824386573010146
Energy: 1.1872418887410734
Energy: 1.38243865730033
Energy: 1.209964395386312
Energy: 1.3824386573012515
Energy: 1.2129721372419657
Energy: 1.4679741402703983
Energy: 1.2129776521046356
Energy: 1.4679741402696878
Energy: 1.2129721372419657
Energy: 1.4679741402699245
Energy: 1.2248267561742674
Energy: 1.3827112141933162
Energy: 1.2100316810262055
Energy: 1.3827112141937903
Energy: 1.2248267561747148
Energy: 1.3827112141930793
Energy: 1.2280682757421353
Energy: 1.3822412353021145
Energy: 1.193697956031467
Energy: 1.3822412353032731
Energy: 1.228068275740503
Energy: 1.38224123530351

minimum gb energy = 1.183421313237047 eV
minimum distance =  2.22850626761213 Angstroms
sigma value = 9


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

Energy: 1.6105490354896292
Energy: 1.5736687539696583
Energy: 1.4683789711751778
Energy: 1.5736687539696583
Energy: 1.6105490354909315
Energy: 1.5736687539690073
Energy: 1.4356273182493513
Energy: 1.5056030948034047
Energy: 1.3383045428624736
Energy: 1.5197533924122923
Energy: 1.4356273182473984
Energy: 1.5056030948034047
Energy: 1.3000538179412697
Energy: 1.5261403484230505
Energy: 1.3181023675784305
Energy: 1.5261403484243525
Energy: 1.3000538179419208
Energy: 1.5261403484237015
Energy: 1.2571196777154126
Energy: 1.4940763899383307
Energy: 1.2343191509291207
Energy: 1.4940763899396328
Energy: 1.2571196777154126
Energy: 1.4940763899402838
Energy: 1.2564580978462472
Energy: 1.4908200045893696
Energy: 1.2522954857573634
Energy: 1.4908200045906714
Energy: 1.2564580978462472
Energy: 1.4908200045900206
Energy: 1.238879955877637
Energy: 1.4448018308488444
Energy: 1.3312305596282374
Energy: 1.460871342414917
Energy: 1.238879955877637
Energy: 1.4448018308494954
Energy: 1.4943175792745067
Energy: 1.5201056162052513
Energy: 1.3255142083327092
Energy: 1.5201056162052513
Energy: 1.4943175792745067
Energy: 1.5201056162046
Energy: 1.4338073597285848
Energy: 1.4904053466930551
Energy: 1.3508022521256553
Energy: 1.4904053466924039
Energy: 1.4338073597272827
Energy: 1.4904053466930551
Energy: 1.4348684042136606
Energy: 1.5186911986206686
Energy: 1.328799555672013
Energy: 1.5186911986180645
Energy: 1.4348684042130093
Energy: 1.5186911986167624
Energy: 1.4372709422189764
Energy: 1.5280698282819536
Energy: 1.2663406389863547
Energy: 1.5280698282819536
Energy: 1.4372709422177037
Energy: 1.5280698282832557
Energy: 1.4204111503881351
Energy: 1.5096638290215232
Energy: 1.3317024514562787
Energy: 1.5096638290215232
Energy: 1.420411150381625
Energy: 1.5096638290208722
Energy: 1.3072903629865824
Energy: 1.489939348541225
Energy: 1.3066565068770328
Energy: 1.4899393485392718
Energy: 1.3072903629865824
Energy: 1.4899393485392718
Energy: 1.2427132191745913
Energy: 1.4464701142800356
Energy: 1.2398084076048068
Energy: 1.4464701142793843
Energy: 1.2427132191745913
Energy: 1.4464701142800356
Energy: 1.4530356393201471
Energy: 1.5464377794114965
Energy: 1.2426373182803245
Energy: 1.5464377794088924
Energy: 1.453035639319496
Energy: 1.5464377794121476
Energy: 1.3088037690593297
Energy: 1.5126396098112012
Energy: 1.3668841358852208
Energy: 1.5126396098085968
Energy: 1.3088037690593297
Energy: 1.5126396098092478
Energy: 1.375665608243764
Energy: 1.4931486113702446
Energy: 1.2988216336240288
Energy: 1.4931486113695935
Energy: 1.3756656082443852
Energy: 1.4931486113689425
Energy: 1.4393741168926106
Energy: 1.5342111120400992
Energy: 1.327057986007604
Energy: 1.5342111120394482
Energy: 1.4393741168932617
Energy: 1.53421111204075
Energy: 1.309558435459881
Energy: 1.4486212689340965
Energy: 1.321367591384742
Energy: 1.4486212689334454
Energy: 1.3095584354514178
Energy: 1.4486212689353986
Energy: 1.4346650596593544
Energy: 1.5573395987477496
Energy: 1.242726899954174
Energy: 1.5573395987470988
Energy: 1.4346650596593544
Energy: 1.5573395987464478
Energy: 1.2388201208210559
Energy: 1.5980372286164732
Energy: 1.2416082145293583
Energy: 1.5980372286177753
Energy: 1.2388201208204048
Energy: 1.5980372286171243
Energy: 1.2433604824451303
Energy: 1.557294507398106
Energy: 1.4346542393681128
Energy: 1.5572945073955018
Energy: 1.2433604824457811
Energy: 1.5572945073968039
Energy: 1.3212316257010384
Energy: 1.4507532517072046
Energy: 1.3101530263877847
Energy: 1.4507532517072046
Energy: 1.3212316257016896
Energy: 1.4507532517104598
Energy: 1.32697192446786
Energy: 1.5341908246202134
Energy: 1.4392295479603237
Energy: 1.5341908246137033
Energy: 1.3269719244659068
Energy: 1.53419082461826
Energy: 1.3055722501377058
Energy: 1.4934778848579655
Energy: 1.3760161926817038
Energy: 1.4934778848566637
Energy: 1.305572250139008
Energy: 1.4934778848586165
Energy: 1.3632581372776225
Energy: 1.5132705200262355
Energy: 1.3087650537777211
Energy: 1.5132705200262355
Energy: 1.3632581372763204
Energy: 1.5132705200262355
Energy: 1.2397993908106213
Energy: 1.54667750597278
Energy: 1.4532682052889172
Energy: 1.54667750597278
Energy: 1.2397993908073661
Energy: 1.5466775059747333
Energy: 1.2416078140207016
Energy: 1.4433865784826472
Energy: 1.242704769083198
Energy: 1.443386578481345
Energy: 1.2416078140226545
Energy: 1.443386578480694
Energy: 1.3003728373381849
Energy: 1.4901560401182055
Energy: 1.3065961165328948
Energy: 1.4901560401201588
Energy: 1.300372837340789
Energy: 1.4901560401208096
Energy: 1.3317366327758893
Energy: 1.5097102196525936
Energy: 1.4849403197094604
Energy: 1.5097102196486876
Energy: 1.3317366327758893
Energy: 1.5097102196512917
Energy: 1.2663968213285794
Energy: 1.5275650219881352
Energy: 1.4375389074627476
Energy: 1.5275650219874841
Energy: 1.2663968213292303
Energy: 1.5275650219874841
Energy: 1.3302428057258353
Energy: 1.5186911986271787
Energy: 1.4308083279104313
Energy: 1.5186911986271787
Energy: 1.3302428057225804
Energy: 1.5186911986239235
Energy: 1.3514470496536437
Energy: 1.4903515672776269
Energy: 1.4337459269651702
Energy: 1.4903515672769758
Energy: 1.3514470496568989
Energy: 1.4903515672769758
Energy: 1.3236090489737946
Energy: 1.5200984086222498
Energy: 1.4947613878743715
Energy: 1.5200984086202969
Energy: 1.3236090489770498
Energy: 1.5200984086189946
Energy: 1.3014855364392068
Energy: 1.4912306223850773
Energy: 1.2388658124834697
Energy: 1.4912306223850773
Energy: 1.3014855363734827
Energy: 1.4912306223844263
Energy: 1.2351580391281767
Energy: 1.4905081866448475
Energy: 1.25645416374932
Energy: 1.4905081866448475
Energy: 1.235158039129479
Energy: 1.4905081866448475
Energy: 1.235167437678082
Energy: 1.4939743782048782
Energy: 1.2571251676220583
Energy: 1.4939743782055293
Energy: 1.2351674376767798
Energy: 1.4939743782068313
Energy: 1.3193709696623193
Energy: 1.526369748893225
Energy: 1.3001650880698774
Energy: 1.5263697488938759
Energy: 1.3193709696623193
Energy: 1.5263697488938759
Energy: 1.3281846027089204
Energy: 1.4832863228201967
Energy: 1.4351097673237676
Energy: 1.4832863228208475
Energy: 1.3281846027076183
Energy: 1.4832863228214987
Energy: 1.4109723207034846
Energy: 1.5736687539677054
Energy: 1.6105490354928844
Energy: 1.5736687539683563
Energy: 1.4109723207021825
Energy: 1.5736687539690073
Energy: 1.3383045428637756
Energy: 1.5056030948021029
Energy: 1.4356273182493513
Energy: 1.5056030948001498
Energy: 1.3383045428624736
Energy: 1.505603094799499
Energy: 1.3181023675764771
Energy: 1.5261403484237015
Energy: 1.3000538179438736
Energy: 1.5261403484237015
Energy: 1.3181023675771284
Energy: 1.5261403484237015
Energy: 1.2343191509291207
Energy: 1.4940763899383307
Energy: 1.2571196777115063
Energy: 1.494076389938982
Energy: 1.2343191509297717
Energy: 1.494076389938982
Energy: 1.2704923138784767
Energy: 1.4908200045913225
Energy: 1.2564580978462472
Energy: 1.4908200045913225
Energy: 1.270492313885638
Energy: 1.4908200045919735

minimum gb energy = 1.2343191509291207 eV
minimum distance =  2.18702860227665 Angstroms
sigma value = 57


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

Energy: 1.3857547856861738
Energy: 1.4401776089010174
Energy: 1.454598581598349
Energy: 1.4401776088995353
Energy: 1.385754785684692
Energy: 1.4401776089024991
Energy: 1.4186925779610022
Energy: 1.4731244537552663
Energy: 1.1579271565692164
Energy: 1.4731244537167687
Energy: 1.4186925779610022
Energy: 1.4731244537182508
Energy: 1.1308824685625933
Energy: 1.4151104267694397
Energy: 1.2701701685716154
Energy: 1.4151104267679575
Energy: 1.1308824685625933
Energy: 1.4151104267679575
Energy: 1.151750283124958
Energy: 1.4130189899398713
Energy: 1.1600272992971012
Energy: 1.4130189899398713
Energy: 1.1517502831234756
Energy: 1.4130189899398713
Energy: 1.1521571203773018
Energy: 1.4445577521067803
Energy: 1.2220313736145856
Energy: 1.4445577521082622
Energy: 1.1521571203773018
Energy: 1.4445577521097441
Energy: 1.4387936641664998
Energy: 1.4125055798861443
Energy: 1.1314516482419026
Energy: 1.4125055798861443
Energy: 1.4387936641694639
Energy: 1.4125055798861443
Energy: 1.4389557385790201
Energy: 1.4125629674579334
Energy: 1.1322616630171523
Energy: 1.4125629674549696
Energy: 1.4389557385819842
Energy: 1.4125629674564515
Energy: 1.1523111310588026
Energy: 1.439594096272751
Energy: 1.1571100878616378
Energy: 1.439594096272751
Energy: 1.1523111310588026
Energy: 1.4395940962742326
Energy: 1.15159239864469
Energy: 1.4145022247016676
Energy: 1.2203638922936668
Energy: 1.4145022247001857
Energy: 1.1515923986432084
Energy: 1.4145022247001857
Energy: 1.1308498755844836
Energy: 1.4147594964947148
Energy: 1.2707826078078297
Energy: 1.4147594964947148
Energy: 1.1308498755859655
Energy: 1.4147594964947148
Energy: 1.4182109466017474
Energy: 1.473124453749372
Energy: 1.1591364930895376
Energy: 1.4731244537552663
Energy: 1.4182109466032293
Energy: 1.473124453749372
Energy: 1.385754785684692
Energy: 1.4401776089024991
Energy: 1.4023686290533208
Energy: 1.4401776089010174
Energy: 1.3857547856861738
Energy: 1.4401776089010174
Energy: 1.4186925779610022
Energy: 1.4731244537226966
Energy: 1.1579271565677347
Energy: 1.4731244537167687
Energy: 1.4186925779595205
Energy: 1.473124453746408
Energy: 1.1308824685625933
Energy: 1.4151104267679575
Energy: 1.2701701685716154
Energy: 1.4151104267679575
Energy: 1.1308824685625933
Energy: 1.4151104267679575
Energy: 1.151750283124958
Energy: 1.4130189899398713
Energy: 1.1600272992971012
Energy: 1.4130189899413534
Energy: 1.151750283124958
Energy: 1.4130189899398713
Energy: 1.1521571203773018
Energy: 1.4445577521082622
Energy: 1.2551125909997582
Energy: 1.4445577521082622
Energy: 1.1521571203773018
Energy: 1.4445577521082622
Energy: 1.4387936641368602
Energy: 1.4125055798861443
Energy: 1.1314516482448669
Energy: 1.4125055798846624
Energy: 1.4387936641531622
Energy: 1.4125055798861443
Energy: 1.4389557385819842
Energy: 1.4125629674564515
Energy: 1.1322616630171523
Energy: 1.4125629674564515
Energy: 1.4389557385819842
Energy: 1.4125629674579334
Energy: 1.1523111310588026
Energy: 1.4395940962757148
Energy: 1.1571100878601557
Energy: 1.4395940962742326
Energy: 1.1523111310588026
Energy: 1.4395940962742326

minimum gb energy = 1.1308498755844836 eV
minimum distance =  2.17955956192369 Angstroms
sigma value = 11


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

Energy: 1.2541601547854875
Energy: 1.379230782604035
Energy: 1.3526650798202895
Energy: 1.379230782604035
Energy: 1.254160154784402
Energy: 1.379230782604035
Energy: 1.7324560472038537
Energy: 1.3264329160939228
Energy: 1.0703247345706093
Energy: 1.3264329160939228
Energy: 1.7324560472038537
Energy: 1.3264329160917516
Energy: 1.2312859483809226
Energy: 1.3121376154091529
Energy: 1.2055728893009394
Energy: 1.3121376154091529
Energy: 1.231285948379837
Energy: 1.3121376154091529
Energy: 1.2667549881923885
Energy: 1.2985675173986075
Energy: 1.0692360188463952
Energy: 1.2985675173975217
Energy: 1.2667549881923885
Energy: 1.298567517399693
Energy: 1.0664359104643473
Energy: 1.379164971838212
Energy: 1.107375659076705
Energy: 1.3791649718371266
Energy: 1.0664359104632617
Energy: 1.379164971838212
Energy: 1.078627176685581
Energy: 1.3649833376329616
Energy: 1.0805844044805715
Energy: 1.3649833376318758
Energy: 1.0786271766844955
Energy: 1.3649833376318758
Energy: 1.0783450778875665
Energy: 1.396187837977481
Energy: 1.0763832988172342
Energy: 1.396187837976396
Energy: 1.0783450778875665
Energy: 1.396187837976396
Energy: 1.4832616084625025
Energy: 1.375442995691613
Energy: 1.0928036074191048
Energy: 1.375442995689442
Energy: 1.483261608464674
Energy: 1.375442995689442
Energy: 1.4817718346899176
Energy: 1.3730101110555601
Energy: 1.4187883086480777
Energy: 1.3730101110544746
Energy: 1.4817718346899176
Energy: 1.3730101110544746
Energy: 1.078676157802724
Energy: 1.310394365427812
Energy: 1.0806730443955679
Energy: 1.310394365427812
Energy: 1.0786761578038098
Energy: 1.3103943654267267
Energy: 1.0785684872252135
Energy: 1.360529133719524
Energy: 1.0776506625871431
Energy: 1.3605291337206098
Energy: 1.0785684872241281
Energy: 1.360529133721695
Energy: 1.0663865544508084
Energy: 1.3752997659607784
Energy: 1.0810431110356105
Energy: 1.3752997659596926
Energy: 1.0663865544529796
Energy: 1.3752997659607784
Energy: 1.483756154251901
Energy: 1.2041731181781814
Energy: 1.1076438047698554
Energy: 1.2041731181466997
Energy: 1.483756154251901
Energy: 1.2041731181836093
Energy: 1.0746117778905546
Energy: 1.30933091680738
Energy: 1.091315923842777
Energy: 1.309330916809551
Energy: 1.0746117778699782
Energy: 1.30933091680738
Energy: 1.7322684694810129
Energy: 1.3266447027778998
Energy: 1.0755815191558018
Energy: 1.3266447027768142
Energy: 1.7322684694799275
Energy: 1.3266447027768142
Energy: 1.2433364815567756
Energy: 1.3752190560602608
Energy: 1.29882868466698
Energy: 1.3752190560592246
Energy: 1.2433364815567756
Energy: 1.3752190560581392
Energy: 1.7492514318892063
Energy: 1.3244342696428506
Energy: 1.0802922853190995
Energy: 1.3244342696439364
Energy: 1.7492514318902919
Energy: 1.3244342696450218
Energy: 1.075567260282532
Energy: 1.3097063226285184
Energy: 1.0947938900689262
Energy: 1.3097063226328607
Energy: 1.0755672604029813
Energy: 1.309706322631775
Energy: 1.2659639355737387
Energy: 1.3033580231379651
Energy: 1.075891611839128
Energy: 1.3033580231390505
Energy: 1.2659639355748245
Energy: 1.303358023140136
Energy: 1.066452292984193
Energy: 1.379316518354189
Energy: 1.0817672979456228
Energy: 1.3793165183520175
Energy: 1.066452292984193
Energy: 1.379316518353103
Energy: 1.525631956155397
Energy: 1.3623952583501713
Energy: 1.0686656095805889
Energy: 1.362395258352293
Energy: 1.5256319561564824
Energy: 1.362395258352293
Energy: 1.0788875146639565
Energy: 1.3987976519194762
Energy: 1.0725722130351478
Energy: 1.3987976519183905
Energy: 1.0788875146639565
Energy: 1.3987976519183905
Energy: 1.4863776835796096
Energy: 1.3723670587752421
Energy: 1.0930850479095886
Energy: 1.3723670587784988
Energy: 1.4863776835806954
Energy: 1.372367058777413
Energy: 1.0669066348238163
Energy: 1.3797646821032903
Energy: 1.463243931313665
Energy: 1.3797646821032903
Energy: 1.0669066348227307
Energy: 1.3797646821032903
Energy: 1.0794352102562204
Energy: 1.3052635272169606
Energy: 1.0718036347347493
Energy: 1.305263527212618
Energy: 1.0794352102573062
Energy: 1.305263527212618
Energy: 1.079177743398424
Energy: 1.3606881348674749
Energy: 1.0722232000726188
Energy: 1.3606881348663895
Energy: 1.0791777433995096
Energy: 1.3606881348653037

minimum gb energy = 1.0663865544508084 eV
minimum distance =  2.2355403029501 Angstroms
sigma value = 41


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

Energy: 1.5516006100146962
Energy: 1.3424974056236147
Energy: 1.2924047402599608
Energy: 1.3424974056236147
Energy: 1.5516006100146962
Energy: 1.3424974056244705
Energy: 1.714310253090355
Energy: 1.205142023843552
Energy: 0.9950334695255498
Energy: 1.2051420238444077
Energy: 1.7143102530912107
Energy: 1.205142023843552
Energy: 1.069619152013822
Energy: 1.2645969291099497
Energy: 1.0240714209021062
Energy: 1.2645969291108055
Energy: 1.0696191520103997
Energy: 1.2645969291099497
Energy: 1.5079424003925397
Energy: 1.1785658731875608
Energy: 0.9932845703311707
Energy: 1.1785658731858497
Energy: 1.5079424003908286
Energy: 1.1785658731867052
Energy: 1.112231413161612
Energy: 1.1890875595099764
Energy: 1.0133309859067205
Energy: 1.1890875595099764
Energy: 1.112231413161612
Energy: 1.1890875595074093
Energy: 1.3038984635867064
Energy: 1.2443007892808915
Energy: 0.998083667156959
Energy: 1.2443007892808915
Energy: 1.3038984635867064
Energy: 1.2443007892808915
Energy: 0.9952883679017188
Energy: 1.2528029896871293
Energy: 0.9947803552287998
Energy: 1.2528029896871293
Energy: 0.9952883679017188
Energy: 1.2528029896862736
Energy: 1.3538622488946916
Energy: 1.2541153759130672
Energy: 1.0155379006515084
Energy: 1.2541153759130672
Energy: 1.3538622488955472
Energy: 1.2541153759130672
Energy: 1.0109114132377643
Energy: 1.1911077776749364
Energy: 1.2215020085890056
Energy: 1.1911077776749364
Energy: 1.0109114132377643
Energy: 1.1911077776775036
Energy: 1.3133188018469648
Energy: 1.2526892005191896
Energy: 1.3099803841977
Energy: 1.2526892005200452
Energy: 1.313318801848676
Energy: 1.2526892005200452
Energy: 1.3128804314650335
Energy: 1.252788261185286
Energy: 1.3073768627583764
Energy: 1.2527882611835746
Energy: 1.3128804314650335
Energy: 1.2527882611844305
Energy: 1.0048813397088616
Energy: 1.2718661993954905
Energy: 1.0140711930113497
Energy: 1.2526203005773193
Energy: 1.0048813397088616
Energy: 1.2784714080722501
Energy: 1.010413682028573
Energy: 1.2451606490937255
Energy: 1.220618084773932
Energy: 1.2451606490945812
Energy: 1.0104136820277176
Energy: 1.2451606490945812
Energy: 0.9928903818678639
Energy: 1.252425414765072
Energy: 0.9936084505040286
Energy: 1.252425414765072
Energy: 0.9928903818687195
Energy: 1.2524254147659275
Energy: 1.309392969381295
Energy: 1.2453281841729216
Energy: 0.9940722589571501
Energy: 1.2453281841720663
Energy: 1.309392969381295
Energy: 1.2453281841720663
Energy: 0.9970527040445248
Energy: 1.2797965858357072
Energy: 0.9928165175305081
Energy: 1.2527480652528153
Energy: 0.9970527040411413
Energy: 1.279796585833996
Energy: 1.2918159752787393
Energy: 1.2732237876072778
Energy: 1.0139244724977072
Energy: 1.2732237876072778
Energy: 1.2918159752795952
Energy: 1.2732237876047108
Energy: 1.015545747704352
Energy: 1.2533163625844483
Energy: 1.0064185579143685
Energy: 1.2533163625853039
Energy: 1.015545747700074
Energy: 1.2533163625853039
Energy: 1.7193105494524819
Energy: 1.2052057565309222
Energy: 0.9947231371275619
Energy: 1.2052057565300667
Energy: 1.7193105494524819
Energy: 1.2052057565300667
Energy: 1.3039974822410338
Energy: 1.2783527969931503
Energy: 1.3123802645792275
Energy: 1.2528097078600957
Energy: 1.3039974822281997
Energy: 1.2783527969940058
Energy: 1.7094041992621563
Energy: 1.204910285057232
Energy: 1.0015594229055942
Energy: 1.2049102850589433
Energy: 1.7094041992613005
Energy: 1.2049102850589433
Energy: 1.019117688304101
Energy: 1.2530204386744794
Energy: 1.0086355977029946
Energy: 1.2530204386744794
Energy: 1.019117688306668
Energy: 1.2530204386736241
Energy: 1.5061590884856484
Energy: 1.1784099396087775
Energy: 0.9941382015571544
Energy: 1.1784099396087775
Energy: 1.5061590884830818
Energy: 1.178409939609633
Energy: 0.994537662969509
Energy: 1.2162628531011173
Energy: 1.1548262456383156
Energy: 1.2442528185563533
Energy: 0.9945376629678369
Energy: 1.2162628530959834
Energy: 1.154686678909905
Energy: 1.2442497332315614
Energy: 0.9982674497055949
Energy: 1.2442497332315614
Energy: 1.154686678909905
Energy: 1.244249733230706
Energy: 0.9927780034867804
Energy: 1.215736373063787
Energy: 1.14167038714811
Energy: 1.2157363730663535
Energy: 0.9927780034867804
Energy: 1.2157363730672095
Energy: 1.3518966137094495
Energy: 1.2526051531072333
Energy: 1.0168370672984404
Energy: 1.2526051531063775
Energy: 1.3518966137103048
Energy: 1.2526051531072333
Energy: 1.0052683760677201
Energy: 1.2244816562899186
Energy: 1.5002918722277814
Energy: 1.2457206975088113
Energy: 1.0052683760677201
Energy: 1.2244816562899186
Energy: 1.312092071000935
Energy: 1.253292022711497
Energy: 1.3098629867448957
Energy: 1.2532920227106414
Energy: 1.3120920710043575
Energy: 1.253292022711497
Energy: 0.9928620128500342
Energy: 1.2481569287609562
Energy: 1.3084259972784154
Energy: 1.2481569287575338
Energy: 0.9928620128508897
Energy: 1.248156928761812
Energy: 1.0048534394101845
Energy: 1.2525493708726823
Energy: 1.0149676579793636
Energy: 1.252549370873538
Energy: 1.0048534394101845
Energy: 1.2525493708743936
Energy: 1.0049988724081647
Energy: 1.2441161032032906
Energy: 1.2877987574833858
Energy: 1.2441161032032906
Energy: 1.0049988724081647
Energy: 1.2441161032015793
Energy: 0.9947736127106286
Energy: 1.2526352682507143
Energy: 0.9968732546265362
Energy: 1.2526352682507143
Energy: 0.9947736127106286
Energy: 1.2526352682507143

minimum gb energy = 0.9927780034867804 eV
minimum distance =  2.23066947526318 Angstroms
sigma value = 33


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

Energy: 1.29494379446462
Energy: 1.1323567412435578
Energy: 1.0520070668684802
Energy: 1.1323567412477613
Energy: 1.29494379446462
Energy: 1.1323567412477613
Energy: 1.8579686998073586
Energy: 1.0361106849585964
Energy: 0.8922515410769374
Energy: 1.036110684959197
Energy: 1.8579686998067577
Energy: 1.0361106849573956
Energy: 1.275351898249335
Energy: 1.1303484117508968
Energy: 1.041333133496971
Energy: 1.130348411752098
Energy: 1.275351898249335
Energy: 1.130348411752098
Energy: 1.7166984490937627
Energy: 1.023160824125389
Energy: 0.8924262475126168
Energy: 1.0231608241241879
Energy: 1.7166984490937627
Energy: 1.023160824125389
Energy: 0.9480568675348627
Energy: 1.1049306084812904
Energy: 0.8997188689058043
Energy: 1.1049306084788886
Energy: 0.9480568675282575
Energy: 1.1049306084788886
Energy: 1.3766103081122767
Energy: 1.0756447997524186
Energy: 0.8925577669750531
Energy: 1.0756447997560215
Energy: 1.3766103081128769
Energy: 1.0756447997536196
Energy: 0.9297175762784599
Energy: 1.0892637862174415
Energy: 0.8902339560420938
Energy: 1.0892637862180419
Energy: 0.9297175762802613
Energy: 1.0892637862174415
Energy: 1.2360348662514846
Energy: 1.0781356471603785
Energy: 0.9004723371083833
Energy: 1.0781356471579766
Energy: 1.2360348662508842
Energy: 1.078135647158577
Energy: 0.9119879088491575
Energy: 1.1050734296341789
Energy: 1.066097497241977
Energy: 1.1050734296371811
Energy: 0.9119879088479567
Energy: 1.1050734296335782
Energy: 1.0938828793439601
Energy: 1.1088781709205657
Energy: 1.1866717404625402
Energy: 1.1088781709199653
Energy: 1.0938828793433597
Energy: 1.1088781709205657
Energy: 0.9063662050181666
Energy: 1.0890360336071454
Energy: 1.1075189124838687
Energy: 1.0890360336071454
Energy: 0.9063662050181666
Energy: 1.0890360336071454
Energy: 1.402455337522238
Energy: 1.1238973194508108
Energy: 1.129770614404196
Energy: 1.123897319453213
Energy: 1.4024553375252404
Energy: 1.1238973194526123
Energy: 1.0989242500975287
Energy: 1.1059038924958124
Energy: 1.2435523506914261
Energy: 1.1059038924934106
Energy: 1.098924250096928
Energy: 1.1059038924958124
Energy: 1.1289948568410855
Energy: 1.123895861503818
Energy: 1.4003674958015726
Energy: 1.1238958615044183
Energy: 1.1289948568410855
Energy: 1.1238958615044183
Energy: 1.1054149753190563
Energy: 1.0820538820094732
Energy: 1.4143870964497935
Energy: 1.0820538820088725
Energy: 1.105414975319657
Energy: 1.0820538820094732
Energy: 1.1000415946810576
Energy: 1.1249147283596492
Energy: 1.1188434155237923
Energy: 1.124914728359049
Energy: 1.1000415946798565
Energy: 1.1249147283584484
Energy: 1.0978268071983386
Energy: 1.1052217072573842
Energy: 1.2674981169131248
Energy: 1.1052217072573842
Energy: 1.0978268071995392
Energy: 1.1052217072597863
Energy: 0.8905401518220392
Energy: 1.1242092353506834
Energy: 1.1060950890189607
Energy: 1.1242092353530857
Energy: 0.8905401518214386
Energy: 1.1242092353530857
Energy: 1.1072597708265106
Energy: 1.1030391337036398
Energy: 1.0951158454472016
Energy: 1.1030391337030394
Energy: 1.1072597708277114
Energy: 1.1030391337036398
Energy: 0.8986811606659167
Energy: 1.124455141391281
Energy: 0.9009029527355087
Energy: 1.1244551413900803
Energy: 0.8986811606653162
Energy: 1.1244551413900803
Energy: 1.0988470041092637
Energy: 1.104050815479695
Energy: 1.0059841310621713
Energy: 1.1040508154778936
Energy: 1.0988470041092637
Energy: 1.1040508154802955
Energy: 0.913150088432453
Energy: 1.124022481339104
Energy: 0.892819690941991
Energy: 1.124022481337903
Energy: 0.9131500884282497
Energy: 1.1240224813373025
Energy: 1.3850793360061489
Energy: 1.1160672565785577
Energy: 0.8898769759985118
Energy: 1.1160672565773568
Energy: 1.3850793360067493
Energy: 1.1160672565785577
Energy: 0.9329011404872258
Energy: 1.124737146031856
Energy: 0.8927399913563825
Energy: 1.1247371460300546
Energy: 0.9329011404866253
Energy: 1.1247371460300546
Energy: 1.3834100615539542
Energy: 1.1050957424044143
Energy: 1.0593495074562038
Energy: 1.105095742405615
Energy: 1.3834100615527531
Energy: 1.1050957424062156
Energy: 1.2541569325042727
Energy: 1.1240558477905322
Energy: 0.8965888930223028
Energy: 1.1240558477923337
Energy: 1.2541569325078756
Energy: 1.1240558477923337
Energy: 1.8593080953402652
Energy: 1.0530519719847058
Energy: 0.8900695608618038
Energy: 1.0530519719883087
Energy: 1.8593080953402652
Energy: 1.0530519719871076
Energy: 1.1517260660916495
Energy: 1.123660264596837
Energy: 1.137020647305381
Energy: 1.123660264592033
Energy: 1.1517260660886472
Energy: 1.123660264598038
Energy: 1.534484856396869
Energy: 1.095038663888874
Energy: 0.9919696342083565
Energy: 1.0950386638900749
Energy: 1.534484856396268
Energy: 1.0950386638894745
Energy: 1.1197189101036975
Energy: 1.123814094606964
Energy: 1.1141088999266424
Energy: 1.1238140946063635
Energy: 1.1197189101811047
Energy: 1.1238140946063635
Energy: 1.5408692599073561
Energy: 1.0241407454363067
Energy: 0.8902857431591799
Energy: 1.0241407454327038
Energy: 1.5408692599103584
Energy: 1.0241407454345053
Energy: 0.9187154159543256
Energy: 1.1080396007170488
Energy: 1.1227545492467652
Energy: 1.1080396007170488
Energy: 0.9187154159591293
Energy: 1.1080396007170488
Energy: 1.2378488623457369
Energy: 1.0750464501368235
Energy: 0.8987327716998696
Energy: 1.075046450137424
Energy: 1.2378488623439354
Energy: 1.0750464501362231
Energy: 0.9099463203692533
Energy: 1.0782221660886764
Energy: 1.416781979126342
Energy: 1.0782221660928801
Energy: 0.9099463203698539
Energy: 1.0782221660928801
Energy: 1.4168458846836944
Energy: 1.078198178301381
Energy: 0.911862614392145
Energy: 1.0781981783031824
Energy: 1.416845884683094
Energy: 1.078198178302582
Energy: 0.8984103179798406
Energy: 1.0754315552233018
Energy: 1.2367767331755852
Energy: 1.0754315552251033
Energy: 0.8984103179786397
Energy: 1.0754315552245028
Energy: 1.1227016761536408
Energy: 1.1082856548215638
Energy: 0.9311942655193015
Energy: 1.108285654823966
Energy: 1.1227016761542412
Energy: 1.108285654823966
Energy: 0.890378512510178
Energy: 1.0234957047281872
Energy: 1.5404886410106824
Energy: 1.0234957047287878
Energy: 0.8903785125107785
Energy: 1.023495704729388
Energy: 1.114108899924841
Energy: 1.123503993411466
Energy: 1.254097416416295
Energy: 1.123503993410265
Energy: 1.1141088999254414
Energy: 1.123503993410265
Energy: 1.1020599124002621
Energy: 1.0950185296532446
Energy: 1.534349477776783
Energy: 1.0950185296520438
Energy: 1.102059912399061
Energy: 1.0950185296514432
Energy: 1.1353527683982851
Energy: 1.1241679309150614
Energy: 1.149819578236398
Energy: 1.1241679309150614
Energy: 1.1353527683970845
Energy: 1.1241679309150614
Energy: 0.8900486145850607
Energy: 1.05198019306141
Energy: 1.8588153437810033
Energy: 1.0519801930596087
Energy: 0.8900486145844603
Energy: 1.0519801930608095
Energy: 0.8966543785712798
Energy: 1.1241846459203408
Energy: 1.1250877808644926
Energy: 1.1241846459173384
Energy: 0.8966543785712798
Energy: 1.1241846459185394
Energy: 1.102272075843932
Energy: 1.1050802591888695
Energy: 1.3864959768515062
Energy: 1.10508025918947
Energy: 1.1022720758433315
Energy: 1.1050802591876685
Energy: 0.8924290027562175
Energy: 1.1242408383092823
Energy: 0.9314495886918381
Energy: 1.1242408383134856
Energy: 0.8924290027562175
Energy: 1.1242408383062799
Energy: 0.8899191289790986
Energy: 1.1160672565779572
Energy: 1.3863074232129244
Energy: 1.1160672565815601
Energy: 0.8899191289778976
Energy: 1.116067256580359
Energy: 0.8928325344414354
Energy: 1.1241791043138576
Energy: 0.9097950039124949
Energy: 1.1241791043138576
Energy: 0.8928325344408349
Energy: 1.1241791043132574

minimum gb energy = 0.8898769759985118 eV
minimum distance =  2.23358909108681 Angstroms
sigma value = 67


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

Energy: 0.3448907060010816
Energy: 0.29161386914708864
Energy: 1.0477079567893008
Energy: 0.29161386914588017
Energy: 0.3448907060018797
Energy: 0.2916138691462906
Energy: 0.27562508258028484
Energy: 0.7104597481688403
Energy: 0.70281542081287
Energy: 0.7104597481660356
Energy: 0.2756250825806953
Energy: 0.7104597481660356
Energy: 0.344890706000694
Energy: 0.2916138691478868
Energy: 1.0477079570059225
Energy: 0.2916138691462906
Energy: 0.344890706000694
Energy: 0.29161386914670107
Energy: 0.27562508258028484
Energy: 0.7104597481688403
Energy: 0.7028158898178628
Energy: 0.7104597481664233
Energy: 0.2756250825798972
Energy: 0.7104597481664233
Energy: 0.3448907060014921
Energy: 0.29161386914749915
Energy: 1.3105607936005343
Energy: 0.29161386914588017
Energy: 0.3448907060018797
Energy: 0.2916138691462906
Energy: 0.2756250825806953
Energy: 0.7104597481692507
Energy: 0.7028158849387652
Energy: 0.7104597481660356
Energy: 0.27562508258028484
Energy: 0.7104597481656252
Energy: 0.344890706000694
Energy: 0.29161386914749915
Energy: 1.716738369778503
Energy: 0.2916138691462906
Energy: 0.3448907060010816
Energy: 0.29161386914670107

minimum gb energy = 0.2756250825798972 eV
minimum distance =  2.4039881955031 Angstroms
sigma value = 3


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

Energy: 1.4215916336403724
Energy: 1.1244987296223272
Energy: 1.245106567045907
Energy: 1.124498729624512
Energy: 1.421591633634365
Energy: 1.1244987296250581
Energy: 1.824659640335205
Energy: 0.8863753515712918
Energy: 0.8746615849927272
Energy: 0.8863753515701994
Energy: 1.8246596403346589
Energy: 0.8863753515685611
Energy: 1.2742680074965844
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Energy: 1.0896827864646141
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Energy: 1.0959245623210296
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Energy: 1.0822751859600075
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Energy: 1.0957841268106183
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Energy: 1.092002529981143
Energy: 0.8699531812277465
Energy: 1.0466020675944927
Energy: 1.386948337085602
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Energy: 1.046602067593947
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Energy: 1.0809001616503902
Energy: 1.1124296013337762
Energy: 1.0809001616482057
Energy: 0.8725178211785874
Energy: 1.0809001616476595
Energy: 0.8653554020265926
Energy: 1.0566079659667846
Energy: 1.3839512650635546
Energy: 1.0566079659667846
Energy: 0.8653554020244081
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Energy: 0.8763638764639052
Energy: 1.0988419064503956
Energy: 1.3897215393827604
Energy: 1.0988419064520338
Energy: 0.8763638764644512
Energy: 1.0988419064514878
Energy: 0.876843285137664
Energy: 0.8863116516056424
Energy: 1.5292394053998737
Energy: 0.8863116516023658
Energy: 0.8768432851360256
Energy: 0.886311651604004
Energy: 0.8688501299364682
Energy: 1.1104119396544239
Energy: 1.410873510887437
Energy: 1.1104119396533316
Energy: 0.8688501299364682
Energy: 1.1104119396544239
Energy: 0.8654842176983966
Energy: 0.9667356438071809
Energy: 1.5357935005500465
Energy: 0.9667356438060888
Energy: 0.8654842176967582
Energy: 0.9667356438060888
Energy: 0.8679163099755168
Energy: 1.098564293134587
Energy: 1.3918938824537082
Energy: 1.0985642931329485
Energy: 0.8679163099755168
Energy: 1.0985642931334942
Energy: 0.877236421133392
Energy: 0.8722554004296972
Energy: 1.534247314493593
Energy: 0.8722554004286049
Energy: 0.877236421133392
Energy: 0.8722554004286049
Energy: 0.8598222650918239
Energy: 1.0809308165591973
Energy: 1.1114528693108479
Energy: 1.0809308165591973
Energy: 0.859822265092916
Energy: 1.0809308165602896
Energy: 0.8732468218831215
Energy: 1.0487543274391593
Energy: 1.2612443402393183
Energy: 1.0487543274402518
Energy: 0.8732468218831215
Energy: 1.0487543274386133
Energy: 1.1136213653869111
Energy: 1.0715156890247002
Energy: 1.095173300438797
Energy: 1.071515689023062
Energy: 1.1136213653869111
Energy: 1.0715156890241542

minimum gb energy = 0.8545331051240469 eV
minimum distance =  2.25859437107925 Angstroms
sigma value = 81


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

Energy: 1.4027072165446413
Energy: 1.264360717487716
Energy: 1.0899338805585388
Energy: 1.264360717487716
Energy: 1.402707216543142
Energy: 1.264360717487716
Energy: 1.6854260338249842
Energy: 0.9982753242145439
Energy: 0.9788880132300953
Energy: 0.9982753242167585
Energy: 1.6854260338249842
Energy: 0.9982753242160087
Energy: 1.317023082655862
Energy: 1.2575661729833163
Energy: 0.9981670431713174
Energy: 1.2575661729848158
Energy: 1.3170230826536136
Energy: 1.257566172984066
Energy: 1.269923763986929
Energy: 0.976668207265769
Energy: 0.9786639594882617
Energy: 0.9766682072665186
Energy: 1.2699237640064174
Energy: 0.9766682072665186
Energy: 1.0058941281871199
Energy: 1.2173479693139126
Energy: 1.0788878150698833
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Energy: 1.0058941281871199
Energy: 1.2173479693139126
Energy: 1.1175720666578468
Energy: 1.2004765815422216
Energy: 0.9706083188925148
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Energy: 1.1175720666526
Energy: 1.2004765815422216
Energy: 0.9829189023572912
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Energy: 1.1303101066699521
Energy: 1.222397825968848
Energy: 0.9829189023580407
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Energy: 0.9722314225923687
Energy: 1.2336414963165967
Energy: 1.5784238125523773
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Energy: 0.9722314225931182
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Energy: 0.9783076344175935
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Energy: 1.2917874229797646
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Energy: 1.2721819923300217
Energy: 1.2620026563299205
Energy: 0.9792343606977291
Energy: 1.2620026563314195
Energy: 0.9730397344490517
Energy: 1.2433242070670592
Energy: 0.9937159841672795
Energy: 1.2433242070678086
Energy: 0.9730397344483022
Energy: 1.2433242070678086
Energy: 0.9721826897423267
Energy: 1.1998583143354733
Energy: 1.2193086702866434
Energy: 1.1998583143347235
Energy: 0.9721826897423267
Energy: 1.1998583143347235
Energy: 1.2685094794341916
Energy: 1.222855755642436
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Energy: 1.268509479433442
Energy: 1.2228557556431856
Energy: 1.268883867359333
Energy: 1.2457734875871525
Energy: 0.9608684790360533
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Energy: 1.2688838673600826
Energy: 1.2457734875886515
Energy: 1.2856134746509043
Energy: 1.243383865546325
Energy: 0.9787151162901925
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Energy: 1.2856134746494052
Energy: 1.2433838655470746
Energy: 1.2854173048146889
Energy: 1.2228752801378926
Energy: 1.2223557504591294
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Energy: 1.67055465039004
Energy: 1.2331570250269208
Energy: 0.968840922626803
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Energy: 1.6705546503870419
Energy: 1.2331570250254218
Energy: 1.67043324553353
Energy: 1.2332737112988377
Energy: 0.9689372668409959
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Energy: 1.6704332455342794
Energy: 1.233273711299587
Energy: 1.285437709307211
Energy: 1.222847968458565
Energy: 1.1381212617848395
Energy: 1.2228479684578155
Energy: 1.2854377093079603
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Energy: 1.2855000910774825
Energy: 1.243319480182593
Energy: 0.9787091166747497
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Energy: 1.2855000910789818
Energy: 1.243319480182593
Energy: 1.268818353337472
Energy: 1.2455293057792252
Energy: 0.9610019417529689
Energy: 1.2455293057777261
Energy: 1.268818353337472
Energy: 1.2455293057792252
Energy: 1.268572241943374
Energy: 1.2228700668190058
Energy: 0.9706792775985861
Energy: 1.2228700668175065
Energy: 1.268572241943374
Energy: 1.2228700668182562
Energy: 0.9723616908843885
Energy: 1.200656848524684
Energy: 1.1317305258270747
Energy: 1.2006568485276823
Energy: 0.972361690883639
Energy: 1.200656848526183
Energy: 0.9730688108613229
Energy: 1.2433482444179078
Energy: 0.9937564803332726
Energy: 1.2433482444179078
Energy: 0.9730688108613229
Energy: 1.2433482444179078
Energy: 0.979470223163109
Energy: 1.2620026563314195
Energy: 1.271029616008203
Energy: 1.2620026563314195
Energy: 0.9794702231616099
Energy: 1.2620026563314195
Energy: 0.9797403384770894
Energy: 1.2230440217303036
Energy: 1.2861115469654734
Energy: 1.2230440217310532
Energy: 0.9797403384763398
Energy: 1.2230440217303036
Energy: 0.9722852658595773
Energy: 1.2336522744490133
Energy: 1.4734973712176493
Energy: 1.2336522744497629
Energy: 0.9722852658588276
Energy: 1.2336522744497629
Energy: 0.968682445972446
Energy: 1.243198636026287
Energy: 1.3802614025111752
Energy: 1.2431986360255376
Energy: 0.9686824459746947
Energy: 1.243198636026287
Energy: 0.9800709783618232
Energy: 1.1039600665914864
Energy: 1.5081078751687125
Energy: 1.1039600665892377
Energy: 0.9800709783633224
Energy: 1.1039600665907368
Energy: 0.9823258341086264
Energy: 1.2226409093130413
Energy: 1.2928155471678198
Energy: 1.2226409093160393
Energy: 0.9823258341086264
Energy: 1.2226409093145403
Energy: 0.9724902972747612
Energy: 1.0989244846178434
Energy: 1.345220705203923
Energy: 1.0989244846125967
Energy: 0.9724902972747612
Energy: 1.0989244846148454
Energy: 0.9630754653841024
Energy: 1.1964164292280892
Energy: 0.9935466893436574
Energy: 1.1964164292280892
Energy: 0.963075465384852
Energy: 1.1964164292280892
Energy: 0.9829514090738304
Energy: 1.2222821605969152
Energy: 1.130328614442379
Energy: 1.2222821605954162
Energy: 0.9829514090738304
Energy: 1.2222821605946665

minimum gb energy = 0.9608684790360533 eV
minimum distance =  2.22142377446186 Angstroms
sigma value = 43


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

Energy: 1.5401140943216964
Energy: 1.367261168999861
Energy: 1.2366438520749619
Energy: 1.3672611690007814
Energy: 1.5401140943161722
Energy: 1.3672611690007814
Energy: 1.6899220654593068
Energy: 1.0897643039546336
Energy: 1.048679396361809
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Energy: 1.099642503236519
Energy: 1.3380244841117053
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Energy: 1.0996425032374397
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Energy: 1.22959237999962
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Energy: 1.0553618676317782
Energy: 1.3423199864032827
Energy: 1.0355535979042205
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Energy: 1.035304814032618
Energy: 1.3153012074199346
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Energy: 1.1958731086640024
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Energy: 1.0715552179034988
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Energy: 1.0515280738553239
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Energy: 1.3303692270132674
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Energy: 1.0491233455015807
Energy: 1.3077100128336578
Energy: 1.0806985024345452
Energy: 1.3077100128345784
Energy: 1.0491233455025015
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Energy: 1.0516432347070808
Energy: 1.036726072727651
Energy: 1.3414208363974112
Energy: 1.0367260727267302
Energy: 1.0516432347061602
Energy: 1.0367260727258096
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Energy: 1.3312196247609898
Energy: 1.040324652234439
Energy: 1.3312196247619104
Energy: 1.0388274254318055
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Energy: 1.0404893701704712
Energy: 1.3150705734569736
Energy: 1.0359276146434302
Energy: 1.315070573458815
Energy: 1.0404893701713918
Energy: 1.3150705734578945
Energy: 1.4182651550671332
Energy: 1.1903999763477722
Energy: 1.0491840277168263
Energy: 1.1903999763477722
Energy: 1.4182651550671332
Energy: 1.19039997634501
Energy: 1.4193201399271154
Energy: 1.3079237650281792
Energy: 1.3479849372496546
Energy: 1.3079237650291
Energy: 1.4193201399271154
Energy: 1.3079237650281792
Energy: 1.4510583651699664
Energy: 1.3393407409108975
Energy: 1.043571212088348
Energy: 1.3393407409108975
Energy: 1.4510583651699664
Energy: 1.3393407409108975
Energy: 1.4524145781278037
Energy: 1.3408376956124917
Energy: 1.0439425668825517
Energy: 1.3408376956115708
Energy: 1.4524145781287243
Energy: 1.3408376956124917
Energy: 1.418423839231527
Energy: 1.3574361584019405
Energy: 1.0401074910679031
Energy: 1.35743615840102
Energy: 1.418423839231527
Energy: 1.35743615840102
Energy: 1.4192858165579685
Energy: 1.3734528954145173
Energy: 1.0401923735928629
Energy: 1.3734528954135965
Energy: 1.4192858165579685
Energy: 1.3734528954145173
Energy: 1.038851152567837
Energy: 1.3150816581856146
Energy: 1.0369122726123206
Energy: 1.315081658183773
Energy: 1.038851152567837
Energy: 1.3150816581856146
Energy: 1.0406959451092392
Energy: 1.3308513140649232
Energy: 1.0390493629925204
Energy: 1.3308513140630818
Energy: 1.0406959451101603
Energy: 1.3308513140630818
Energy: 1.049329189556922
Energy: 1.341374930465289
Energy: 1.0387497171228925
Energy: 1.3413749304643687
Energy: 1.0493291895578427
Energy: 1.3413749304643687
Energy: 1.0517792927457343
Energy: 1.372931455711225
Energy: 1.082432971143866
Energy: 1.372931455711225
Energy: 1.0517792927457343
Energy: 1.372931455711225
Energy: 1.040506690110625
Energy: 1.3444345040451764
Energy: 1.4190329023503354
Energy: 1.3444345040451764
Energy: 1.0405066901097044
Energy: 1.3444345040451764
Energy: 1.0435006964554612
Energy: 1.341207496184516
Energy: 1.4532909956422935
Energy: 1.341207496184516
Energy: 1.0435006964563818
Energy: 1.341207496184516
Energy: 1.052581769581652
Energy: 1.3313891328752157
Energy: 1.3010026375106003
Energy: 1.3313891328752157
Energy: 1.0525817695807316
Energy: 1.3313891328752157
Energy: 1.0734418421048788
Energy: 1.3074402492782262
Energy: 1.082323932140387
Energy: 1.3074402492809882
Energy: 1.0734418421057992
Energy: 1.3074402492800679
Energy: 1.040766456264948
Energy: 1.1909763201124772
Energy: 1.2494904833570173
Energy: 1.1909763201115566
Energy: 1.0407664562658683
Energy: 1.1909763201124772
Energy: 1.0364008404204026
Energy: 1.3155409947011831
Energy: 1.038830570242054
Energy: 1.3155409947011831
Energy: 1.0364008404194818
Energy: 1.3155409947021037

minimum gb energy = 1.0353048140316972 eV
minimum distance =  2.22986302249907 Angstroms
sigma value = 57


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

Energy: 1.2138120390825322
Energy: 1.4804424713251987
Energy: 1.5978575289186974
Energy: 1.4804424713228144
Energy: 1.2138120390837241
Energy: 1.4804424713228144
Energy: 1.4241213906935228
Energy: 1.2159180037005812
Energy: 1.129537344580485
Energy: 1.2159180037005812
Energy: 1.4241213906935228
Energy: 1.2159180037017734
Energy: 1.1448043663137724
Energy: 1.4716950528427724
Energy: 1.3417347061077487
Energy: 1.4716950528427724
Energy: 1.1448043663137724
Energy: 1.4716950528427724
Energy: 1.1581544955001672
Energy: 1.1518553867457815
Energy: 1.1330351350242274
Energy: 1.1518553867469736
Energy: 1.1581544955001672
Energy: 1.1518553867457815
Energy: 1.129408323329207
Energy: 1.1577568408174448
Energy: 1.2966717157917724
Energy: 1.1577568408150607
Energy: 1.129408323329207
Energy: 1.1577568408150607
Energy: 1.1464139144683854
Energy: 1.4570010199017887
Energy: 1.132408179423473
Energy: 1.457001019904173
Energy: 1.1464139144683854
Energy: 1.457001019904173
Energy: 1.143834747209199
Energy: 1.333443638886492
Energy: 1.4228133873542654
Energy: 1.3334436388853002
Energy: 1.143834747209199
Energy: 1.3334436388853002
Energy: 1.1450822951266724
Energy: 1.465506619886919
Energy: 1.1943787793094705
Energy: 1.4655066198893034
Energy: 1.1450822951254804
Energy: 1.465506619886919
Energy: 1.1294966113315845
Energy: 1.1988617002445077
Energy: 1.3003016280001716
Energy: 1.1988617002421234
Energy: 1.1294966113303926
Energy: 1.198861700239739
Energy: 1.149989252773074
Energy: 1.4569771434615122
Energy: 1.1292279655036652
Energy: 1.4569771434627043
Energy: 1.149989252774266
Energy: 1.4569771434627043
Energy: 1.1435284311947205
Energy: 1.1464121550918012
Energy: 1.1396431334222161
Energy: 1.1464121550894169
Energy: 1.1435284311947205
Energy: 1.146412155090609
Energy: 1.129927474978512
Energy: 1.3235389810148686
Energy: 1.1293141688011088
Energy: 1.3235389810172526
Energy: 1.129927474978512
Energy: 1.3235389810172526
Energy: 1.1295338738940228
Energy: 1.457313245995055
Energy: 1.1803424844567003
Energy: 1.457313245995055
Energy: 1.1295338738940228
Energy: 1.457313245996247
Energy: 1.4091715133733052
Energy: 1.321338875096089
Energy: 1.1427615909655544
Energy: 1.321338875096089
Energy: 1.409171513374497
Energy: 1.3213388750937045
Energy: 1.6642247996781938
Energy: 1.4642832521658744
Energy: 1.142825351020204
Energy: 1.4642832521658744
Energy: 1.6642247996781938
Energy: 1.4642832521670668
Energy: 1.1300082274733947
Energy: 1.4884636416619723
Energy: 1.1294695695028978
Energy: 1.4884636416643566
Energy: 1.1300082274745866
Energy: 1.4884636416655488
Energy: 1.1297907620240424
Energy: 1.3342771790458496
Energy: 1.1427757842737918
Energy: 1.3342771790446575
Energy: 1.1297907620240424
Energy: 1.3342771790446575
Energy: 1.143987315300625
Energy: 1.3472576682085036
Energy: 1.1444888509790752
Energy: 1.3472576682049273
Energy: 1.143987315301817
Energy: 1.3472576682085036
Energy: 1.1427455379029061
Energy: 1.3342023696755803
Energy: 1.129795764594957
Energy: 1.3342023696755803
Energy: 1.1427455379029061
Energy: 1.3342023696767722
Energy: 1.129505450636813
Energy: 1.4882049762591985
Energy: 1.1299490118358748
Energy: 1.4882049762591985
Energy: 1.1295054506356208
Energy: 1.4882049762615828
Energy: 1.1431752267335302
Energy: 1.4642169873171766
Energy: 1.6638392955986452
Energy: 1.4642169873183688
Energy: 1.1431752267335302
Energy: 1.4642169873171766
Energy: 1.1424756622534458
Energy: 1.3303464767474145
Energy: 1.4094731985615725
Energy: 1.3303464767474145
Energy: 1.1424756622522538
Energy: 1.3303464767450301
Energy: 1.164332737700959
Energy: 1.457385427992149
Energy: 1.129537141577508
Energy: 1.457385427989765
Energy: 1.164332737700959
Energy: 1.4573854279909568
Energy: 1.129260543941009
Energy: 1.3249339984885835
Energy: 1.1299040691451474
Energy: 1.3249339984909678
Energy: 1.129260543939817
Energy: 1.3249339984897757

minimum gb energy = 1.1292279655036652 eV
minimum distance =  2.22587888181127 Angstroms
sigma value = 17


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

Energy: 1.250798668313187
Energy: 1.2508344288006144
Energy: 1.6150934248971502
Energy: 1.2508344288006144
Energy: 1.250798668313187
Energy: 1.2508344288006144
Energy: 1.2803263505926485
Energy: 1.252926889569172
Energy: 1.2526369144253888
Energy: 1.2529268895674863
Energy: 1.2803263505926485
Energy: 1.252926889569172
Energy: 1.2718282237581886
Energy: 1.2689607013968618
Energy: 1.451769965838989
Energy: 1.2689607013968618
Energy: 1.2718282237581886
Energy: 1.2689607013968618
Energy: 1.268159183931449
Energy: 1.2669191314446417
Energy: 1.2520371526427536
Energy: 1.2669191314446417
Energy: 1.268159183931449
Energy: 1.2669191314429558
Energy: 1.2530348974051675
Energy: 1.270257234583179
Energy: 1.2791942610801554
Energy: 1.2702572345865508
Energy: 1.2530348974051675
Energy: 1.270257234584865
Energy: 1.2573696760244948
Energy: 1.251098114384266
Energy: 1.235336518183026
Energy: 1.251098114384266
Energy: 1.2573696760261808
Energy: 1.2510981143825801
Energy: 1.259711096308115
Energy: 1.386885017342885
Energy: 1.2795885347208096
Energy: 1.386885017342885
Energy: 1.259711096308115
Energy: 1.3868850173479428
Energy: 1.2594684680004218
Energy: 1.3667318089592617
Energy: 1.2518820428728967
Energy: 1.3667318089592617
Energy: 1.2594684680004218
Energy: 1.3667318089592617
Energy: 1.2530231660692586
Energy: 1.2676370745920713
Energy: 1.344957945628863
Energy: 1.2676370745937573
Energy: 1.2530231660692586
Energy: 1.2676370745937573
Energy: 1.2355770133249395
Energy: 1.2250897891512416
Energy: 1.2533507026757624
Energy: 1.2250897891512416
Energy: 1.2355770133249395
Energy: 1.2250897891512416
Energy: 1.2362541624539143
Energy: 1.4687590953656906
Energy: 1.2547354798283092
Energy: 1.4687590953673766
Energy: 1.2362541624539143
Energy: 1.4687590953673766
Energy: 1.263998510407593
Energy: 1.266098822559852
Energy: 1.255587235841846
Energy: 1.2660988225548326
Energy: 1.263998510407593
Energy: 1.2660988225565186
Energy: 1.253064316717713
Energy: 1.3682398358359729
Energy: 1.2568680500313056
Energy: 1.368239835837659
Energy: 1.253064316717713
Energy: 1.368239835837659
Energy: 1.2583366982674458
Energy: 1.266791864938665
Energy: 1.2533067930397934
Energy: 1.266791864936979
Energy: 1.2583366982674458
Energy: 1.266791864938665
Energy: 1.2611554510406715
Energy: 1.4812087987686713
Energy: 1.235492971358637
Energy: 1.4812087987686713
Energy: 1.2611554510406715
Energy: 1.4812087987686713
Energy: 1.2569816827540323
Energy: 1.4701154693432381
Energy: 1.2374167239839062
Energy: 1.4701154694173784
Energy: 1.2569816827540323
Energy: 1.4701154689977853
Energy: 1.2557881188745772
Energy: 1.2664994719256748
Energy: 1.2645683843715936
Energy: 1.2664994719273608
Energy: 1.255788118877949
Energy: 1.2664994719273608

minimum gb energy = 1.2250897891512416 eV
minimum distance =  2.22767826766318 Angstroms
sigma value = 17


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

Energy: 1.6985413544849588
Energy: 1.6922019576385863
Energy: 1.7609943935697558
Energy: 1.6922019576385863
Energy: 1.6985413544843078
Energy: 1.6922019576385863
Energy: 1.5269254863815311
Energy: 1.308000232106842
Energy: 1.2877544554242752
Energy: 1.3080002321107482
Energy: 1.5269254863828334
Energy: 1.3080002321061908
Energy: 1.288577405649854
Energy: 1.3499184196510923
Energy: 1.309434174859609
Energy: 1.3499184196875202
Energy: 1.288577405650505
Energy: 1.3499184196771334
Energy: 1.3270888349584213
Energy: 1.5722465929111435
Energy: 1.33523919128318
Energy: 1.5722465929130967
Energy: 1.3270888349675354
Energy: 1.5722465929117946
Energy: 1.2901468682483952
Energy: 1.3484837470573203
Energy: 1.5332094036002597
Energy: 1.3484837470566693
Energy: 1.2901468682477444
Energy: 1.3484837470592737
Energy: 1.3549165107900916
Energy: 1.5738170176878328
Energy: 1.355495585276748
Energy: 1.57381701768588
Energy: 1.3549165107907426
Energy: 1.57381701768588
Energy: 1.2866056839965874
Energy: 1.38039042286599
Energy: 1.5240471248469103
Energy: 1.3803904228555737
Energy: 1.2866056839952855
Energy: 1.380390422864688
Energy: 1.6155307834285864
Energy: 1.4308627354775443
Energy: 1.2903330342239336
Energy: 1.4308627354807992
Energy: 1.6155307834272843
Energy: 1.430862735472336
Energy: 1.3602990054206743
Energy: 1.639843197149016
Energy: 1.3123528563175062
Energy: 1.6398431971496668
Energy: 1.360299005417419
Energy: 1.6398431971496668
Energy: 1.6159354662030396
Energy: 1.3438036230082129
Energy: 1.2870904511708599
Energy: 1.349989195759643
Energy: 1.6159354662023886
Energy: 1.343803623008864
Energy: 1.3316115151849373
Energy: 1.6380230092992671
Energy: 1.3371034661346772
Energy: 1.6380230093012202
Energy: 1.3316115151849373
Energy: 1.6380230093018713
Energy: 1.3218752799952935
Energy: 1.5756126211428656
Energy: 1.2868201468189246
Energy: 1.5756126211428656
Energy: 1.3218752799952935
Energy: 1.5756126211454697
Energy: 1.2918690084209892
Energy: 1.4326526931562935
Energy: 1.6814310060739097
Energy: 1.4326526931615018
Energy: 1.2918690084203381
Energy: 1.4326526931556425
Energy: 1.3025499266263276
Energy: 1.5598348536060032
Energy: 1.6820859472324452
Energy: 1.559834853602097
Energy: 1.3025499266263276
Energy: 1.5598348536073052
Energy: 1.30104446765517
Energy: 1.6476991771771268
Energy: 1.3408613327021843
Energy: 1.6476991771777778
Energy: 1.3010444676538677
Energy: 1.6476991771784288
Energy: 1.3342452998956371
Energy: 1.6621339798310042
Energy: 1.2869141266359543
Energy: 1.6368684653309402
Energy: 1.3342452998956371
Energy: 1.6621339798303532
Energy: 1.3283041325176557
Energy: 1.6645247170843305
Energy: 1.3034865066826025
Energy: 1.6645247170823774
Energy: 1.3283041325176557
Energy: 1.6645247170823774
Energy: 1.67088369020532
Energy: 1.5367845709592973
Energy: 1.310305478651974
Energy: 1.5367845709651566
Energy: 1.670883690204669
Energy: 1.5367845709664587
Energy: 1.5879182701438415
Energy: 1.5382364628404122
Energy: 1.287061948088772
Energy: 1.53823646283911
Energy: 1.5879182701464454
Energy: 1.53823646283911
Energy: 1.2903020585307179
Energy: 1.5984640952735376
Energy: 1.2878464756659271
Energy: 1.5310148330590707
Energy: 1.2903020585294158
Energy: 1.5984640952728866
Energy: 1.287084422451442
Energy: 1.5378639387893933
Energy: 1.6674576475253098
Energy: 1.5378639387900443
Energy: 1.2870844224507907
Energy: 1.5378639387919972
Energy: 1.3102584364787455
Energy: 1.530827133034883
Energy: 1.6711776903327156
Energy: 1.530827133035534
Energy: 1.3102584364800476
Energy: 1.5308271330342318
Energy: 1.3038912749750289
Energy: 1.6644831866214003
Energy: 1.3288914925791497
Energy: 1.6644831866214003
Energy: 1.3038912749743778
Energy: 1.6644831866214003
Energy: 1.2869616438105722
Energy: 1.5696397347510498
Energy: 1.33300334923823
Energy: 1.5696397347471438
Energy: 1.2869616438105722
Energy: 1.5696397347471438
Energy: 1.3343290418733729
Energy: 1.6476619361553362
Energy: 1.3017643457748995
Energy: 1.6476619361553362
Energy: 1.334329041875977
Energy: 1.6476619361559874
Energy: 1.6822108246904943
Energy: 1.5505130948809722
Energy: 1.3026245422860632
Energy: 1.550513094882274
Energy: 1.6822108246917964
Energy: 1.550513094876415
Energy: 1.6812988780138465
Energy: 1.4328751488838847
Energy: 1.2919471738384776
Energy: 1.4328751488838847
Energy: 1.6812988780144975
Energy: 1.4328751488838847
Energy: 1.2867401658852573
Energy: 1.5736720543038125
Energy: 1.3212837826776294
Energy: 1.5736720543044636
Energy: 1.2867401658852573
Energy: 1.5736720543051148
Energy: 1.3372018120830633
Energy: 1.6375608596696334
Energy: 1.3311085528165716
Energy: 1.6375608596715865
Energy: 1.337201812081761
Energy: 1.6375608596702842
Energy: 1.2872684804025254
Energy: 1.4566546664069788
Energy: 1.6158713369223674
Energy: 1.4566546664069788
Energy: 1.2872684804025254
Energy: 1.4566546664102045
Energy: 1.310549354723512
Energy: 1.6403493287108841
Energy: 1.3603713691529438
Energy: 1.6403493287115352
Energy: 1.3105493547228608
Energy: 1.6403493287108841
Energy: 1.2900866409708858
Energy: 1.4329040843833243
Energy: 1.6158515245793905
Energy: 1.4329040843839753
Energy: 1.2900866409708858
Energy: 1.4329040843839753
Energy: 1.5237768414571746
Energy: 1.379878291251045
Energy: 1.2866553613549225
Energy: 1.3798782912542704
Energy: 1.5237768414558723
Energy: 1.3798782912497431
Energy: 1.3562839226330656
Energy: 1.574934677220772
Energy: 1.356630456964254
Energy: 1.574934677221423
Energy: 1.3562839226337167
Energy: 1.574934677222074
Energy: 1.5245092793298063
Energy: 1.3484837470573203
Energy: 1.2917283170839546
Energy: 1.3484837470573203
Energy: 1.5245092793291553
Energy: 1.3484837470579716
Energy: 1.3351262313480254
Energy: 1.568146305272601
Energy: 1.3235618476877757
Energy: 1.56814630527195
Energy: 1.3351262313480254
Energy: 1.56814630527195
Energy: 1.3136581855382876
Energy: 1.3463300137979215
Energy: 1.2885803660916388
Energy: 1.3463300133567024
Energy: 1.3136581854140006
Energy: 1.3463300133527965
Energy: 1.2876693744615761
Energy: 1.314309932881281
Energy: 1.5280038594009595
Energy: 1.314309932879979
Energy: 1.2876693744628485
Energy: 1.3143099328819323
Energy: 1.5379053377044833
Energy: 1.6922019576379352
Energy: 1.6985413544856098
Energy: 1.6922019576372842
Energy: 1.5379053377031813
Energy: 1.6922019576372842
Energy: 1.2877544554255773
Energy: 1.3080002321133521
Energy: 1.5269254863821822
Energy: 1.3080002321159265
Energy: 1.2877544554255773
Energy: 1.3080002321159265
Energy: 1.3094341752955905
Energy: 1.34991841966867
Energy: 1.288577405652458
Energy: 1.3499184196946816
Energy: 1.3094341751628402
Energy: 1.3499184196907754
Energy: 1.3352391912851331
Energy: 1.5722465929130967
Energy: 1.3270888347189613
Energy: 1.5722465929143987
Energy: 1.3352391912838308
Energy: 1.5722465929150498
Energy: 1.5332094035989576
Energy: 1.3484837470573203
Energy: 1.2901468682496973
Energy: 1.348483747052763
Energy: 1.5332094035996087
Energy: 1.3484837470573203

minimum gb energy = 1.2866056839952855 eV
minimum distance =  2.21205488402014 Angstroms
sigma value = 57


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

Energy: 1.4010886038071804
Energy: 1.6611567786104209
Energy: 1.596839471319059
Energy: 1.6611567786189012
Energy: 1.4010886038093002
Energy: 1.6611567786189012
Energy: 1.369590672485699
Energy: 1.3138692114209471
Energy: 1.307772855410379
Energy: 1.313869211416707
Energy: 1.369590672485699
Energy: 1.313869211414587
Energy: 1.2793072159821872
Energy: 1.4105998286680126
Energy: 1.4957342882068478
Energy: 1.4105998286786128
Energy: 1.2793072159821872
Energy: 1.4105998286616521
Energy: 1.3914042960237152
Energy: 1.3832181586576713
Energy: 1.3616558865019144
Energy: 1.3832181586470709
Energy: 1.3914042960226551
Energy: 1.3832181586491912
Energy: 1.2827852012967411
Energy: 1.3869232891585714
Energy: 1.38765533822703
Energy: 1.3869232891564514
Energy: 1.2827852012967411
Energy: 1.3869232891553913
Energy: 1.3844566765134159
Energy: 1.3711831469637261
Energy: 1.3603000835510464
Energy: 1.3711831470061269
Energy: 1.3844566765123558
Energy: 1.3711831469796263
Energy: 1.2826002211767973
Energy: 1.3883734168205093
Energy: 1.3242285316472275
Energy: 1.3883734178037823
Energy: 1.2826002211767973
Energy: 1.3883734171956148
Energy: 1.6452594570835548
Energy: 1.356616800218565
Energy: 1.3079085496813743
Energy: 1.3566168002302255
Energy: 1.6452594570814347
Energy: 1.3566168002281052
Energy: 1.3954853491757884
Energy: 1.6989797643947806
Energy: 1.3228471259125343
Energy: 1.6989797643947806
Energy: 1.3954853491747283
Energy: 1.6989797643937203
Energy: 1.3620960089138499
Energy: 1.3105779973178504
Energy: 1.3096036202792283
Energy: 1.3105779973263305
Energy: 1.3620960089933039
Energy: 1.3105779973252707
Energy: 1.2824247457873945
Energy: 1.481526335828717
Energy: 1.3654666414108252
Energy: 1.4815263365132063
Energy: 1.2824247457863343
Energy: 1.4815263313128988
Energy: 1.3759910214543845
Energy: 1.3593450119376713
Energy: 1.3533845592732647
Energy: 1.3593450119387316
Energy: 1.3759910214543845
Energy: 1.3593450119387316
Energy: 1.2875001766936545
Energy: 1.5320643134988896
Energy: 1.3652156151681383
Energy: 1.5320643135031295
Energy: 1.2875001766936545
Energy: 1.5320643134946494
Energy: 1.3721246271347987
Energy: 1.4251166328551337
Energy: 1.353432788260829
Energy: 1.4251166328583138
Energy: 1.3721246271326784
Energy: 1.4251166328572535
Energy: 1.2869400538612425
Energy: 1.3860036087869514
Energy: 1.3240404094209905
Energy: 1.3860036087922514
Energy: 1.2869400538601823
Energy: 1.3860036087890713
Energy: 1.643738554203639
Energy: 1.580794524787715
Energy: 1.309233864771425
Energy: 1.580794524789835
Energy: 1.643738554196267
Energy: 1.5807945247930149
Energy: 1.3858503604542791
Energy: 1.544825727260349
Energy: 1.3185088518654102
Energy: 1.5448257272635293
Energy: 1.3858503604532193
Energy: 1.5448257272550487
Energy: 1.3698967253897465
Energy: 1.3694561466585484
Energy: 1.3145566864213296
Energy: 1.3694561468153363
Energy: 1.3698967253897465
Energy: 1.3694561463915174
Energy: 1.2872013102194324
Energy: 1.5295178287311584
Energy: 1.354574786941371
Energy: 1.5295178287311584
Energy: 1.2872013102194324
Energy: 1.529517828729038
Energy: 1.3782964717061692
Energy: 1.5457751450598798
Energy: 1.3522849754754285
Energy: 1.545775144081907
Energy: 1.3782964717061692
Energy: 1.5457751426302944
Energy: 1.2950412168988898
Energy: 1.5264070338395521
Energy: 1.3562908089834647
Energy: 1.5264070338437923
Energy: 1.2950412168978298
Energy: 1.526407033841672
Energy: 1.2805375620355777
Energy: 1.5364397066470366
Energy: 1.3524467815990866
Energy: 1.5364397066480966
Energy: 1.2805375620345176
Energy: 1.5364397066470366
Energy: 1.2899448510541913
Energy: 1.3719496712911692
Energy: 1.318157305556731
Energy: 1.3719496712848092
Energy: 1.289944851053131
Energy: 1.371949671274209
Energy: 1.3865515136249353
Energy: 1.5472565734712675
Energy: 1.3145458051173713
Energy: 1.5472565734627872
Energy: 1.3865515136228155
Energy: 1.5472565734596069
Energy: 1.3876541818954569
Energy: 1.5434692980323232
Energy: 1.313920541658268
Energy: 1.5434692979867903
Energy: 1.3876541818912167
Energy: 1.5434692980588238
Energy: 1.280174390106832
Energy: 1.3973221842307608
Energy: 1.3199009728108857
Energy: 1.397322184241361
Energy: 1.2801743901057723
Energy: 1.3973221842254608
Energy: 1.290189030832955
Energy: 1.5369222643843292
Energy: 1.3512068224796585
Energy: 1.536922264386449
Energy: 1.290189030832955
Energy: 1.5369222643875091

minimum gb energy = 1.2793072159821872 eV
minimum distance =  2.23501648960102 Angstroms
sigma value = 43


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

Energy: 1.4556299209401065
Energy: 1.644920748486824
Energy: 1.7985736692767313
Energy: 1.644920748491423
Energy: 1.455629920940879
Energy: 1.6449207484875965
Energy: 1.38990199777903
Energy: 1.357507432733077
Energy: 1.323632002719446
Energy: 1.3575074327462067
Energy: 1.3899019977805744
Energy: 1.3575074327608814
Energy: 1.3265402605965535
Energy: 1.4380735599447143
Energy: 1.604580222149882
Energy: 1.4380735599423973
Energy: 1.3265402605965535
Energy: 1.4380735599431698
Energy: 1.4439465251917578
Energy: 1.6178995570022707
Energy: 1.4067140051627278
Energy: 1.6178995570014985
Energy: 1.4439465251909853
Energy: 1.6178995570007262
Energy: 1.3269157419063893
Energy: 1.406031693641714
Energy: 1.4156170853346282
Energy: 1.406031693582279
Energy: 1.3269157419063893
Energy: 1.4060316936741173
Energy: 1.4019804380323284
Energy: 1.4236602826802653
Energy: 1.3250153108950544
Energy: 1.423660282643965
Energy: 1.4019804380423688
Energy: 1.423660282670225
Energy: 1.3261258321173504
Energy: 1.4119830850357633
Energy: 1.3613566898127938
Energy: 1.4119830849431174
Energy: 1.3261258321173504
Energy: 1.4119830848273012
Energy: 1.4344116651218408
Energy: 1.4050230593628577
Energy: 1.3279277391664102
Energy: 1.4050230593620854
Energy: 1.4344116651195238
Energy: 1.4050230593628577
Energy: 1.4047218343052739
Energy: 1.618571945768551
Energy: 1.4314707565570686
Energy: 1.6185719457716405
Energy: 1.4047218343045018
Energy: 1.6185719457716405
Energy: 1.532864103657593
Energy: 1.4412013806548174
Energy: 1.3259871907965923
Energy: 1.441201380542898
Energy: 1.5328641036599098
Energy: 1.4412013806625408
Energy: 1.3248529162568088
Energy: 1.3727960295052999
Energy: 1.6224331394959757
Energy: 1.3727960295052999
Energy: 1.3248529162575813
Energy: 1.3727960295052999
Energy: 1.356602824616919
Energy: 1.5916775385733646
Energy: 1.4432916299890772
Energy: 1.5916775396117073
Energy: 1.3566028246176913
Energy: 1.5916775434091692
Energy: 1.3289014659600102
Energy: 1.3622240414369386
Energy: 1.4291428861026856
Energy: 1.3622240413975493
Energy: 1.3289014659600102
Energy: 1.3622240413967768
Energy: 1.4037723557821107
Energy: 1.4854015756393262
Energy: 1.326069271804949
Energy: 1.4854015756393262
Energy: 1.4037723557821107
Energy: 1.4854015756385541
Energy: 1.4009820251588068
Energy: 1.6183058941087145
Energy: 1.3591431721760319
Energy: 1.6183058941164377
Energy: 1.4009820251580343
Energy: 1.6183058941295676
Energy: 1.4061578235102863
Energy: 1.542905460423514
Energy: 1.330321755504374
Energy: 1.542905460423514
Energy: 1.4061578235133756
Energy: 1.5429054604242862
Energy: 1.3307203816580166
Energy: 1.4967146793424708
Energy: 1.399646775122272
Energy: 1.4967146793386092
Energy: 1.3307203816580166
Energy: 1.4967146793401538
Energy: 1.355879199278907
Energy: 1.4101486382645845
Energy: 1.3251004510082427
Energy: 1.4101486376654933
Energy: 1.3558791992796795
Energy: 1.4101486386822457
Energy: 1.3438527830535445
Energy: 1.471004883848066
Energy: 1.4045763264466897
Energy: 1.4710048838527001
Energy: 1.343852783052772
Energy: 1.471004883848066
Energy: 1.3431544520712753
Energy: 1.5838768272560448
Energy: 1.4007428091977965
Energy: 1.5838768272560448
Energy: 1.3431544520720478
Energy: 1.5838768272544999
Energy: 1.3322478446930932
Energy: 1.4281049065108808
Energy: 1.356008994832281
Energy: 1.428104906475353
Energy: 1.3322478446938657
Energy: 1.4281049064877105
Energy: 1.7239374112465393
Energy: 1.4825610384920684
Energy: 1.331130133401534
Energy: 1.482561038504426
Energy: 1.7239374112465393
Energy: 1.482561038463527
Energy: 1.624671244010574
Energy: 1.5432717773553266
Energy: 1.3580690674072824
Energy: 1.543271777356099
Energy: 1.6246712440074846
Energy: 1.543271777356099
Energy: 1.334592805853618
Energy: 1.6188215917287758
Energy: 1.3559285908631349
Energy: 1.6188215917349544
Energy: 1.3345928058474392
Energy: 1.6188215917102393
Energy: 1.3329910157555773
Energy: 1.5837820506676408
Energy: 1.4115035891895642
Energy: 1.5837820506715026
Energy: 1.3329910157555773
Energy: 1.58378205067073
Energy: 1.3630822021431999
Energy: 1.566907734255454
Energy: 1.4068012467513804
Energy: 1.5669077342616329
Energy: 1.3630822021431999
Energy: 1.5669077341906126
Energy: 1.3426514804899814
Energy: 1.5381153780709138
Energy: 1.4005178444484783
Energy: 1.5381153798696616
Energy: 1.3426514804892091
Energy: 1.5381153949367425
Energy: 1.3990775474975432
Energy: 1.734343970849713
Energy: 1.3990558549379997
Energy: 1.7343439708489408
Energy: 1.3990775474975432
Energy: 1.7343439708489408
Energy: 1.4008129129760507
Energy: 1.5404109735585605
Energy: 1.3684002802850368
Energy: 1.5404109735832756
Energy: 1.4008129129791402
Energy: 1.5404109735539269
Energy: 1.4059443186255476
Energy: 1.5650897947548843
Energy: 1.360535480864563
Energy: 1.5650897949162332
Energy: 1.4059443186263199
Energy: 1.5650897947263427
Energy: 1.4113353956464192
Energy: 1.583734751633841
Energy: 1.3321081467326694
Energy: 1.5837347516353855
Energy: 1.4113353956456467
Energy: 1.5837347516353855
Energy: 1.3559413227201602
Energy: 1.4210122476469296
Energy: 1.340782417729704
Energy: 1.4210122482074037
Energy: 1.3559413227193877
Energy: 1.4210122470262478
Energy: 1.3581310611828854
Energy: 1.5431669431935833
Energy: 1.8207591998869423
Energy: 1.5431669431943558
Energy: 1.3581310611828854
Energy: 1.5431669431920385
Energy: 1.3308425639850114
Energy: 1.485911039345373
Energy: 1.7237700181121491
Energy: 1.485911041283072
Energy: 1.3308425639865562
Energy: 1.4859110392087387
Energy: 1.3602028339431806
Energy: 1.4178360360100155
Energy: 1.3324409908818755
Energy: 1.417836036118108
Energy: 1.3602028339439531
Energy: 1.4178360359420845
Energy: 1.4012290352292058
Energy: 1.583817899590374
Energy: 1.3424623465326833
Energy: 1.583817899590374
Energy: 1.4012290352284336
Energy: 1.5838178995896017

minimum gb energy = 1.323632002719446 eV
minimum distance =  2.23346909166202 Angstroms
sigma value = 81


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

Energy: 1.3698488003809375
Energy: 1.375180607811095
Energy: 2.2094905342324163
Energy: 1.3751806078122233
Energy: 1.3698488003806473
Energy: 1.3751806078122233
Energy: 1.5668306115378388
Energy: 1.374551212269095
Energy: 1.3697762565649663
Energy: 1.3745512122688048
Energy: 1.5668306115392576
Energy: 1.374551212269353
Energy: 1.369734094638783
Energy: 1.3741870857914047
Energy: 1.5428901791638163
Energy: 1.3741870857914047
Energy: 1.3697340946384928
Energy: 1.3741870857914047
Energy: 2.2094905342321263
Energy: 1.3751806078119335
Energy: 1.3698488003811953
Energy: 1.375180607811643
Energy: 2.2094905342321263
Energy: 1.3751806078130622
Energy: 1.3697762565646763
Energy: 1.374551212269095
Energy: 1.5668306115389998
Energy: 1.3745512122682246
Energy: 1.3697762565649663
Energy: 1.374551212267386
Energy: 1.6969242670881601
Energy: 1.374187085790276
Energy: 1.3697340946393635
Energy: 1.3741870857908565
Energy: 1.6969242670881601
Energy: 1.3741870857914047
Energy: 1.3698488003806473
Energy: 1.3751806078119335
Energy: 1.644364096633506
Energy: 1.375180607811643
Energy: 1.3698488003803568
Energy: 1.3751806078119335
Energy: 1.5668306115389998
Energy: 1.3745512122685148
Energy: 1.3697762565652243
Energy: 1.374551212269353
Energy: 1.5668306115375807
Energy: 1.3745512122685148
Energy: 1.3697340946393635
Energy: 1.3741870857914047
Energy: 1.6969242670892888
Energy: 1.3741870857925658
Energy: 1.369734094639073
Energy: 1.3741870857914047
Energy: 1.714945411670497
Energy: 1.3751806078122233
Energy: 1.3698488003809375
Energy: 1.375180607811643
Energy: 1.7149454116696583
Energy: 1.3751806078133522

minimum gb energy = 1.3697340946384928 eV
minimum distance =  2.23325072044274 Angstroms
sigma value = 3


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

Energy: 1.6755580067967222
Energy: 1.6830389221841353
Energy: 1.9514450847423994
Energy: 1.6830389221892306
Energy: 1.6755580067941747
Energy: 1.683038922186683
Energy: 1.5785262055148246
Energy: 1.3630189759785223
Energy: 1.3003709428867878
Energy: 1.3630189759751254
Energy: 1.5785262055139755
Energy: 1.3630189759717286
Energy: 1.338555928478116
Energy: 1.3385941728688644
Energy: 1.5761660815385685
Energy: 1.3385941728688644
Energy: 1.338555928478116
Energy: 1.338594172868015
Energy: 1.7271205522918365
Energy: 1.6820897112996487
Energy: 1.3558283120228325
Energy: 1.6820897112996487
Energy: 1.7271205522918365
Energy: 1.6820897113030455
Energy: 1.3439757777451582
Energy: 1.3419184369818944
Energy: 1.651398021871421
Energy: 1.341918436980196
Energy: 1.3439757777451582
Energy: 1.3419184369810453
Energy: 1.4922501029149937
Energy: 1.4025096609785719
Energy: 1.3040415182276726
Energy: 1.4025096610184462
Energy: 1.4922501406430164
Energy: 1.4025096609785719
Energy: 1.3442856349166787
Energy: 1.3513000012964969
Energy: 1.4866932339516437
Energy: 1.3513000012990446
Energy: 1.3442856349166787
Energy: 1.3513000012964969
Energy: 1.3412339808580789
Energy: 1.734252966075415
Energy: 1.3532474904824146
Energy: 1.734252966076264
Energy: 1.3412339808580789
Energy: 1.734252966076264
Energy: 1.3415534664841493
Energy: 1.5262876645626064
Energy: 1.6458160491816327
Energy: 1.5262876645609467
Energy: 1.3415534664841493
Energy: 1.5262876645609467
Energy: 1.338809650408384
Energy: 1.3647610934632133
Energy: 1.2990377698833637
Energy: 1.3647610934674592
Energy: 1.338809650408384
Energy: 1.3647610934649115
Energy: 1.6579943086614306
Energy: 1.5659265014085613
Energy: 1.373960495290827
Energy: 1.5659265014136565
Energy: 1.6579943086614306
Energy: 1.5659265014136565
Energy: 1.6620360686721534
Energy: 1.3275737884681766
Energy: 1.3017567292629995
Energy: 1.3275737889112706
Energy: 1.662036068671304
Energy: 1.3275737883408338
Energy: 1.3414012150728825
Energy: 1.427741359947459
Energy: 1.3016671692848518
Energy: 1.4277413599500066
Energy: 1.3414012150728825
Energy: 1.4277413599542526
Energy: 1.3390284269565063
Energy: 1.4140584257427615
Energy: 1.3547451481450299
Energy: 1.4140584257427615
Energy: 1.339028426955657
Energy: 1.4140584257444597
Energy: 1.3458045090713977
Energy: 1.3526262249140049
Energy: 1.3516526867735037
Energy: 1.3526262252696688
Energy: 1.3458045090713977
Energy: 1.3526262271370786
Energy: 1.3431290149485249
Energy: 1.364287222936837
Energy: 1.3035832248890649
Energy: 1.3642872229385352
Energy: 1.3431290149485249
Energy: 1.364287222937686
Energy: 1.3455629124100559
Energy: 1.4171087579575072
Energy: 1.3038498316524831
Energy: 1.4171087579634518
Energy: 1.3455629124100559
Energy: 1.4171087579549597
Energy: 1.342598283252435
Energy: 1.4417167343777457
Energy: 1.3517311452635417
Energy: 1.4417167343802935
Energy: 1.3425982832549828
Energy: 1.4417167343794441
Energy: 1.3392513927609722
Energy: 1.4163339582227406
Energy: 1.3514712851731883
Energy: 1.416333958221042
Energy: 1.3392513927618213
Energy: 1.416333958228685
Energy: 1.3394560332871346
Energy: 1.3430312785686453
Energy: 1.3017781980371494
Energy: 1.3430312780593516
Energy: 1.339456033287984
Energy: 1.3430312775424154
Energy: 1.661174050653
Energy: 1.3287027270374614
Energy: 1.301791413124365
Energy: 1.3287027270374614
Energy: 1.6611740506538493
Energy: 1.3287027270417076
Energy: 1.6569855914681477
Energy: 1.5702050543185535
Energy: 1.372171672377572
Energy: 1.570205054315195
Energy: 1.6569855914672986
Energy: 1.5702050543160058
Energy: 1.3386729726409843
Energy: 1.3690202316076492
Energy: 1.302516246698384
Energy: 1.3690202316169906
Energy: 1.3386729726409843
Energy: 1.3690202316195381
Energy: 1.3392478560591872
Energy: 1.5332148593709585
Energy: 1.6269095805512077
Energy: 1.5332148593735064
Energy: 1.339247856060036
Energy: 1.5332148593735064
Energy: 1.3418203872788146
Energy: 1.441847390320773
Energy: 1.3532486362505822
Energy: 1.4418473903190745
Energy: 1.341820387277965
Energy: 1.4418473903199238
Energy: 1.343562805819424
Energy: 1.5363988837781766
Energy: 1.4351351178608094
Energy: 1.5363971414936075
Energy: 1.343562805819424
Energy: 1.5364013096344562
Energy: 1.3416869140161838
Energy: 1.5646233294951968
Energy: 1.3006114219764284
Energy: 1.5646233294968954
Energy: 1.3416869140187313
Energy: 1.5646233294960459
Energy: 1.3434066041327053
Energy: 1.407802044672587
Energy: 1.656511366441642
Energy: 1.4078020446675303
Energy: 1.3434066041327053
Energy: 1.4078020446734365
Energy: 1.4511262911174236
Energy: 1.7372268736354182
Energy: 1.3559543638710685
Energy: 1.7372268736345688
Energy: 1.4511262911208207
Energy: 1.7372268736337197
Energy: 1.3377104887085935
Energy: 1.3584735567884263
Energy: 1.4652693175540463
Energy: 1.3584735567909738
Energy: 1.3377104887077442
Energy: 1.3584735567901245
Energy: 1.5689797638612926
Energy: 1.3622929620549784
Energy: 1.2994630027365912
Energy: 1.3622929620515813
Energy: 1.5689797638612926
Energy: 1.362292962054129
Energy: 1.669865103022042
Energy: 1.6826340010101073
Energy: 1.3681610551719199
Energy: 1.6826340010050118
Energy: 1.6698651030228913
Energy: 1.6826340010109564
Energy: 1.568855247828647
Energy: 1.3628242012173313
Energy: 1.2985014718689072
Energy: 1.3628242012156326
Energy: 1.5688552478260998
Energy: 1.3628242012156326

minimum gb energy = 1.2985014718689072 eV
minimum distance =  2.19193252553578 Angstroms
sigma value = 67


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

Energy: 1.4653929103239818
Energy: 1.8011684972812116
Energy: 1.7832785413156422
Energy: 1.801168497280002
Energy: 1.4653929103239818
Energy: 1.801168497278792
Energy: 1.6284096219108453
Energy: 1.4096109728414354
Energy: 1.2930439327888261
Energy: 1.4096109728438555
Energy: 1.6284096219120554
Energy: 1.4096109728426456
Energy: 1.2977804399595687
Energy: 1.3943013007473049
Energy: 1.476509258914722
Energy: 1.3943013007412548
Energy: 1.2977804399595687
Energy: 1.3943013007424647
Energy: 1.6405251400163248
Energy: 1.6627267159261478
Energy: 1.412150986278026
Energy: 1.6627267159249381
Energy: 1.6405251400163248
Energy: 1.6627267159261478
Energy: 1.4029211137009183
Energy: 1.6598019902804657
Energy: 1.5257573430283942
Energy: 1.6598019902804657
Energy: 1.4029211137009183
Energy: 1.6598019902828858
Energy: 1.4026735306790301
Energy: 1.4777260880591798
Energy: 1.2768823630937023
Energy: 1.4777260880555498
Energy: 1.4026735306766098
Energy: 1.4777260880591798
Energy: 1.4001462060314331
Energy: 1.3009534329415835
Energy: 1.3006907701315304
Energy: 1.300953433641914
Energy: 1.4001462060302232
Energy: 1.3009534342285016
Energy: 1.3973245613356455
Energy: 1.5416985890783654
Energy: 1.6849983168426448
Energy: 1.5416985890759456
Energy: 1.3973245613053948
Energy: 1.5416985890771555
Energy: 1.3948165520563633
Energy: 1.4141183491740514
Energy: 1.683868498213004
Energy: 1.4141183491752618
Energy: 1.3948165520575737
Energy: 1.4141183491752618
Energy: 1.396158194978343
Energy: 1.3001151153289963
Energy: 1.3017793566543159
Energy: 1.3001151164586655
Energy: 1.396158194978343
Energy: 1.30011511573661
Energy: 1.394605997388998
Energy: 1.4758334056273565
Energy: 1.307952357787614
Energy: 1.4758334056273565
Energy: 1.394605997388998
Energy: 1.4758334056249365
Energy: 1.3989380399239009
Energy: 1.3355932455499422
Energy: 1.3986708844592575
Energy: 1.335593245547522
Energy: 1.3989380399239009
Energy: 1.335593245547522
Energy: 1.3000246567055282
Energy: 1.433064235778753
Energy: 1.3960531636825881
Energy: 1.433064235777543
Energy: 1.3000246567031086
Energy: 1.433064235776333
Energy: 1.2976245467461156
Energy: 1.4233905222420782
Energy: 1.3968157983385638
Energy: 1.4233905224513577
Energy: 1.2976245467461156
Energy: 1.4233905217449774
Energy: 1.7541562835118103
Energy: 1.4419141449245538
Energy: 1.3960348614271392
Energy: 1.4419141449245538
Energy: 1.7541562835130202
Energy: 1.4419141449245538
Energy: 1.7553100389905247
Energy: 1.5961655389377396
Energy: 1.402957624408484
Energy: 1.5961655389329543
Energy: 1.7553100389784244
Energy: 1.5961655389281142
Energy: 1.3019240974613706
Energy: 1.3024602697883068
Energy: 1.2851143668335108
Energy: 1.3024596334615814
Energy: 1.3019240974601605
Energy: 1.3024610235334573
Energy: 1.276389848908005
Energy: 1.5731536437506384
Energy: 1.4025829619799066
Energy: 1.5731536437482183
Energy: 1.276389848908005
Energy: 1.5731536437470084
Energy: 1.5474190657197997
Energy: 1.7984002208522893
Energy: 1.402866779876982
Energy: 1.7984002208534995
Energy: 1.5474190658032363
Energy: 1.7984002208534995
Energy: 1.4060351399423892
Energy: 1.7179518577355297
Energy: 1.5997296319283354
Energy: 1.7179518577379498
Energy: 1.4060351399423892
Energy: 1.7179518577379498
Energy: 1.602099859575038
Energy: 1.4763241780104472
Energy: 1.2846877040196005
Energy: 1.4763241780080272
Energy: 1.6020998595581526
Energy: 1.4763241780080272
Energy: 1.291131406162628
Energy: 1.4041943707971574
Energy: 1.7805692080853217
Energy: 1.4041943707971574
Energy: 1.291131406162628
Energy: 1.4041943707971574
Energy: 1.6367920617535148
Energy: 1.7429921317449624
Energy: 1.323398467841183
Energy: 1.7429921317437522
Energy: 1.6367920616361973
Energy: 1.7429921317437522

minimum gb energy = 1.276389848908005 eV
minimum distance =  2.19691647851343 Angstroms
sigma value = 33


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

Energy: 1.5365122443656687
Energy: 1.7886944927096553
Energy: 1.7599316441614126
Energy: 1.7886944927127257
Energy: 1.5365122443672037
Energy: 1.788694492708888
Energy: 1.7069345566713736
Energy: 1.5064988246361584
Energy: 1.2354066080360782
Energy: 1.5064988246323205
Energy: 1.7069345566276544
Energy: 1.5064988246361584
Energy: 1.2335497562774986
Energy: 1.3238208448906204
Energy: 1.6153922398094065
Energy: 1.323820844891388
Energy: 1.2335497562774986
Energy: 1.323820844889085
Energy: 1.3081353466201011
Energy: 1.3527112737388263
Energy: 1.2417838892275457
Energy: 1.3527113491506162
Energy: 1.3081353466208687
Energy: 1.3527118656536696
Energy: 1.459780701129014
Energy: 1.5441208292403894
Energy: 1.4443682948890775
Energy: 1.5441208292380864
Energy: 1.4597807011259436
Energy: 1.5441208292350161
Energy: 1.4593003243636713
Energy: 1.4708643146778042
Energy: 1.2377560868759443
Energy: 1.4506301027405728
Energy: 1.459300324364439
Energy: 1.4708643146778042
Energy: 1.229362293939135
Energy: 1.2598730377982703
Energy: 1.2478254371507684
Energy: 1.2598730377982703
Energy: 1.229362293939135
Energy: 1.2598730377982703
Energy: 1.2532214635756276
Energy: 1.2297573122354317
Energy: 1.4597960456869878
Energy: 1.2297573122354317
Energy: 1.2532214635756276
Energy: 1.2297573109034412
Energy: 1.4412676071524209
Energy: 1.4282767389469988
Energy: 1.455782763693937
Energy: 1.4282767389454638
Energy: 1.4412676071524209
Energy: 1.4282767389454638
Energy: 1.2366029901226692
Energy: 1.4247327403288088
Energy: 1.226418455309442
Energy: 1.2478585859578095
Energy: 1.2366029901234368
Energy: 1.4247327403280412
Energy: 1.224401476204338
Energy: 1.4411915926970926
Energy: 1.2532629734306022
Energy: 1.4411915926947898
Energy: 1.2244014762028026
Energy: 1.4411915926955576
Energy: 1.2275662541053958
Energy: 1.2934438989770527
Energy: 1.7223645529252072
Energy: 1.2934438989785881
Energy: 1.2275662541053958
Energy: 1.2934438989785881
Energy: 1.4686179193593145
Energy: 1.5599508874325
Energy: 1.527145840731698
Energy: 1.5599508874325
Energy: 1.4686179193616176
Energy: 1.5599508874332677
Energy: 1.2352941175573604
Energy: 1.2526429291768988
Energy: 1.2348630128979716
Energy: 1.2526429292659074
Energy: 1.2352941175573604
Energy: 1.2526429292405759
Energy: 1.4825728266921439
Energy: 1.3119594085588622
Energy: 1.2268765662529089
Energy: 1.3119594085580946
Energy: 1.4825728267136373
Energy: 1.3119594085588622
Energy: 1.2419050768474593
Energy: 1.4739011768830874
Energy: 1.6486987076229063
Energy: 1.4739011768830874
Energy: 1.2419050768474593
Energy: 1.4739011768838548
Energy: 1.7023747967945675
Energy: 1.7933112386378902
Energy: 1.506115606459377
Energy: 1.7933112386378902
Energy: 1.7023747967968703
Energy: 1.7933112386386576
Energy: 1.2256975204879004
Energy: 1.259229959349542
Energy: 1.6315236879732
Energy: 1.2592299593410983
Energy: 1.225697520488668
Energy: 1.259229959373338
Energy: 1.3459101660035007
Energy: 1.2603439482758594
Energy: 1.2293242478098025
Energy: 1.2603439482820005
Energy: 1.3459101660241917
Energy: 1.26034394827893
Energy: 1.4574944910478007
Energy: 1.545723442759856
Energy: 1.2493217749724435
Energy: 1.5457234427590887
Energy: 1.457494491063118
Energy: 1.545723442756018
Energy: 1.7052585489242307
Energy: 1.404752880796278
Energy: 1.2373364685455515
Energy: 1.4047528807993481
Energy: 1.705258548923463
Energy: 1.4047528808069896
Energy: 1.2338919870173755
Energy: 1.4455999307134446
Energy: 1.4457382121494635
Energy: 1.4455999307134446
Energy: 1.2338919870173755
Energy: 1.445599930712677
Energy: 1.2478035354430896
Energy: 1.443582064951057
Energy: 1.2287230608663622
Energy: 1.443582064951057
Energy: 1.2478035354438572
Energy: 1.4435820649518245
Energy: 1.5128381965491065
Energy: 1.5865311650410492
Energy: 1.224577681985987
Energy: 1.5865311650402818
Energy: 1.5128381965498738
Energy: 1.5778584436979073
Energy: 1.7218633483879013
Energy: 1.2964011558812565
Energy: 1.2244064916626833
Energy: 1.2964011558804889
Energy: 1.7218633483863663
Energy: 1.2964011558820239
Energy: 1.2604580532528171
Energy: 1.4506090104731606
Energy: 1.2332102829965457
Energy: 1.4506090104731606
Energy: 1.2604580532520495
Energy: 1.4506090104731606
Energy: 1.2267757896264093
Energy: 1.4518399825165194
Energy: 1.4413184266310468
Energy: 1.4518399825157517
Energy: 1.2267757896264093
Energy: 1.451839982517287
Energy: 1.4586518352054967
Energy: 1.417386268086957
Energy: 1.2367682969130025
Energy: 1.4173862680900273
Energy: 1.458651835204729
Energy: 1.417386268088492
Energy: 1.4586708629962095
Energy: 1.2294275774466905
Energy: 1.2483242089429367
Energy: 1.2294275770538448
Energy: 1.458670862967075
Energy: 1.2294275775632986
Energy: 1.251568429397952
Energy: 1.2570670671199287
Energy: 1.231056301387544
Energy: 1.2570670671206963
Energy: 1.2515684293987197
Energy: 1.257067067119161
Energy: 1.2293828587914626
Energy: 1.4241716163644336
Energy: 1.7055494103197129
Energy: 1.4241716163652012
Energy: 1.2293828587914626
Energy: 1.4241716163652012
Energy: 1.449173291945436
Energy: 1.7780178258290573
Energy: 1.480792314937079
Energy: 1.7780178258467128
Energy: 1.4491732918832938
Energy: 1.7780178258444097
Energy: 1.240194256940264
Energy: 1.482289015669082
Energy: 1.707719985165434
Energy: 1.4822890156706177
Energy: 1.2401942569410316
Energy: 1.482289015669082
Energy: 1.6493765604840964
Energy: 1.298616770451344
Energy: 1.2334693500055902
Energy: 1.2986167704528795
Energy: 1.6493765621713197
Energy: 1.2986167704544145
Energy: 1.2317123055797605
Energy: 1.4978948891566342
Energy: 1.5853737511256243
Energy: 1.4978948891604722
Energy: 1.231712305578993
Energy: 1.4978948891581694
Energy: 1.4683880573581725
Energy: 1.5575775586926763
Energy: 1.5420185914582931
Energy: 1.557577558708796
Energy: 1.4683880573581725
Energy: 1.5575775587026552
Energy: 1.228933794009585
Energy: 1.636780699016989
Energy: 1.722947490240754
Energy: 1.6367806990177567
Energy: 1.228933794009585
Energy: 1.636780699015454

minimum gb energy = 1.2244014762028026 eV
minimum distance =  2.18488087842491 Angstroms
sigma value = 41


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

Energy: 1.0832154618412035
Energy: 1.0584560007328243
Energy: 1.8357912694720642
Energy: 1.0584560007328243
Energy: 1.0832154618412035
Energy: 1.0584560007307284
Energy: 1.6327154683839677
Energy: 1.0551068137706372
Energy: 1.0536725065426145
Energy: 1.0551068137727329
Energy: 1.6327154683839677
Energy: 1.0551068137706372
Energy: 1.0838111851865084
Energy: 1.2443306219923977
Energy: 1.05564849489238
Energy: 1.244330621990302
Energy: 1.0838111851907002
Energy: 1.244330621990302
Energy: 1.6588905192255452
Energy: 1.0556092367186394
Energy: 1.0536314140753271
Energy: 1.0556092367165437
Energy: 1.6588905192255452
Energy: 1.0556092367165437
Energy: 1.080889407973823
Energy: 1.455848062929137
Energy: 1.055872658077534
Energy: 1.4558480629270414
Energy: 1.0808894079780145
Energy: 1.4558480629270414
Energy: 1.0789375621824142
Energy: 1.0978385393803956
Energy: 1.0533592519719859
Energy: 1.0978385393824914
Energy: 1.0789375197293405
Energy: 1.0978385393824914
Energy: 1.658879617008651
Energy: 1.0556125134239338
Energy: 1.0540025096461032
Energy: 1.0556125134197423
Energy: 1.658879617008651
Energy: 1.0556125134197423
Energy: 1.0839175181638858
Energy: 1.0603949247264821
Energy: 1.0545198317920015
Energy: 1.0603949247264821
Energy: 1.0839175181596943
Energy: 1.0603949247264821
Energy: 1.603639770533535
Energy: 1.101576856170075
Energy: 1.0533548512645707
Energy: 1.101576856170075
Energy: 1.603639770533535
Energy: 1.101576856170075
Energy: 1.0855939466235518
Energy: 1.4568359748185855
Energy: 1.0577216672237248
Energy: 1.4568359748206814
Energy: 1.0855939466256477
Energy: 1.4568359748185855
Energy: 1.6234677065650807
Energy: 1.059971363855075
Energy: 1.0613849567413292
Energy: 1.059971363855075
Energy: 1.6234677065650807
Energy: 1.059971363855075
Energy: 1.09584461546765
Energy: 1.2439367548139295
Energy: 1.672185590664522
Energy: 1.243936754818121
Energy: 1.09584461546765
Energy: 1.243936754818121
Energy: 1.6250260292521936
Energy: 1.0601195637327625
Energy: 1.06367448788601
Energy: 1.0601195637306668
Energy: 1.6250260292521936
Energy: 1.0601195637306668
Energy: 1.0855633912243015
Energy: 1.4532540624182932
Energy: 1.0577234697795903
Energy: 1.4532540623910475
Energy: 1.0855633912201097
Energy: 1.4532540623910475

minimum gb energy = 1.0533548512645707 eV
minimum distance =  2.20712326302993 Angstroms
sigma value = 11


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

Energy: 1.6054255869387193
Energy: 1.2846325458088024
Energy: 1.7252022526614579
Energy: 1.284632545807882
Energy: 1.6054255869387193
Energy: 1.2846325458088024
Energy: 1.5764473495420246
Energy: 1.5860349241104776
Energy: 1.2582957040293286
Energy: 1.5860349241104776
Energy: 1.5764473495420246
Energy: 1.586034924109557
Energy: 1.260104321875175
Energy: 1.390548879411151
Energy: 1.2618351286772371
Energy: 1.390548879411151
Energy: 1.260104321875175
Energy: 1.3905488794120713
Energy: 1.2853384992427497
Energy: 1.2945468550873758
Energy: 1.2625088188761584
Energy: 1.294546855090138
Energy: 1.2853384992427497
Energy: 1.2945468550882966
Energy: 1.4977446199671076
Energy: 1.4693525380479904
Energy: 1.2840014350330649
Energy: 1.4693525380470696
Energy: 1.4977446199680284
Energy: 1.4693525380488899
Energy: 1.294333632410104
Energy: 1.4811664664613506
Energy: 1.4806178517647963
Energy: 1.481166466496337
Energy: 1.294333632410104
Energy: 1.4811664664208612
Energy: 1.2774910449054522
Energy: 1.5443771857905475
Energy: 1.317282233336113
Energy: 1.544377185785944
Energy: 1.2774910448686456
Energy: 1.544377185789627
Energy: 1.260411499567286
Energy: 1.2969278288907513
Energy: 1.3705101741770254
Energy: 1.2969278288889097
Energy: 1.2604114995663656
Energy: 1.2969278288898305
Energy: 1.5547147040656635
Energy: 1.3539102374912744
Energy: 1.2581947962729514
Energy: 1.3539102374912744
Energy: 1.5547147040647429
Energy: 1.3539102374894332
Energy: 1.2586044440071231
Energy: 1.4792005005278985
Energy: 1.361265295380494
Energy: 1.4792005005278985
Energy: 1.2586044440071231
Energy: 1.4792005005288191
Energy: 1.4339555933902326
Energy: 1.6124630613460513
Energy: 1.5448609653314573
Energy: 1.612463061367227
Energy: 1.4339555933902326
Energy: 1.6124630613764341
Energy: 1.2611391621356622
Energy: 1.4976230478210129
Energy: 1.4788578986395877
Energy: 1.4976230478191714
Energy: 1.2611391621347414
Energy: 1.497623047820092
Energy: 1.2589122991123443
Energy: 1.3903037759307237
Energy: 1.5006352823450069
Energy: 1.3903037759298034
Energy: 1.2589122991132649
Energy: 1.3903037759298034
Energy: 1.2775730761362263
Energy: 1.3618993034727973
Energy: 1.2770282943599855
Energy: 1.361899303473718
Energy: 1.2775730761362263
Energy: 1.3618993034727973
Energy: 1.2592192385633707
Energy: 1.5380732849062875
Energy: 1.4810852743305507
Energy: 1.5380732849062875
Energy: 1.2592192385633707
Energy: 1.5380732849062875
Energy: 1.627562386396046
Energy: 1.5721740616607456
Energy: 1.2959085502000858
Energy: 1.5721740616607456
Energy: 1.627562386396046
Energy: 1.5721740616616662
Energy: 1.3168843056269508
Energy: 1.5899132604252093
Energy: 1.4494321444374134
Energy: 1.5899132604242883
Energy: 1.3168843056269508
Energy: 1.5899132604252093
Energy: 1.4810393701541045
Energy: 1.5377269060494543
Energy: 1.2615695475569082
Energy: 1.537726906050375
Energy: 1.4810393701541045
Energy: 1.537726906050375
Energy: 1.2799337782287425
Energy: 1.390211895186499
Energy: 1.274581624919071
Energy: 1.3902118951911024
Energy: 1.2799337782287425
Energy: 1.390211895189261
Energy: 1.2575255477639653
Energy: 1.391412796883325
Energy: 1.2573483630998525
Energy: 1.391412796883325
Energy: 1.2575255477639653
Energy: 1.391412796883325
Energy: 1.4785467540436283
Energy: 1.4109843094859627
Energy: 1.2581092714353852
Energy: 1.4109843094850418
Energy: 1.4785467540399453
Energy: 1.4109843094859627
Energy: 1.545496836258338
Energy: 1.6214451549678266
Energy: 1.490615687404909
Energy: 1.6214451549678266
Energy: 1.5454968362592585
Energy: 1.6214451549678266
Energy: 1.5117859951366324
Energy: 1.4797619918857667
Energy: 1.2829333544010948
Energy: 1.4797619918866876
Energy: 1.511785995137553
Energy: 1.4797619918857667
Energy: 1.2579173753150346
Energy: 1.3620868402584416
Energy: 1.5566439023719336
Energy: 1.3620868402602828
Energy: 1.2579173753131931
Energy: 1.3620868402602828
Energy: 1.3384282514541583
Energy: 1.2946858836290915
Energy: 1.2592569371043805
Energy: 1.294685883630933
Energy: 1.3384282514541583
Energy: 1.294685883630933
Energy: 1.2944704853102553
Energy: 1.4546928706997222
Energy: 1.2775385981180896
Energy: 1.4546928706997222
Energy: 1.294470485311176
Energy: 1.454692870700643
Energy: 1.481563541880099
Energy: 1.4979320837241537
Energy: 1.4975444895978456
Energy: 1.4979320837213916
Energy: 1.4815635418810198
Energy: 1.4979320837204917
Energy: 1.2763695869296843
Energy: 1.4565469182819828
Energy: 1.2945187168986283
Energy: 1.4565469182819828
Energy: 1.2763695869287635
Energy: 1.4565469182819828
Energy: 1.26237461321028
Energy: 1.294072346854299
Energy: 1.2773723403107877
Energy: 1.2940723468533781
Energy: 1.2623746132112008
Energy: 1.294072346854299
Energy: 1.2640990802299716
Energy: 1.3910830657972952
Energy: 1.260381086116238
Energy: 1.3910830657963744
Energy: 1.264099080229051
Energy: 1.3910830657972952
Energy: 1.2583473397205103
Energy: 1.5900701402813437
Energy: 1.546181813978543
Energy: 1.5900701402813437
Energy: 1.2583473397214306
Energy: 1.5900701402822643

minimum gb energy = 1.2573483630998525 eV
minimum distance =  2.18881621671585 Angstroms
sigma value = 57


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

Energy: 1.3692082902402383
Energy: 1.372301294935373
Energy: 1.821570566769393
Energy: 1.3723012949337348
Energy: 1.3692082902418767
Energy: 1.372301294935373
Energy: 1.3266479066712369
Energy: 1.3478690064121002
Energy: 1.3174096251437875
Energy: 1.3478690064137386
Energy: 1.3266479066712369
Energy: 1.3717698568263041
Energy: 1.3400040817167855
Energy: 1.3772842303486936
Energy: 1.315737268147022
Energy: 1.3772842303470552
Energy: 1.3400040817167855
Energy: 1.3772842303486936
Energy: 1.3159052969132012
Energy: 1.4026255492705577
Energy: 1.3167117835758202
Energy: 1.4699754179082614
Energy: 1.3159052969132012
Energy: 1.402625550302255
Energy: 1.3158368378154868
Energy: 1.3775866992338415
Energy: 1.3674040914438208
Energy: 1.3775866992338415
Energy: 1.3158368378154868
Energy: 1.3775866992338415
Energy: 1.3178848944710906
Energy: 1.3486116601095361
Energy: 1.3267841911953349
Energy: 1.3486116601078981
Energy: 1.3178848944710906
Energy: 1.3486116601062597
Energy: 1.62792005290402
Energy: 1.3723012949370115
Energy: 1.3692082902418767
Energy: 1.372301294935373
Energy: 1.62792005290402
Energy: 1.372301294935373
Energy: 1.3174096251437875
Energy: 1.4662915488887034
Energy: 1.3266479066695984
Energy: 1.4662915488887034
Energy: 1.317409625142149
Energy: 1.3478690064137386
Energy: 1.315737268147022
Energy: 1.3772842303470552
Energy: 1.340004081715147
Energy: 1.3772842303486936
Energy: 1.315737268147022
Energy: 1.3772842303486936
Energy: 1.31671178357906
Energy: 1.6233190981510384
Energy: 1.3159052969116003
Energy: 1.4026255515763588
Energy: 1.3167117835774216
Energy: 1.4011367151261593
Energy: 1.3674040914454595
Energy: 1.3775866992338415
Energy: 1.3158368378154868
Energy: 1.3775866992322032
Energy: 1.3674040914454595
Energy: 1.3775866992338415
Energy: 1.3267841911953349
Energy: 1.3486116601095361
Energy: 1.3178848944710906
Energy: 1.3486116601095361
Energy: 1.3267841911969733
Energy: 1.3486116601095361
Energy: 1.3692082902418767
Energy: 1.372301294935373
Energy: 1.62792005290402
Energy: 1.3723012949337348
Energy: 1.3692082902418767
Energy: 1.372301294935373
Energy: 1.3266479066728754
Energy: 1.3717698568263041
Energy: 1.3174096251437875
Energy: 1.3717698568263041
Energy: 1.3266479066712369
Energy: 1.3717698568263041
Energy: 1.3400040817167855
Energy: 1.3772842303470552
Energy: 1.315737268147022
Energy: 1.3772842303486936
Energy: 1.3400040817184238
Energy: 1.3772842303486936
Energy: 1.3159052969148397
Energy: 1.4026255532287433
Energy: 1.3167117835741822
Energy: 1.4699754622101115
Energy: 1.3159052969116003
Energy: 1.4026255532009277
Energy: 1.3158368378154868
Energy: 1.3775866992338415
Energy: 1.3674040914454595
Energy: 1.3775866992338415
Energy: 1.315836837817125
Energy: 1.3775866992338415

minimum gb energy = 1.315737268147022 eV
minimum distance =  2.22036359058715 Angstroms
sigma value = 9


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

Energy: 1.4795769359726787
Energy: 1.4489776146480025
Energy: 1.477400544096296
Energy: 1.4489776146413442
Energy: 1.4795769359726787
Energy: 1.4489776146413442
Energy: 1.3789724514118542
Energy: 1.450878018133889
Energy: 1.350483137303386
Energy: 1.4508780181392398
Energy: 1.3789724514118542
Energy: 1.4508780181325511
Energy: 1.3546206383581272
Energy: 1.4249806272132735
Energy: 1.3521489909828786
Energy: 1.4249806272119359
Energy: 1.3546206383581272
Energy: 1.4249806272119359
Energy: 1.353740958310897
Energy: 1.3507914641799939
Energy: 1.3879797014822697
Energy: 1.3507914641773184
Energy: 1.353740958312235
Energy: 1.3507914641773184
Energy: 1.3809287667757653
Energy: 1.449740386194886
Energy: 1.3532085532787779
Energy: 1.4497403861935483
Energy: 1.3809287667757653
Energy: 1.4497403861935483
Energy: 1.3584065824032159
Energy: 1.3545922212323513
Energy: 1.5713887357849299
Energy: 1.3545922212310137
Energy: 1.3584065824045537
Energy: 1.3545922212310137
Energy: 1.3574171809579487
Energy: 1.4235075351092885
Energy: 1.3539269887237326
Energy: 1.4235075351052753
Energy: 1.3574171809579487
Energy: 1.423507535106613
Energy: 1.404611936414282
Energy: 1.4943366376553577
Energy: 1.3581826907026826
Energy: 1.4943366376553577
Energy: 1.4046119364129444
Energy: 1.4943366376580334
Energy: 1.400627553888709
Energy: 1.4215103437071597
Energy: 1.3673726414024168
Energy: 1.4215103437071597
Energy: 1.400627553888709
Energy: 1.4215103437084973
Energy: 1.3565762416532576
Energy: 1.4653071127208288
Energy: 1.352317398683095
Energy: 1.4653071127235042
Energy: 1.35657624165192
Energy: 1.4653071127248418
Energy: 1.3570305094091255
Energy: 1.3666701767686666
Energy: 1.388230281518323
Energy: 1.3666701767700042
Energy: 1.3570305094091255
Energy: 1.3666701767713423
Energy: 1.3537939318727175
Energy: 1.4261691382057582
Energy: 1.4197254340354861
Energy: 1.4261691382097714
Energy: 1.3537939318713796
Energy: 1.4261691382084336
Energy: 1.356211129421542
Energy: 1.4281018985328717
Energy: 1.4090961821273935
Energy: 1.4281018985301963
Energy: 1.356211129421542
Energy: 1.4281018985301963
Energy: 1.3539630650465437
Energy: 1.3515505500715812
Energy: 1.364861018595744
Energy: 1.3515505500675684
Energy: 1.353963065047881
Energy: 1.351550550068906
Energy: 1.548644528083535
Energy: 1.4648376951881827
Energy: 1.3661959035887201
Energy: 1.4648376951868451
Energy: 1.548644528083535
Energy: 1.4648376951868451
Energy: 1.4045629430264144
Energy: 1.4218418392819745
Energy: 1.3972713768566123
Energy: 1.421841839280637
Energy: 1.404562943023739
Energy: 1.421841839279299
Energy: 1.4028487786869406
Energy: 1.4214283170434288
Energy: 1.3752341291151828
Energy: 1.4214283170434288
Energy: 1.402848778684265
Energy: 1.4214283170460738
Energy: 1.4610851606207127
Energy: 1.4664379961884262
Energy: 1.3534587451482878
Energy: 1.4664379961924392
Energy: 1.4610851606193749
Energy: 1.4664379961911016
Energy: 1.3566185349976525
Energy: 1.3530565385630093
Energy: 1.5824071803969029
Energy: 1.3530565385656848
Energy: 1.3566185349976525
Energy: 1.3530565385643472
Energy: 1.3541678642309904
Energy: 1.4497832248439269
Energy: 1.353219304133325
Energy: 1.4497832248452645
Energy: 1.3541678642283455
Energy: 1.4497832248452645
Energy: 1.3566072692878497
Energy: 1.350922366745125
Energy: 1.391069246255934
Energy: 1.3509223667464627
Energy: 1.3566072692878497
Energy: 1.350922366745125

minimum gb energy = 1.350483137303386 eV
minimum distance =  2.22218376394836 Angstroms
sigma value = 27


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

Energy: 1.4532655148078617
Energy: 1.512434858369831
Energy: 1.5786846376938743
Energy: 1.5124348583709584
Energy: 1.4532655148078617
Energy: 1.512434858369831
Energy: 1.3325726740537238
Energy: 1.4486004451859613
Energy: 1.3515198147410816
Energy: 1.448600445187089
Energy: 1.3325726740537238
Energy: 1.4486004451904717
Energy: 1.3539006577231998
Energy: 1.486260422149036
Energy: 1.3502265820989696
Energy: 1.4862604221501634
Energy: 1.3539006577243273
Energy: 1.4862604221501634
Energy: 1.3567681498368045
Energy: 1.3671779214737299
Energy: 1.4956919421524526
Energy: 1.3671779214726023
Energy: 1.3567681498368045
Energy: 1.3671779214726023
Energy: 1.33245152522288
Energy: 1.493233405956305
Energy: 1.3531067048895076
Energy: 1.493233405956305
Energy: 1.3324515252217524
Energy: 1.493233405956305
Energy: 1.3672974819995254
Energy: 1.37412222721616
Energy: 1.3650422798026813
Energy: 1.3741222272150324
Energy: 1.3672974819995254
Energy: 1.3741222272184153
Energy: 1.3580236600444897
Energy: 1.3854135671331513
Energy: 1.3533202649905582
Energy: 1.3854135671320236
Energy: 1.3580236600444897
Energy: 1.3854135671331513
Energy: 1.3411230442493542
Energy: 1.3857433306355955
Energy: 1.3527427913228416
Energy: 1.3857433306355955
Energy: 1.3411230442482265
Energy: 1.3857433306367233
Energy: 1.3989784495676727
Energy: 1.3654717408804304
Energy: 1.43234600661263
Energy: 1.3654717408815322
Energy: 1.398978449566545
Energy: 1.3654717408815322
Energy: 1.34161612216137
Energy: 1.4601103336395813
Energy: 1.41319934609936
Energy: 1.4601103336395813
Energy: 1.34161612216137
Energy: 1.4601103336361987
Energy: 1.341713771854426
Energy: 1.4596383017970258
Energy: 1.405670057169165
Energy: 1.4596383018004087
Energy: 1.3417137718555536
Energy: 1.4596383017992811
Energy: 1.3995681330092689
Energy: 1.3649016911973089
Energy: 1.432202009498284
Energy: 1.3649016912006917
Energy: 1.399568133008141
Energy: 1.3649016911973089
Energy: 1.34104353797721
Energy: 1.3855435049068354
Energy: 1.3521855664550315
Energy: 1.385543504907963
Energy: 1.3410435379760826
Energy: 1.3855435049068354
Energy: 1.3581212309546484
Energy: 1.3851628558835007
Energy: 1.3534912890124802
Energy: 1.3851628558823732
Energy: 1.3581212309546484
Energy: 1.3851628558823732
Energy: 1.3672875572235172
Energy: 1.3750902660500877
Energy: 1.365005966537993
Energy: 1.3750902660500877
Energy: 1.3672875572235172
Energy: 1.3750902660512152
Energy: 1.332655212987966
Energy: 1.4932334059540753
Energy: 1.3531275450660205
Energy: 1.4932334059552028
Energy: 1.332655212987966
Energy: 1.4932334059552028
Energy: 1.3568375770166436
Energy: 1.3668317599202238
Energy: 1.3465891769200315
Energy: 1.3668317599213515
Energy: 1.3568375770166436
Energy: 1.3668317599213515
Energy: 1.3531300205694605
Energy: 1.486137166476171
Energy: 1.3499460566745085
Energy: 1.4861371664772987
Energy: 1.3531300205694605
Energy: 1.486137166476171
Energy: 1.3323248775691026
Energy: 1.4492330340466983
Energy: 1.3504130153536609
Energy: 1.4492330338359374
Energy: 1.332324877567975
Energy: 1.449233033914819
Energy: 1.4532655148078617
Energy: 1.5124348583709584
Energy: 1.528555589096152
Energy: 1.512434858369831
Energy: 1.4532655148089895
Energy: 1.5124348583709584
Energy: 1.3325726740537238
Energy: 1.448600445187089
Energy: 1.3515198147410816
Energy: 1.4486004451848338
Energy: 1.3325726740548516
Energy: 1.448600445187089
Energy: 1.3539006577243273
Energy: 1.4862604221501634
Energy: 1.3502265820978419
Energy: 1.486260422149036
Energy: 1.3539006577243273
Energy: 1.486260422149036
Energy: 1.3567681498368045
Energy: 1.3671779214726023
Energy: 1.590862395739591
Energy: 1.3671779214714748
Energy: 1.3567681498368045
Energy: 1.3671779214714748
Energy: 1.33245152522288
Energy: 1.493233405956305
Energy: 1.3531067048895076
Energy: 1.493233405956305
Energy: 1.3324515252206246
Energy: 1.493233405956305
Energy: 1.3672974819995254
Energy: 1.3741222272184153
Energy: 1.3650422798026813
Energy: 1.3741222272139049
Energy: 1.3672974820006527
Energy: 1.3741222272172877

minimum gb energy = 1.332324877567975 eV
minimum distance =  2.22791682963735 Angstroms
sigma value = 19


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

Energy: 1.4785795713155099
Energy: 1.2875662845041935
Energy: 1.5413422229727978
Energy: 1.287566284511007
Energy: 1.4785795713155099
Energy: 1.2875662845071134
Energy: 1.2878911746299866
Energy: 1.415758253655748
Energy: 1.2719775588076108
Energy: 1.415758253652828
Energy: 1.2878911746299866
Energy: 1.4157582536547744
Energy: 1.2864749530271442
Energy: 1.366332983836548
Energy: 1.2707801993264924
Energy: 1.3663329838394682
Energy: 1.2864749530271442
Energy: 1.3663329838394682
Energy: 1.3278615590239686
Energy: 1.3961367389963073
Energy: 1.3067579194870247
Energy: 1.3961367390002004
Energy: 1.3278615590249419
Energy: 1.3961367390011516
Energy: 1.295539262703127
Energy: 1.3228086491634532
Energy: 1.3111952444369346
Energy: 1.322808649166373
Energy: 1.295539262703127
Energy: 1.3228086491653999
Energy: 1.2889387971776214
Energy: 1.3961105606685102
Energy: 1.3100215768068755
Energy: 1.3961105606694837
Energy: 1.2889387971776214
Energy: 1.3961105606694837
Energy: 1.3008978867738705
Energy: 1.3859570243798953
Energy: 1.310579116083626
Energy: 1.385957024378922
Energy: 1.3008978867738705
Energy: 1.3859570243798953
Energy: 1.295879302832918
Energy: 1.322299790259537
Energy: 1.3102306901181922
Energy: 1.3222997902566174
Energy: 1.2958793028338913
Energy: 1.322299790259537
Energy: 1.301132636030718
Energy: 1.376202207505167
Energy: 1.346452848887134
Energy: 1.376202207508087
Energy: 1.301132636030718
Energy: 1.3762022075071134
Energy: 1.295163407148921
Energy: 1.4270822773145793
Energy: 1.2722662277547756
Energy: 1.4270822773252636
Energy: 1.2951634071479479
Energy: 1.4270822773155303
Energy: 1.2944697169418726
Energy: 1.3797513571433802
Energy: 1.2999506514450425
Energy: 1.3797513571414335
Energy: 1.2944697169428458
Energy: 1.3797513571424067
Energy: 1.3137234950512062
Energy: 1.4728217177114096
Energy: 1.2715117958153672
Energy: 1.4728217177094631
Energy: 1.313723495053153
Energy: 1.4728217177114096
Energy: 1.3132510558078867
Energy: 1.472028599257065
Energy: 1.270926661975956
Energy: 1.4720285992609579
Energy: 1.3132510558049666
Energy: 1.4720285992658246
Energy: 1.2883962261677044
Energy: 1.3806686519532907
Energy: 1.3772140301912184
Energy: 1.3806686519523172
Energy: 1.2883962261696513
Energy: 1.380668651951344
Energy: 1.3014628756242372
Energy: 1.3950947568999226
Energy: 1.2722814659561987
Energy: 1.3950947569018695
Energy: 1.3014628756242372
Energy: 1.3950947569018695
Energy: 1.2994943989066206
Energy: 1.375531570393124
Energy: 1.2725399817400016
Energy: 1.3755315703940973
Energy: 1.299494398905647
Energy: 1.375531570393124
Energy: 1.2869119251623677
Energy: 1.322709111788434
Energy: 1.2724430876606387
Energy: 1.3227091117864873
Energy: 1.2869119251623677
Energy: 1.3227091117874608
Energy: 1.2994674398874668
Energy: 1.4603592321565269
Energy: 1.2707780740815402
Energy: 1.4603592321575003
Energy: 1.29946743988844
Energy: 1.4603592321575003
Energy: 1.2870912666716525
Energy: 1.3219965211441391
Energy: 1.2724348452585872
Energy: 1.3219965211451123
Energy: 1.287091266672626
Energy: 1.3219965211451123
Energy: 1.2994290187373538
Energy: 1.3755648414145751
Energy: 1.2725436223304727
Energy: 1.3755648414145751
Energy: 1.2994290187373538
Energy: 1.3755648414155488
Energy: 1.3014460579623663
Energy: 1.397531097075655
Energy: 1.2722781727685404
Energy: 1.3975310970717618
Energy: 1.3014460579623663
Energy: 1.3975310970805217
Energy: 1.288476404694307
Energy: 1.380653516295864
Energy: 1.377310067439063
Energy: 1.3806535162997573
Energy: 1.2884764046952801
Energy: 1.380653516295864
Energy: 1.3131953386799644
Energy: 1.4714547710186232
Energy: 1.2709120344562035
Energy: 1.4714547710166763
Energy: 1.3131953386799644
Energy: 1.471454771021543
Energy: 1.3140037296503615
Energy: 1.472509382694413
Energy: 1.2712050848774967
Energy: 1.4725093826953861
Energy: 1.3140037296503615
Energy: 1.472509382694413
Energy: 1.2944392683613788
Energy: 1.379553509626328
Energy: 1.2706121463221722
Energy: 1.3795535096253546
Energy: 1.2944392683604056
Energy: 1.379553509626328
Energy: 1.2952140214094026
Energy: 1.395369500870012
Energy: 1.2726411362077208
Energy: 1.3953695008632205
Energy: 1.2952140214094026
Energy: 1.3953695008777984
Energy: 1.3023830921170743
Energy: 1.3762954648215155
Energy: 1.3616473809204226
Energy: 1.3762954648205423
Energy: 1.3023830921199941
Energy: 1.3762954648215155
Energy: 1.2958794515465066
Energy: 1.322223579870959
Energy: 1.3101921456047245
Energy: 1.3222235798699855
Energy: 1.29587945154748
Energy: 1.3222235798699855
Energy: 1.3023760893662513
Energy: 1.3859570243798953
Energy: 1.310622330312192
Energy: 1.3859570243769754
Energy: 1.3023760893681977
Energy: 1.3859570243760024

minimum gb energy = 1.2706121463221722 eV
minimum distance =  2.21549504119945 Angstroms
sigma value = 101


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

Energy: 1.4628650963423595
Energy: 1.3426693852838252
Energy: 1.4798003419797945
Energy: 1.3426693852829696
Energy: 1.4628650963423595
Energy: 1.3426693852812586
Energy: 1.2469076930829255
Energy: 1.3458678716369292
Energy: 1.2484439430119103
Energy: 1.34586787165832
Energy: 1.2469076930829255
Energy: 1.345867871632651
Energy: 1.2313282945925672
Energy: 1.3536057924298621
Energy: 1.2468376917270934
Energy: 1.353605792432429
Energy: 1.2313282945917114
Energy: 1.353605792432429
Energy: 1.2647980949139832
Energy: 1.3663554300724994
Energy: 1.2550010437301877
Energy: 1.3100098586848867
Energy: 1.2647980949122721
Energy: 1.3663554300707883
Energy: 1.2202279050138212
Energy: 1.2930171455356008
Energy: 1.2315508788690797
Energy: 1.293017145534745
Energy: 1.2202279050146771
Energy: 1.2930171455356008
Energy: 1.234139956977098
Energy: 1.3585692965474532
Energy: 1.2193924684673525
Energy: 1.3585692965465979
Energy: 1.234139956977098
Energy: 1.3585692965457423
Energy: 1.2404491836056684
Energy: 1.3669863686235144
Energy: 1.2200909577775154
Energy: 1.366986368638021
Energy: 1.2404491836056684
Energy: 1.3669863686149584
Energy: 1.2309156890323187
Energy: 1.3678560826718933
Energy: 1.2310117371475755
Energy: 1.3487209214878237
Energy: 1.2309156890323187
Energy: 1.3678560826718933
Energy: 1.219904475534271
Energy: 1.3331890973118528
Energy: 1.2315941408108086
Energy: 1.3331890973118528
Energy: 1.219904475534271
Energy: 1.3331890973127085
Energy: 1.2194764471737418
Energy: 1.3211632439850451
Energy: 1.2201789982945992
Energy: 1.3211632439816228
Energy: 1.2194764471737418
Energy: 1.321163243973922
Energy: 1.279233878734803
Energy: 1.3105946991862363
Energy: 1.2994632018474157
Energy: 1.310594699188803
Energy: 1.279233878736514
Energy: 1.3105946991905142
Energy: 1.248175010661563
Energy: 1.3525433345631208
Energy: 1.219372684156204
Energy: 1.352543334549431
Energy: 1.248175010661563
Energy: 1.3525433345810889
Energy: 1.2740305306861417
Energy: 1.3540376407517616
Energy: 1.2645914998832388
Energy: 1.354037640750906
Energy: 1.2740305306869975
Energy: 1.3540376407517616
Energy: 1.2711704352157047
Energy: 1.2495333128395243
Energy: 1.2463911181772558
Energy: 1.2835738313151965
Energy: 1.27117043521656
Energy: 1.2495333128455137
Energy: 1.2194352237643962
Energy: 1.5364684557852517
Energy: 1.2470150158060702
Energy: 1.5364684557843962
Energy: 1.219435223762685
Energy: 1.5364684557826847
Energy: 1.2915432625234784
Energy: 1.353818228058491
Energy: 1.2304173112624093
Energy: 1.3538182280602022
Energy: 1.2915432625226226
Energy: 1.353818228058491
Energy: 1.2204053838523616
Energy: 1.3620484538909097
Energy: 1.2644728118233084
Energy: 1.3620484538934765
Energy: 1.2204053838532172
Energy: 1.3620484538917652
Energy: 1.23109174664671
Energy: 1.29354500016867
Energy: 1.220079214095471
Energy: 1.2935450001720923
Energy: 1.2310917466458542
Energy: 1.2935450001703812
Energy: 1.2295190649244454
Energy: 1.319927479067179
Energy: 1.2331744901835486
Energy: 1.3199274790688904
Energy: 1.2295190649244454
Energy: 1.3199274790714572
Energy: 1.2201475268172974
Energy: 1.4393736546817812
Energy: 1.2195568097596352
Energy: 1.4393736546826368
Energy: 1.2201475268181528
Energy: 1.4393736546826368
Energy: 1.2420386069481317
Energy: 1.2927832363323546
Energy: 1.231802013258319
Energy: 1.2927832363323546
Energy: 1.2420386069481317
Energy: 1.2927832363323546
Energy: 1.2195892496955894
Energy: 1.3189921980059314
Energy: 1.2194363169338194
Energy: 1.3189921980042203
Energy: 1.2195892496947338
Energy: 1.3189921979982309
Energy: 1.243520622459534
Energy: 1.3203676955221637
Energy: 1.2199159974017488
Energy: 1.320367695521308
Energy: 1.243520622459534
Energy: 1.320367695523836
Energy: 1.2642400133450133
Energy: 1.3634532106532797
Energy: 1.2782993258539144
Energy: 1.3634532106541355
Energy: 1.264240013345869
Energy: 1.3899215011550674
Energy: 1.2201834373242484
Energy: 1.4652857181536405
Energy: 1.2195419101845524
Energy: 1.4652857181544958
Energy: 1.2201834373242484
Energy: 1.4652857181536405
Energy: 1.2455257529197026
Energy: 1.3534760401163486
Energy: 1.2908818880039545
Energy: 1.3534760401154926
Energy: 1.2455257529197026
Energy: 1.353476040114637
Energy: 1.246564958241729
Energy: 1.4127240303312545
Energy: 1.219653738084888
Energy: 1.4127240303816972
Energy: 1.2465649582400178
Energy: 1.4127240303816972
Energy: 1.2476421830754687
Energy: 1.5467864560909268
Energy: 1.220047614721583
Energy: 1.5467864560909268
Energy: 1.2476421830771802
Energy: 1.5467864560917823
Energy: 1.3343280983102264
Energy: 1.4242337468890804
Energy: 1.3536715234799528
Energy: 1.4242337468890804
Energy: 1.3343280983102264
Energy: 1.424233746888225
Energy: 1.219543449085166
Energy: 1.3918276561372116
Energy: 1.2200547114553457
Energy: 1.3918276561346448
Energy: 1.219543449085166
Energy: 1.3918276561038423
Energy: 1.264074273837856
Energy: 1.3633785128514804
Energy: 1.2322772339057866
Energy: 1.3633785128531917
Energy: 1.2640742738387118
Energy: 1.3633785128531917
Energy: 1.2454588111127085
Energy: 1.3199169324095665
Energy: 1.219363942332888
Energy: 1.319916932407
Energy: 1.2454588111135638
Energy: 1.319916932408711
Energy: 1.2200710343764711
Energy: 1.4190600562937004
Energy: 1.2434751957112822
Energy: 1.4190600562928448
Energy: 1.2200710343764711
Energy: 1.4190600562928448

minimum gb energy = 1.219363942332888 eV
minimum distance =  2.23208061564801 Angstroms
sigma value = 33


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

Energy: 0.014073979380611891
Energy: 0.015235147680996642
Energy: 1.3783883501731797
Energy: 0.015235147680325233
Energy: 0.014073979380611891
Energy: 0.015235147679614328
Energy: 0.01417582554259406
Energy: 0.6657132815972261
Energy: 0.014175825541211743
Energy: 0.6657132815972261
Energy: 0.01417582554259406
Energy: 0.6657132815972261
Energy: 1.3931583338817
Energy: 0.015235147681707547
Energy: 0.014073979380611891
Energy: 0.015235147680996642
Energy: 1.3931583338865579
Energy: 0.015235147680996642
Energy: 0.014175825543304965
Energy: 0.6657132815972261
Energy: 0.01417582554259406
Energy: 0.6657132815972261
Energy: 0.014175825543304965
Energy: 0.6657132815979172

minimum gb energy = 0.014073979380611891 eV
minimum distance =  2.41051426642631 Angstroms
sigma value = 1