Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Al__MO_060567868558_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050199627876282
cohesive_energy=3.5802838199389533
mass=26.981538
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: 0.01109978955379978
Energy: 0.16938688796853252
Energy: 0.01109978955379978
Energy: 0.1693868879682827
Energy: 0.01109978955379978
Energy: 0.16938688796853252
Energy: 0.1693868879682827
Energy: 0.34212071219116075
Energy: 0.16938688796853252
Energy: 0.5000441200174093
Energy: 0.16938688796853252
Energy: 0.3421207121909109
Energy: 0.01109978955379978
Energy: 0.16938688796853252
Energy: 0.01109978955379978
Energy: 0.16938688796853252
Energy: 0.01109978955379978
Energy: 0.1693868879682827
Energy: 0.1693868879682827
Energy: 0.5000441200166874
Energy: 0.16938688796853252
Energy: 0.5000441200181587
Energy: 0.16938688796878237
Energy: 0.34212071219018925
Energy: 0.01109978955379978
Energy: 0.16938688796853252
Energy: 0.01109978955379978
Energy: 0.16938688796853252
Energy: 0.01109978955379978
Energy: 0.1693868879682827
Energy: 0.16938688796853252
Energy: 0.3421207121909109
Energy: 0.1693868879682827
Energy: 0.3421207121906611
Energy: 0.16938688796878237
Energy: 0.34212071219041124

minimum gb energy = 0.01109978955379978 eV
minimum distance =  2.50482674613563 Angstroms
sigma value = 1


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

Energy: 0.33298842642228177
Energy: 0.3222074907762302
Energy: 0.33298842642228177
Energy: 0.3222074907768316
Energy: 0.33298842642228177
Energy: 0.3222074907768316
Energy: 0.35304409263965786
Energy: 0.3178647900698304
Energy: 0.35304409263965786
Energy: 0.3178647900698304
Energy: 0.35304409263965786
Energy: 0.3178647900698304
Energy: 0.32815889847243723
Energy: 0.3266066736099071
Energy: 0.3281588984718358
Energy: 0.3266066736099071
Energy: 0.3281588984718358
Energy: 0.3266066736099071
Energy: 0.34592603256214544
Energy: 0.3178240330092608
Energy: 0.34592603256334825
Energy: 0.31782403300986223
Energy: 0.3459260325615441
Energy: 0.3178240330092608
Energy: 0.3255208747963511
Energy: 0.33682107505667297
Energy: 0.32552087479695246
Energy: 0.33682107505667297
Energy: 0.32552087479695246
Energy: 0.33682107505667297
Energy: 0.3446753324986495
Energy: 0.3120608885481896
Energy: 0.3446753324986495
Energy: 0.3120608885481896
Energy: 0.3446753324986495
Energy: 0.3120608885481896
Energy: 0.32532311342515774
Energy: 0.3362383780208832
Energy: 0.32532311342515774
Energy: 0.3362383780208832
Energy: 0.3253231134239823
Energy: 0.3362383780208832
Energy: 0.31804424355883526
Energy: 0.35160911620374485
Energy: 0.31804424355943667
Energy: 0.35160911620314345
Energy: 0.31804424355883526
Energy: 0.35160911620314345
Energy: 0.3355677926860265
Energy: 0.33089225130802596
Energy: 0.33556779268722925
Energy: 0.33089225130802596
Energy: 0.3355677926860265
Energy: 0.3308922513086273
Energy: 0.30766695001902855
Energy: 0.35100304146056815
Energy: 0.30766695001722444
Energy: 0.35100304146056815
Energy: 0.3076669500184272
Energy: 0.35100304146056815
Energy: 0.3343127369032729
Energy: 0.30836967735451826
Energy: 0.33431273690267155
Energy: 0.30836967735451826
Energy: 0.33431273690207014
Energy: 0.30836967735451826
Energy: 0.30762707277520673
Energy: 0.35527145511552355
Energy: 0.30762707277520673
Energy: 0.35527145511492214
Energy: 0.3076270727746054
Energy: 0.35527145511492214
Energy: 0.34611968203339044
Energy: 0.3126776928777744
Energy: 0.34611968203339044
Energy: 0.3126776928777744
Energy: 0.34611968203399185
Energy: 0.31267769287717306
Energy: 0.3120016644320404
Energy: 0.31593793017569033
Energy: 0.3120016644320404
Energy: 0.3159379301768931
Energy: 0.3120016644326418
Energy: 0.31593793017569033
Energy: 0.35601214066232123
Energy: 0.3095818112016711
Energy: 0.35601214066352393
Energy: 0.3095818112016711
Energy: 0.3560121406629226
Energy: 0.3095818112016711
Energy: 0.35123048585045263
Energy: 0.33403558138001455
Energy: 0.3512304858492499
Energy: 0.33403558138001455
Energy: 0.351230485851054
Energy: 0.33403558138001455
Energy: 0.33104527774845555
Energy: 0.32847682964340574
Energy: 0.33104527774845555
Energy: 0.32847682964340574
Energy: 0.3310452777490569
Energy: 0.32847682964340574
Energy: 0.3315819089711523
Energy: 0.32547631132220234
Energy: 0.3315819089705509
Energy: 0.32547631132220234
Energy: 0.3315819089705509
Energy: 0.325476311321601
Energy: 0.3120617038057293
Energy: 0.32330039807074534
Energy: 0.3120617038063307
Energy: 0.32330039807074534
Energy: 0.3277058542402433
Energy: 0.32330039807014405
Energy: 0.3306748874756876
Energy: 0.3120355063766396
Energy: 0.33067488747508617
Energy: 0.3120355063760383
Energy: 0.33067488747508617
Energy: 0.3120355063760383
Energy: 0.313788356312826
Energy: 0.3516161692532217
Energy: 0.313788356312826
Energy: 0.3516161692550259
Energy: 0.31378835631342733
Energy: 0.35161616925442457
Energy: 0.3393388207759856
Energy: 0.32613745642407566
Energy: 0.3393388207759856
Energy: 0.32613745642407566
Energy: 0.3393388207759856
Energy: 0.32613745642347425
Energy: 0.31570249508686843
Energy: 0.35156253845976
Energy: 0.31570249508746984
Energy: 0.35156253845915864
Energy: 0.31570249508566567
Energy: 0.35156253845915864

minimum gb energy = 0.3076270727746054 eV
minimum distance =  2.6054510177978 Angstroms
sigma value = 33


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

Energy: 0.3381982025261665
Energy: 0.33503780399559036
Energy: 0.3209988420283538
Energy: 0.33503780398635463
Energy: 0.3381982025261665
Energy: 0.33503780398669675
Energy: 0.34414434113760295
Energy: 0.31316555480972963
Energy: 0.3441443411382871
Energy: 0.31316555481554464
Energy: 0.344144341137945
Energy: 0.31316555481588676
Energy: 0.31343522464841383
Energy: 0.31274326321381685
Energy: 0.31343522465251855
Energy: 0.3127432632097121
Energy: 0.31343522465422885
Energy: 0.31274326320902796
Energy: 0.3292255443274067
Energy: 0.3386705385086598
Energy: 0.329225544328433
Energy: 0.3386705385072915
Energy: 0.3292255443294591
Energy: 0.3386705385069495
Energy: 0.3266290187244852
Energy: 0.333276023083192
Energy: 0.3266290187217486
Energy: 0.33327602308284987
Energy: 0.3266290187220907
Energy: 0.333276023083192
Energy: 0.3171836236498819
Energy: 0.30426989089661083
Energy: 0.3171836236464613
Energy: 0.30426989089797907
Energy: 0.31718362364304065
Energy: 0.30426989089797907
Energy: 0.3371659002280925
Energy: 0.32375768304822455
Energy: 0.33716590022843457
Energy: 0.3237576830441197
Energy: 0.337165900230829
Energy: 0.32375768304446184
Energy: 0.3005011246407354
Energy: 0.346242273354303
Energy: 0.30050112464005124
Energy: 0.3462422733549872
Energy: 0.3005011246424457
Energy: 0.3462422733549872
Energy: 0.3066666028735821
Energy: 0.30904815185776763
Energy: 0.3066666028770027
Energy: 0.3090481518584517
Energy: 0.3066666028770027
Energy: 0.30904815185879375
Energy: 0.3183033631348345
Energy: 0.3599984947299632
Energy: 0.3183021721144089
Energy: 0.3599984947262005
Energy: 0.31830336313141383
Energy: 0.3599984947258584
Energy: 0.3499212408961594
Energy: 0.31885158587454826
Energy: 0.3499212408910595
Energy: 0.318851585878311
Energy: 0.349921240888323
Energy: 0.31885158587865303
Energy: 0.3092509078743025
Energy: 0.32155501796219654
Energy: 0.3092507027887853
Energy: 0.321555017970064
Energy: 0.3092509078787493
Energy: 0.32155501797074815
Energy: 0.3232672454812826
Energy: 0.31090674425399917
Energy: 0.32326724547888813
Energy: 0.3109067442560515
Energy: 0.3232672454771778
Energy: 0.31090674425673565
Energy: 0.3231318799702352
Energy: 0.33673634246083994
Energy: 0.3231318799729717
Energy: 0.33673634245912965
Energy: 0.3231318799757082
Energy: 0.33673634245912965
Energy: 0.3326840596338248
Energy: 0.3115582640997638
Energy: 0.3326840596334828
Energy: 0.31155826410181625
Energy: 0.3326840596362193
Energy: 0.31155826410181625
Energy: 0.3071985592264509
Energy: 0.31747090479727064
Energy: 0.30719855922679296
Energy: 0.3174709047941921
Energy: 0.30719855922679296
Energy: 0.3174709047941921
Energy: 0.343350486991802
Energy: 0.3225763491155598
Energy: 0.34335048699351234
Energy: 0.3225763491135074
Energy: 0.3433504869931703
Energy: 0.3225763491138495
Energy: 0.33218801122153596
Energy: 0.3090658550557843
Energy: 0.3321880112249566
Energy: 0.30906585505544226
Energy: 0.33218801122119396
Energy: 0.3090658550551002
Energy: 0.3149214838729593
Energy: 0.32395135753410753
Energy: 0.31492148386817037
Energy: 0.3239513575320551
Energy: 0.31492148386509183
Energy: 0.3239513575296607
Energy: 0.3352580098327784
Energy: 0.32209522256144246
Energy: 0.3352580098290157
Energy: 0.32209522255802187
Energy: 0.33525800982491094
Energy: 0.32209522255836387
Energy: 0.2955308021382882
Energy: 0.32844999713607487
Energy: 0.2955308021348987
Energy: 0.3284499971295757
Energy: 0.29553080213592486
Energy: 0.32844999713368045
Energy: 0.31189776990558654
Energy: 0.31146871672204895
Energy: 0.3118977699021659
Energy: 0.31146871672204895
Energy: 0.3118977699049024
Energy: 0.31146871672204895
Energy: 0.31773042453137035
Energy: 0.35501833408534883
Energy: 0.3177319696873905
Energy: 0.35501833408055994
Energy: 0.3177304245276076
Energy: 0.35501833408398054
Energy: 0.33630031293577795
Energy: 0.3239864753346759
Energy: 0.3363003129354359
Energy: 0.32398647532954494
Energy: 0.3363003129326993
Energy: 0.323986475329887
Energy: 0.3133711441892738
Energy: 0.3149761556434365
Energy: 0.3069660139223425
Energy: 0.3149761556389897
Energy: 0.31337114419440476
Energy: 0.3149761556386476
Energy: 0.3424568259184984
Energy: 0.33667670309109815
Energy: 0.32832824722165294
Energy: 0.33667670308767755
Energy: 0.3424568259256817
Energy: 0.33667670308938785
Energy: 0.3432338408936962
Energy: 0.3320181246999776
Energy: 0.328387173300896
Energy: 0.3320181247061348
Energy: 0.3432338408947224
Energy: 0.33201812470647685
Energy: 0.30701352509645685
Energy: 0.3136929568731703
Energy: 0.3070135250920101
Energy: 0.3136929568783013
Energy: 0.30701352509543073
Energy: 0.313692956876933
Energy: 0.35722746691778123
Energy: 0.30808363977754283
Energy: 0.3572274669170971
Energy: 0.3080836397713857
Energy: 0.3572274669150447
Energy: 0.3080836397717278
Energy: 0.31771888122660685
Energy: 0.3364096586314189
Energy: 0.31771888122797504
Energy: 0.3364096586303927
Energy: 0.31771888122797504
Energy: 0.3364096586314189
Energy: 0.33050775572022223
Energy: 0.28874361655399267
Energy: 0.33050775571748575
Energy: 0.28874361656083397
Energy: 0.3305077557085921
Energy: 0.28874361659706155
Energy: 0.3104989331266792
Energy: 0.323230936600241
Energy: 0.3104989331229165
Energy: 0.32323093660058305
Energy: 0.31049893312565296
Energy: 0.32323093659853064
Energy: 0.33534930596402507
Energy: 0.32213790845690016
Energy: 0.3353493059626568
Energy: 0.32213790845895257
Energy: 0.33534930596231477
Energy: 0.32213790845895257
Energy: 0.3146650335957793
Energy: 0.3289163743610295
Energy: 0.31466503359406894
Energy: 0.32891637435487237
Energy: 0.31466503359406894
Energy: 0.3289163743558985
Energy: 0.31246407368329365
Energy: 0.30793659831454423
Energy: 0.3124640736867142
Energy: 0.3079365983118388
Energy: 0.312464073691161
Energy: 0.3079365983118388
Energy: 0.32530958850447744
Energy: 0.3304445811319864
Energy: 0.3253095885089243
Energy: 0.3304445811278816
Energy: 0.32530958850789804
Energy: 0.33044458112993397
Energy: 0.3068666212329112
Energy: 0.33180452761245466
Energy: 0.30686683742235626
Energy: 0.3318045276179277
Energy: 0.30686662123633174
Energy: 0.3318045276179277
Energy: 0.3258976324075565
Energy: 0.3170922038045497
Energy: 0.3258976324089248
Energy: 0.3170922038048918
Energy: 0.32589763240618824
Energy: 0.3170922038048918
Energy: 0.3230659234236729
Energy: 0.33655339872415846
Energy: 0.3230659234284618
Energy: 0.3365533987145807
Energy: 0.32306592343051416
Energy: 0.3365533987145807
Energy: 0.34058908411177385
Energy: 0.29583912112755
Energy: 0.34058908411382627
Energy: 0.29583912112686583
Energy: 0.34058908411416833
Energy: 0.29583912112652383
Energy: 0.30743034025540017
Energy: 0.30508100436237195
Energy: 0.307430340254374
Energy: 0.305081004362714
Energy: 0.3074303402502692
Energy: 0.30508100436237195

minimum gb energy = 0.28874361655399267 eV
minimum distance =  2.70114738003247 Angstroms
sigma value = 51


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

Energy: 0.3180941372392762
Energy: 0.3234979775010826
Energy: 0.3180941372392762
Energy: 0.32349797750029
Energy: 0.3180941372392762
Energy: 0.32349797750029
Energy: 0.3480320315058639
Energy: 0.3163590408418091
Energy: 0.34803203150427886
Energy: 0.3163590408418091
Energy: 0.3480320315058639
Energy: 0.3163590408418091
Energy: 0.3136168249764191
Energy: 0.3177859936983538
Energy: 0.3136168249764191
Energy: 0.3177859936983538
Energy: 0.3136168249764191
Energy: 0.3177859936626888
Energy: 0.31408858378553856
Energy: 0.29783423953025534
Energy: 0.31408858378316085
Energy: 0.29783423953025534
Energy: 0.31408858378395343
Energy: 0.29783423953025534
Energy: 0.325334802322942
Energy: 0.3123771169672315
Energy: 0.3253348023237345
Energy: 0.31237711696881665
Energy: 0.3253348023237345
Energy: 0.3123771169672315
Energy: 0.3266678858085813
Energy: 0.3117229640309294
Energy: 0.3266678858093739
Energy: 0.3117229640277592
Energy: 0.3266678858085813
Energy: 0.3117229640309294
Energy: 0.3122506349667782
Energy: 0.31392220920115776
Energy: 0.3122506349675708
Energy: 0.31392220920115776
Energy: 0.3122506349675708
Energy: 0.31392220920115776
Energy: 0.3069309273956788
Energy: 0.31263350227130066
Energy: 0.3069309273964714
Energy: 0.31263350227050807
Energy: 0.3069309273956788
Energy: 0.31263350227050807
Energy: 0.3568406998780649
Energy: 0.2963445623632116
Energy: 0.35684069987885747
Energy: 0.2963445623632116
Energy: 0.3568406998780649
Energy: 0.2963445623632116
Energy: 0.2996690926376467
Energy: 0.362823715683638
Energy: 0.2996690926376467
Energy: 0.362823715683638
Energy: 0.2996690926376467
Energy: 0.362823715683638
Energy: 0.3316900216306452
Energy: 0.3033491553805639
Energy: 0.33169002162826755
Energy: 0.3033491553805639
Energy: 0.3316900216290601
Energy: 0.3033491553805639
Energy: 0.321326665283652
Energy: 0.3241521741234229
Energy: 0.3213266652828594
Energy: 0.3241521741234229
Energy: 0.3213266652828594
Energy: 0.32415217412421543
Energy: 0.3436843874951448
Energy: 0.31636431451788455
Energy: 0.3436843874935597
Energy: 0.31636431451788455
Energy: 0.3436843874951448
Energy: 0.31636431451788455
Energy: 0.3058656060069994
Energy: 0.30633895205522144
Energy: 0.305865606007792
Energy: 0.3063389520544289
Energy: 0.305865606007792
Energy: 0.3063389520528438
Energy: 0.32218958061504327
Energy: 0.3220529827032558
Energy: 0.32218958061504327
Energy: 0.3220529827032558
Energy: 0.32218958061504327
Energy: 0.3220529827040483
Energy: 0.32765811832045444
Energy: 0.31201333967125944
Energy: 0.32765811831966185
Energy: 0.31201333967205197
Energy: 0.32765811832045444
Energy: 0.3120133396728445
Energy: 0.32503239959847935
Energy: 0.3275054351512238
Energy: 0.32503239959847935
Energy: 0.3275054351504313
Energy: 0.32503239959847935
Energy: 0.3275054351520164
Energy: 0.31824927694811134
Energy: 0.3082247468899124
Energy: 0.31824927694811134
Energy: 0.30822474689070495
Energy: 0.31824927694811134
Energy: 0.30822474689070495

minimum gb energy = 0.2963445623632116 eV
minimum distance =  2.53060140792733 Angstroms
sigma value = 19


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

Energy: 0.25132209217658075
Energy: 0.27798753870601633
Energy: 0.2513220921761107
Energy: 0.27798753870601633
Energy: 0.2513220921761107
Energy: 0.27798753870601633
Energy: 0.29454900606071277
Energy: 0.29883855783525914
Energy: 0.29454900606259327
Energy: 0.29883855783525914
Energy: 0.2945490060640036
Energy: 0.29883855783478896
Energy: 0.25632487146672195
Energy: 0.2994119563081519
Energy: 0.25632487146719213
Energy: 0.29941195630862205
Energy: 0.2563248714676622
Energy: 0.29941195630862205
Energy: 0.27048337216626217
Energy: 0.2562984303587128
Energy: 0.27048337216767254
Energy: 0.2562984303587128
Energy: 0.2704833721653219
Energy: 0.256298430359183
Energy: 0.25204029941242523
Energy: 0.2518119188140004
Energy: 0.2520402994128953
Energy: 0.2518119188140004
Energy: 0.252040299411485
Energy: 0.2518119188140004
Energy: 0.25203535930797016
Energy: 0.25178333333381153
Energy: 0.2520353593065598
Energy: 0.25178333333240116
Energy: 0.25203535930797016
Energy: 0.25178333333381153
Energy: 0.2704720033600868
Energy: 0.25629276680069424
Energy: 0.27047200335820626
Energy: 0.2562927668021046
Energy: 0.27047200335914656
Energy: 0.2562927668016345
Energy: 0.2563734576091983
Energy: 0.29935647458238823
Energy: 0.25637345760872815
Energy: 0.29935647458144804
Energy: 0.25637345760872815
Energy: 0.2993564745819181
Energy: 0.29455302528090666
Energy: 0.29897476355562924
Energy: 0.29455302528184685
Energy: 0.29897476355609937
Energy: 0.2945530252799664
Energy: 0.29897476355609937
Energy: 0.25132209217658075
Energy: 0.2779875387055462
Energy: 0.2513220921761107
Energy: 0.2779875387055462
Energy: 0.2513220921761107
Energy: 0.27798753870601633
Energy: 0.294549006061653
Energy: 0.29883855783525914
Energy: 0.294549006061653
Energy: 0.29883855783478896
Energy: 0.2945490060635335
Energy: 0.29883855783478896
Energy: 0.25632487146672195
Energy: 0.29941195630862205
Energy: 0.25632487146672195
Energy: 0.2994119563081519
Energy: 0.25632487146719213
Energy: 0.2994119563072117
Energy: 0.27048337216626217
Energy: 0.2562984303587128
Energy: 0.2704833721657921
Energy: 0.256298430359183
Energy: 0.27048337216626217
Energy: 0.2562984303582427
Energy: 0.2520402994143057
Energy: 0.2518119188140004
Energy: 0.25204029941195505
Energy: 0.25181191881494064
Energy: 0.2520402994133655
Energy: 0.25181191881494064
Energy: 0.25203535930797016
Energy: 0.2517833333328713
Energy: 0.25203535930750004
Energy: 0.2517833333328713
Energy: 0.25203535930938054
Energy: 0.25178333333428166
Energy: 0.2704720033586764
Energy: 0.2562927668011644
Energy: 0.2704720033558557
Energy: 0.2562927668016345
Energy: 0.27047200335820626
Energy: 0.2562927668016345
Energy: 0.2563734576091983
Energy: 0.2993564745828584
Energy: 0.256373457608258
Energy: 0.2993564745828584
Energy: 0.25637345760872815
Energy: 0.2993564745819181
Energy: 0.29455302528090666
Energy: 0.29897476355609937
Energy: 0.2945530252804365
Energy: 0.29897476355609937
Energy: 0.2945530252813767
Energy: 0.29897476355609937
Energy: 0.2513220921761107
Energy: 0.27798753870601633
Energy: 0.25132209217658075
Energy: 0.2779875387055462
Energy: 0.25132209217658075
Energy: 0.27798753870601633
Energy: 0.29454900606259327
Energy: 0.29883855783525914
Energy: 0.29454900606212314
Energy: 0.29883855783525914
Energy: 0.29454900606541395
Energy: 0.29883855783478896
Energy: 0.25632487146719213
Energy: 0.2994119563081519
Energy: 0.25632487146672195
Energy: 0.29941195630862205
Energy: 0.25632487146719213
Energy: 0.29941195630674156
Energy: 0.2704833721653219
Energy: 0.256298430359183
Energy: 0.2704833721653219
Energy: 0.256298430359183
Energy: 0.2704833721667323
Energy: 0.2562984303582427
Energy: 0.25204029941383554
Energy: 0.2518119188135302
Energy: 0.2520402994133655
Energy: 0.2518119188140004
Energy: 0.25204029941383554
Energy: 0.2518119188130601
Energy: 0.2520353593103208
Energy: 0.25178333333240116
Energy: 0.25203535930750004
Energy: 0.25178333333334135
Energy: 0.25203535930797016
Energy: 0.2517833333328713
Energy: 0.2704720033586764
Energy: 0.25629276680069424
Energy: 0.27047200335820626
Energy: 0.2562927668016345
Energy: 0.27047200335914656
Energy: 0.2562927668011644
Energy: 0.2563734576091983
Energy: 0.29935647458144804
Energy: 0.25637345760872815
Energy: 0.2993564745819181
Energy: 0.25637345760872815
Energy: 0.2993564745819181
Energy: 0.29455302528090666
Energy: 0.29897476355609937
Energy: 0.2945530252813767
Energy: 0.29897476355609937
Energy: 0.2945530252804365
Energy: 0.29897476355609937
Energy: 0.2513220921761107
Energy: 0.2779875387055462
Energy: 0.2513220921761107
Energy: 0.2779875387055462
Energy: 0.25132209217564055
Energy: 0.27798753870601633
Energy: 0.29454900606306333
Energy: 0.29883855783525914
Energy: 0.29454900606259327
Energy: 0.29883855783525914
Energy: 0.2945490060644737
Energy: 0.29883855783478896
Energy: 0.25632487146672195
Energy: 0.2994119563076818
Energy: 0.25632487146719213
Energy: 0.2994119563081519
Energy: 0.25632487146719213
Energy: 0.2994119563081519

minimum gb energy = 0.25132209217564055 eV
minimum distance =  2.59766539710336 Angstroms
sigma value = 27


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

Energy: 0.2541809133984913
Energy: 0.25076464869668286
Energy: 0.2541809133984913
Energy: 0.25076464869668286
Energy: 0.2541809133984913
Energy: 0.25076464869668286
Energy: 0.29843666976421734
Energy: 0.23439963758955495
Energy: 0.2984366697653689
Energy: 0.2343996451519278
Energy: 0.2984366697630658
Energy: 0.2343996449585449
Energy: 0.2669423109342906
Energy: 0.28825179045559773
Energy: 0.26694231093544213
Energy: 0.2882517904579009
Energy: 0.2669423109342906
Energy: 0.28825179045559773
Energy: 0.3807818951058918
Energy: 0.243581111651239
Energy: 0.3807818951058918
Energy: 0.243581111651239
Energy: 0.3807818951058918
Energy: 0.243581111651239
Energy: 0.3015339877379717
Energy: 0.24142477034843632
Energy: 0.3015339877379717
Energy: 0.2414247703495879
Energy: 0.3015339877379717
Energy: 0.24142477034843632
Energy: 0.29080788577050126
Energy: 0.30393735663522514
Energy: 0.29080788577050126
Energy: 0.30393735663522514
Energy: 0.29080788577050126
Energy: 0.30393735663522514
Energy: 0.2790837109622942
Energy: 0.26380490100684817
Energy: 0.27908371096344575
Energy: 0.26380490100684817
Energy: 0.2790837109622942
Energy: 0.26380490100684817
Energy: 0.2574146223718156
Energy: 0.253122788550193
Energy: 0.2574146223718156
Energy: 0.253122788550193
Energy: 0.2574146223718156
Energy: 0.253122788550193
Energy: 0.27656259345957157
Energy: 0.26724503085808315
Energy: 0.27656259345842
Energy: 0.2672450308603862
Energy: 0.27656259345957157
Energy: 0.26724503085808315
Energy: 0.2789788949547572
Energy: 0.2961531196094519
Energy: 0.27897889495590883
Energy: 0.29615311960830026
Energy: 0.27897889495590883
Energy: 0.2961531196094519
Energy: 0.3101934622223489
Energy: 0.2407894080860352
Energy: 0.3101934622211973
Energy: 0.2407894080860352
Energy: 0.2508083128002315
Energy: 0.2407894080860352
Energy: 0.3013028432237356
Energy: 0.276554923497207
Energy: 0.3013028432237356
Energy: 0.2765549234983586
Energy: 0.301302843222584
Energy: 0.2765549234983586

minimum gb energy = 0.23439963758955495 eV
minimum distance =  2.53661386282355 Angstroms
sigma value = 9


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

Energy: 0.2509333658157365
Energy: 0.23640178124396458
Energy: 0.25093336581735426
Energy: 0.23640178124396458
Energy: 0.25093336581703074
Energy: 0.23640178124396458
Energy: 0.30051019619512354
Energy: 0.23784526165487654
Energy: 0.30051019619544705
Energy: 0.25453397078044426
Energy: 0.30051019619674135
Energy: 0.23784526165714145
Energy: 0.23097980331194248
Energy: 0.25067094081742025
Energy: 0.23097980331000115
Energy: 0.2506709408180673
Energy: 0.23097980331226606
Energy: 0.2506709408170967
Energy: 0.2380858211230423
Energy: 0.22622819130098
Energy: 0.23808582112336585
Energy: 0.22622819130098
Energy: 0.23808582112239515
Energy: 0.22622819130098
Energy: 0.2543721619383273
Energy: 0.23736398257086944
Energy: 0.2543721619383273
Energy: 0.23736398256989877
Energy: 0.25437216193962153
Energy: 0.23736398257086944
Energy: 0.2527569304092315
Energy: 0.2617250088337608
Energy: 0.25275693040955505
Energy: 0.26172500883149596
Energy: 0.2527569304098787
Energy: 0.2600432572944446
Energy: 0.23792901561600638
Energy: 0.26428392982107274
Energy: 0.23792901561632995
Energy: 0.26428392982107274
Energy: 0.23792901561632995
Energy: 0.26428392982107274
Energy: 0.21905181373188531
Energy: 0.2460614485638497
Energy: 0.21905181373188531
Energy: 0.24606144856611462
Energy: 0.21905181373253244
Energy: 0.24606144856579107
Energy: 0.22141404425819258
Energy: 0.2369942517156465
Energy: 0.22141404425851613
Energy: 0.23699425171597005
Energy: 0.22141404425754546
Energy: 0.23699425171597005
Energy: 0.2501695670801366
Energy: 0.2711913452720026
Energy: 0.2501695670794895
Energy: 0.27119134527006133
Energy: 0.2501695670804602
Energy: 0.271191345271032
Energy: 0.23870315900481218
Energy: 0.22360373445185563
Energy: 0.2387031590038415
Energy: 0.22360373445185563
Energy: 0.23870315900513572
Energy: 0.2236037344521792
Energy: 0.24031116204666692
Energy: 0.2544460126176688
Energy: 0.24031116204731406
Energy: 0.2544460126176688
Energy: 0.24031116204537273
Energy: 0.2544460126176688
Energy: 0.24654563235878912
Energy: 0.24652811727093993
Energy: 0.24654563235749488
Energy: 0.24652811727126347
Energy: 0.24654563236008334
Energy: 0.24652811727126347
Energy: 0.26134093326098407
Energy: 0.2470764923895526
Energy: 0.26134093326098407
Energy: 0.2470764923895526
Energy: 0.26134093326130764
Energy: 0.24707649238922905
Energy: 0.23023593265655592
Energy: 0.25217290032856043
Energy: 0.2302359326575266
Energy: 0.25217290032823686
Energy: 0.23023593265623238
Energy: 0.25217290032823686
Energy: 0.22927904912698557
Energy: 0.2621289120230591
Energy: 0.22927904913054473
Energy: 0.2621289120230591
Energy: 0.2292790491260149
Energy: 0.26212891202402977
Energy: 0.2823431118366248
Energy: 0.2229078231473468
Energy: 0.2823431118353305
Energy: 0.22290782432360254
Energy: 0.2823431118353305
Energy: 0.2229078257327327
Energy: 0.2373625559407943
Energy: 0.2377346338718808
Energy: 0.2373625559411179
Energy: 0.2377346338718808
Energy: 0.23736255594176497
Energy: 0.2377346338718808
Energy: 0.2214386731342172
Energy: 0.24310842003076166
Energy: 0.2214386731351879
Energy: 0.24310842003302657
Energy: 0.2214386731342172
Energy: 0.2431084200304381
Energy: 0.26585281021634544
Energy: 0.23254576175383718
Energy: 0.2658528102156983
Energy: 0.23254576175383718
Energy: 0.26585281021505114
Energy: 0.23254576175351363
Energy: 0.22145030675534094
Energy: 0.24296420886935846
Energy: 0.22145030675792943
Energy: 0.24296420887259407
Energy: 0.2214503067563116
Energy: 0.24296420887518255
Energy: 0.23735388676623845
Energy: 0.2377245018165777
Energy: 0.23735388676494423
Energy: 0.2377245018165777
Energy: 0.23735388676623845
Energy: 0.2377245018165777
Energy: 0.28222447614336155
Energy: 0.2228073917682746
Energy: 0.2822244761423909
Energy: 0.22280739108168182
Energy: 0.282224476143038
Energy: 0.22280738891639354
Energy: 0.22924571111927303
Energy: 0.2379303850904784
Energy: 0.22924571111830233
Energy: 0.2379303850888606
Energy: 0.22924571111894942
Energy: 0.23793038509080197
Energy: 0.23020940846769228
Energy: 0.2520200314777211
Energy: 0.23020940846963364
Energy: 0.25202003147804464
Energy: 0.23020940846801585
Energy: 0.25202003147804464
Energy: 0.2611953648896829
Energy: 0.2473182038107739
Energy: 0.26119536489194783
Energy: 0.2473182038117446
Energy: 0.26119536489097717
Energy: 0.24731820381142103
Energy: 0.24628385498111854
Energy: 0.24651503214485504
Energy: 0.24628385498047142
Energy: 0.2465150321445315
Energy: 0.24628385497917718
Energy: 0.24651503214420797
Energy: 0.24016442854818157
Energy: 0.22927384411889318
Energy: 0.2401644285494758
Energy: 0.22927384411792245
Energy: 0.24016442854818157
Energy: 0.22927384411824606
Energy: 0.2387392388928572
Energy: 0.22351726633671917
Energy: 0.2387392388928572
Energy: 0.22351726633671917
Energy: 0.2387392388931808
Energy: 0.22351726633639563
Energy: 0.25008353301532965
Energy: 0.23184559936038102
Energy: 0.25008353301371183
Energy: 0.23184559936135168
Energy: 0.2500835330156532
Energy: 0.23184559936005744
Energy: 0.2199631584147242
Energy: 0.23698608081302894
Energy: 0.21996315841569483
Energy: 0.2369860808123818
Energy: 0.21996315841666556
Energy: 0.2369860808123818
Energy: 0.21904990037129096
Energy: 0.24618540050145113
Energy: 0.2190499003693496
Energy: 0.2461854005024218
Energy: 0.2190499003703203
Energy: 0.24618540050112755
Energy: 0.23809831879933366
Energy: 0.26431468325492474
Energy: 0.23809831879739235
Energy: 0.2643146832552483
Energy: 0.23809831879933366
Energy: 0.2643146832552483
Energy: 0.25269496740521663
Energy: 0.23449208302223035
Energy: 0.25269496740521663
Energy: 0.23449208302320107
Energy: 0.2526949674045695
Energy: 0.23449208302223035
Energy: 0.2543971496861782
Energy: 0.23724849174645776
Energy: 0.2543971496871489
Energy: 0.23724849174451637
Energy: 0.25439714968650173
Energy: 0.23724849174581064
Energy: 0.2380721681324731
Energy: 0.22621832179481152
Energy: 0.23807216813053172
Energy: 0.22621832179448798
Energy: 0.23807216813214954
Energy: 0.22621832179481152
Energy: 0.23094223105180836
Energy: 0.2506730020821474
Energy: 0.23094223105245548
Energy: 0.2506730020831181
Energy: 0.23094223105342615
Energy: 0.2506730020840887
Energy: 0.30080202819921337
Energy: 0.24079717329532413
Energy: 0.3008020281966249
Energy: 0.24079717329402986
Energy: 0.30080202819144797
Energy: 0.24079717329532413
Energy: 0.2509333658154129
Energy: 0.2364017812420232
Energy: 0.2509333658176779
Energy: 0.2364017812420232
Energy: 0.2509333658157365
Energy: 0.2364017812423468
Energy: 0.30051019619674135
Energy: 0.2258542670747589
Energy: 0.30051019619415287
Energy: 0.22585426707572953
Energy: 0.30051019619577063
Energy: 0.22585426707508247
Energy: 0.23097980331129533
Energy: 0.2506709408167731
Energy: 0.23097980331161894
Energy: 0.2506709408170967
Energy: 0.23097980331226606
Energy: 0.2506709408167731
Energy: 0.23808582112174806
Energy: 0.2262281913016271
Energy: 0.2380858211214245
Energy: 0.2262281913016271
Energy: 0.2380858211207774
Energy: 0.2262281913016271
Energy: 0.2543721619373566
Energy: 0.23736398257086944
Energy: 0.2543721619373566
Energy: 0.2373639825705459
Energy: 0.2543721619373566
Energy: 0.23736398256957522

minimum gb energy = 0.2190499003693496 eV
minimum distance =  2.68056511781703 Angstroms
sigma value = 57


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

Energy: 0.09618002657070784
Energy: 0.10097198886602218
Energy: 0.09618002656997132
Energy: 0.10097198886528565
Energy: 0.09618002656997132
Energy: 0.10097198886602218
Energy: 0.13869003997044932
Energy: 0.09689707802675297
Energy: 0.13869003996897625
Energy: 0.09689707802675297
Energy: 0.13869003997044932
Energy: 0.09689707802675297
Energy: 0.11081159005816658
Energy: 0.1312879411691259
Energy: 0.11081159005816658
Energy: 0.1312879411691259
Energy: 0.11081159005816658
Energy: 0.1312879411691259
Energy: 0.10250572087095523
Energy: 0.0964156114498942
Energy: 0.10250572087095523
Energy: 0.0964156114498942
Energy: 0.10250572087095523
Energy: 0.0964156114498942
Energy: 0.1384737426169873
Energy: 0.13502004996139588
Energy: 0.13847374261625078
Energy: 0.13502004996139588
Energy: 0.1384737426169873
Energy: 0.13502004996139588
Energy: 0.09644033799774016
Energy: 0.1146842382263249
Energy: 0.09644033799626707
Energy: 0.1146842382263249
Energy: 0.0964403379970036
Energy: 0.1146842382263249
Energy: 0.0964412793653156
Energy: 0.11464276010483117
Energy: 0.0964412793653156
Energy: 0.11464276010483117
Energy: 0.0964412793653156
Energy: 0.1146427601040946
Energy: 0.13867174740037183
Energy: 0.1350309519089987
Energy: 0.13867174740037183
Energy: 0.13503095190826214
Energy: 0.13867174740110838
Energy: 0.1350309519089987
Energy: 0.10250561710280573
Energy: 0.09631805805958507
Energy: 0.10250561710206918
Energy: 0.09631805805884851
Energy: 0.10250561710280573
Energy: 0.09631805805884851
Energy: 0.11079615523558906
Energy: 0.13131095055492317
Energy: 0.11079615523558906
Energy: 0.13131095055492317
Energy: 0.11079615523558906
Energy: 0.13131095055492317
Energy: 0.13849076281767966
Energy: 0.09696065604656483
Energy: 0.1384907628162066
Energy: 0.09696065604730135
Energy: 0.13849076281767966
Energy: 0.09696065604730135
Energy: 0.09618002657070784
Energy: 0.10097198886602218
Energy: 0.09618002657070784
Energy: 0.10097198886602218
Energy: 0.09618002656997132
Energy: 0.10097198886602218
Energy: 0.1386900399697128
Energy: 0.09689707802675297
Energy: 0.1386900399697128
Energy: 0.09689707802675297
Energy: 0.1386900399697128
Energy: 0.09689707802675297
Energy: 0.11081159005816658
Energy: 0.1312879411691259
Energy: 0.11081159005890312
Energy: 0.1312879411691259
Energy: 0.11081159005816658
Energy: 0.1312879411691259
Energy: 0.10250572087169177
Energy: 0.0964156114498942
Energy: 0.10250572087169177
Energy: 0.09641561145063074
Energy: 0.10250572087169177
Energy: 0.0964156114498942
Energy: 0.13847374261625078
Energy: 0.1350200499621324
Energy: 0.1384737426169873
Energy: 0.13502004996139588
Energy: 0.13847374261625078
Energy: 0.1350200499621324
Energy: 0.0964403379970036
Energy: 0.1146842382263249
Energy: 0.0964403379970036
Energy: 0.1146842382263249
Energy: 0.0964403379970036
Energy: 0.1146842382263249
Energy: 0.09644127936457908
Energy: 0.11464276010483117
Energy: 0.0964412793653156
Energy: 0.11464276010483117
Energy: 0.0964412793653156
Energy: 0.11464276010483117
Energy: 0.1386717473996353
Energy: 0.13503095190973521
Energy: 0.1386717473996353
Energy: 0.13503095190973521
Energy: 0.13867174740037183
Energy: 0.13503095190973521

minimum gb energy = 0.09618002656997132 eV
minimum distance =  2.79431317419643 Angstroms
sigma value = 11


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

Energy: 0.20660395003574542
Energy: 0.2545087863632005
Energy: 0.20660395003574542
Energy: 0.25450878636374
Energy: 0.20660395003520587
Energy: 0.25450878636374
Energy: 0.26814058910302824
Energy: 0.22708309075310662
Energy: 0.26814058910356775
Energy: 0.22708309075364616
Energy: 0.2681405891024887
Energy: 0.22708309075310662
Energy: 0.22483348597231684
Energy: 0.2972808416674405
Energy: 0.2578270922746977
Energy: 0.2972808416674405
Energy: 0.24328294498150616
Energy: 0.2972808416674405
Energy: 0.27626636468216104
Energy: 0.20305281799958094
Energy: 0.27626636468216104
Energy: 0.2030528180001205
Energy: 0.27626636468054244
Energy: 0.20305281799958094
Energy: 0.24887518363977626
Energy: 0.18742131158500155
Energy: 0.24887518363977626
Energy: 0.1874213115855411
Energy: 0.2488751836392367
Energy: 0.1874213115855411
Energy: 0.23865975774870563
Energy: 0.20591265817212953
Energy: 0.23865975775086376
Energy: 0.20591265817374813
Energy: 0.23865975774978468
Energy: 0.20591265817374813
Energy: 0.19348494043447112
Energy: 0.22100969039561147
Energy: 0.19348494043393155
Energy: 0.22100969039561147
Energy: 0.19348494043393155
Energy: 0.22100969039291385
Energy: 0.26675304439459036
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Energy: 0.26538808840405637
Energy: 0.18012458213573332
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Energy: 0.26538808840459593
Energy: 0.18012458213573332
Energy: 0.18523376947716563
Energy: 0.27706138915896883
Energy: 0.18523376947770517
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Energy: 0.2770613891616665
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Energy: 0.24958710003770662
Energy: 0.1891857662689461
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Energy: 0.2902697944455009
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Energy: 0.29026979444604045
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Energy: 0.20157064741242012
Energy: 0.2724194637116722
Energy: 0.20157064741242012
Energy: 0.27241946371059317
Energy: 0.20157064741242012
Energy: 0.20693327920663795
Energy: 0.25501404030492825
Energy: 0.2069332792055589
Energy: 0.25501404030546787
Energy: 0.20693327920663795
Energy: 0.25501404030546787
Energy: 0.19725342845173047
Energy: 0.22705639581608633
Energy: 0.1972534284506514
Energy: 0.22705639581554676
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Energy: 0.22705639581500725
Energy: 0.32509363558385784
Energy: 0.23597268761991969
Energy: 0.3250936355843974
Energy: 0.23597268761722204
Energy: 0.32509363558385784
Energy: 0.2359726876183011
Energy: 0.24164380645416628
Energy: 0.20257791298057065
Energy: 0.2416438064552453
Energy: 0.20257791298003108
Energy: 0.2416438064547058
Energy: 0.20257791298057065
Energy: 0.24969939592920662
Energy: 0.2035001807543801
Energy: 0.2496993959302857
Energy: 0.2035001807543801
Energy: 0.2496993959302857
Energy: 0.2035001807543801
Energy: 0.18356086565162275
Energy: 0.20600599455092822
Energy: 0.18356086565162275
Energy: 0.2060059945520073
Energy: 0.18356086565054366
Energy: 0.2060059945520073
Energy: 0.20983350772535847
Energy: 0.2200230543507464
Energy: 0.20983350772535847
Energy: 0.2200230543507464
Energy: 0.20983350772427942
Energy: 0.22002305435236497
Energy: 0.22989454538692694
Energy: 0.23082171471901017
Energy: 0.2298945453858479
Energy: 0.23082171471901017
Energy: 0.22989454538746648
Energy: 0.23082171471901017
Energy: 0.23750285891225056
Energy: 0.21603029177563188
Energy: 0.23750285890955294
Energy: 0.21603029177563188
Energy: 0.23750285891171102
Energy: 0.21603029177563188
Energy: 0.18363242842711078
Energy: 0.22362314706585604
Energy: 0.18363242842711078
Energy: 0.22362314706531647
Energy: 0.18363242842818983
Energy: 0.2236231470674746
Energy: 0.34974928607855
Energy: 0.2747798198377367
Energy: 0.34974928607747097
Energy: 0.2747798198371972
Energy: 0.34974928607855
Energy: 0.2747798198371972

minimum gb energy = 0.1801245821351938 eV
minimum distance =  2.63048039225755 Angstroms
sigma value = 41


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

Energy: 0.2244645581399016
Energy: 0.19183561783192876
Energy: 0.2244645581399016
Energy: 0.19183561783192876
Energy: 0.2244645581399016
Energy: 0.19183561783192876
Energy: 0.22125715287726352
Energy: 0.22711503351848497
Energy: 0.22125715287556255
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Energy: 0.22125715287938968
Energy: 0.2271150335180597
Energy: 0.24096475853494936
Energy: 0.2660398012793228
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Energy: 0.2660398012793228
Energy: 0.24096475853537455
Energy: 0.2660398012788975
Energy: 0.22877273703831685
Energy: 0.19161907384173107
Energy: 0.22877273703746637
Energy: 0.19161907384173107
Energy: 0.22877273703746637
Energy: 0.1916190738421563
Energy: 0.18928312440517572
Energy: 0.20041154050705542
Energy: 0.18928312440517572
Energy: 0.20041154050663015
Energy: 0.18928312440560094
Energy: 0.20041154050663015
Energy: 0.2732328862646552
Energy: 0.22809223300487272
Energy: 0.27323288626508047
Energy: 0.22809223301975615
Energy: 0.2732328862655057
Energy: 0.22809223300359704
Energy: 0.207250007134841
Energy: 0.28864878092225427
Energy: 0.20725000713526628
Energy: 0.28864878092225427
Energy: 0.20725000713526628
Energy: 0.28864878092182905
Energy: 0.1966679398351782
Energy: 0.19172711774954856
Energy: 0.19666793983560343
Energy: 0.19172711774954856
Energy: 0.1966679398351782
Energy: 0.1917271177491233
Energy: 0.19553567710762174
Energy: 0.19976159169760174
Energy: 0.19553567710889747
Energy: 0.1997615916971765
Energy: 0.19553567710847222
Energy: 0.19976159169760174
Energy: 0.2242620488754109
Energy: 0.24565907148641536
Energy: 0.22426204887583615
Energy: 0.24565907148684055
Energy: 0.2242620488754109
Energy: 0.24565907148684055
Energy: 0.22451843171408925
Energy: 0.2449772671810551
Energy: 0.22451843171408925
Energy: 0.24497726718148036
Energy: 0.22451843171493974
Energy: 0.24497726718148036
Energy: 0.19436922093082704
Energy: 0.20914531002422995
Energy: 0.1943692209304018
Energy: 0.20914531002805709
Energy: 0.19436922093082704
Energy: 0.20914531002295425
Energy: 0.19707301211193456
Energy: 0.19159685868536266
Energy: 0.19707301211193456
Energy: 0.19159685868493745
Energy: 0.19707301211193456
Energy: 0.19159685868493745
Energy: 0.1908562064820649
Energy: 0.2306238822450821
Energy: 0.19085620648163962
Energy: 0.2306238822450821
Energy: 0.1908562064824901
Energy: 0.2306238822455073
Energy: 0.22423756033737668
Energy: 0.24162947813993782
Energy: 0.22423756033654554
Energy: 0.24162947814163876
Energy: 0.22423756033612027
Energy: 0.24162947813993782
Energy: 0.18885589876560302
Energy: 0.23129889104589327
Energy: 0.18885589876560302
Energy: 0.23129889104589327
Energy: 0.18885589876560302
Energy: 0.23129889104589327
Energy: 0.20183056358212073
Energy: 0.19166797831811994
Energy: 0.2018305635816955
Energy: 0.19166797831811994
Energy: 0.2018305635816955
Energy: 0.19166797831769472
Energy: 0.235833878869678
Energy: 0.2664935982811805
Energy: 0.23583387886925272
Energy: 0.2664935982811805
Energy: 0.23583387887095372
Energy: 0.26649359828160585
Energy: 0.23373734612641453
Energy: 0.22541649296822
Energy: 0.23373734612556404
Energy: 0.22541649296822
Energy: 0.23373734612556404
Energy: 0.22541649296822
Energy: 0.2251717757885003
Energy: 0.24811127939869146
Energy: 0.2251717757880751
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Energy: 0.2251717757880751
Energy: 0.24811127939869146
Energy: 0.19689954378279825
Energy: 0.2697114020060077
Energy: 0.19689954378279825
Energy: 0.26971140200558247
Energy: 0.19689954378279825
Energy: 0.26971140200558247
Energy: 0.22044611675064513
Energy: 0.2664712601191853
Energy: 0.2204461167514956
Energy: 0.2664712601187601
Energy: 0.2204461167502199
Energy: 0.2664712601187601
Energy: 0.2269697650396741
Energy: 0.19367544667418662
Energy: 0.22696976503882363
Energy: 0.19367544667376138
Energy: 0.22696976503924887
Energy: 0.19367544667418662
Energy: 0.18880537451637563
Energy: 0.25570747733856625
Energy: 0.18880537451722612
Energy: 0.2557074773381409
Energy: 0.18880537451637563
Energy: 0.25570747733856625
Energy: 0.18916659878640987
Energy: 0.27546188281850886
Energy: 0.1891665987902177
Energy: 0.27546188281850886
Energy: 0.18916659878768555
Energy: 0.27546188281850886
Energy: 0.20536117652233135
Energy: 0.2431918245228989
Energy: 0.2053611765219061
Energy: 0.24319182452417465
Energy: 0.20536117652148084
Energy: 0.24319182452374938
Energy: 0.19784895945532652
Energy: 0.19377578619280042
Energy: 0.1978489594557518
Energy: 0.1937757861923752
Energy: 0.1978489594557518
Energy: 0.1937757861923752
Energy: 0.19742633419335442
Energy: 0.2543919746265285
Energy: 0.19742633419335442
Energy: 0.25439197462610325
Energy: 0.1974263341929292
Energy: 0.25439197462610325
Energy: 0.22610138710119881
Energy: 0.22715774164395142
Energy: 0.22610138710162403
Energy: 0.22715774164395142
Energy: 0.22610138710077357
Energy: 0.22715774164225047
Energy: 0.2507395431431713
Energy: 0.23157051792912753
Energy: 0.2507395431410451
Energy: 0.23157051792870229
Energy: 0.2507395431418955
Energy: 0.23157051792827707
Energy: 0.19490322464443913
Energy: 0.20844630256158855
Energy: 0.19490322464401388
Energy: 0.2084463025628643
Energy: 0.1949032246435886
Energy: 0.20844630256243904
Energy: 0.1984443317273596
Energy: 0.19227130167455134
Energy: 0.19844433172778483
Energy: 0.19227130167455134
Energy: 0.19844433172778483
Energy: 0.19227130167455134
Energy: 0.18908010797057934
Energy: 0.2052362273970257
Energy: 0.18908010797057934
Energy: 0.20523622739617525
Energy: 0.1890801079710046
Energy: 0.2052362273978762

minimum gb energy = 0.18880537451637563 eV
minimum distance =  2.66272399923391 Angstroms
sigma value = 33


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

Energy: 0.21876623502084827
Energy: 0.2064034277997434
Energy: 0.2187662350202514
Energy: 0.2064034277997434
Energy: 0.2187662350211467
Energy: 0.20640342780004184
Energy: 0.24671601221256115
Energy: 0.21703963186367262
Energy: 0.2467160122119643
Energy: 0.2170396318633742
Energy: 0.2467160122119643
Energy: 0.21703963186367262
Energy: 0.23955010817709718
Energy: 0.3310116013384185
Energy: 0.23955010817769404
Energy: 0.3310116013384185
Energy: 0.23955010817829095
Energy: 0.3310116013384185
Energy: 0.2710448664897511
Energy: 0.20554580990213112
Energy: 0.27104486649064646
Energy: 0.20554580990213112
Energy: 0.27104486649154175
Energy: 0.2055458099018327
Energy: 0.20687699818754948
Energy: 0.23561556469896844
Energy: 0.20687699818695263
Energy: 0.23561556469926684
Energy: 0.20687699818784794
Energy: 0.2356155646995653
Energy: 0.23428071435669717
Energy: 0.21319180725695913
Energy: 0.2342807143513253
Energy: 0.2131918072572576
Energy: 0.23428071435430967
Energy: 0.21319180725755604
Energy: 0.23414087158016744
Energy: 0.2551475919625439
Energy: 0.2341408715804659
Energy: 0.2551475919625439
Energy: 0.2341408715813612
Energy: 0.2551475919625439
Energy: 0.23257024514513738
Energy: 0.25670764292097026
Energy: 0.23257024514454047
Energy: 0.25670764292126874
Energy: 0.23257024514483893
Energy: 0.25670764292126874
Energy: 0.30035983954620216
Energy: 0.21551216657736785
Energy: 0.30035983954620216
Energy: 0.21551216657736785
Energy: 0.30035983954590373
Energy: 0.21551216657766625
Energy: 0.36156702641185723
Energy: 0.22450953953622374
Energy: 0.3615670264112604
Energy: 0.22450953953592528
Energy: 0.3615670264094697
Energy: 0.22450953953592528
Energy: 0.23427879258195947
Energy: 0.23582734415573967
Energy: 0.23427879258255632
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Energy: 0.2358273441560381
Energy: 0.2061876273602802
Energy: 0.20560858879161795
Energy: 0.20618762735493543
Energy: 0.20560858879191637
Energy: 0.20618762735493543
Energy: 0.20560858879161795
Energy: 0.21447022412737113
Energy: 0.2870490086186697
Energy: 0.21447022412737113
Energy: 0.2870490086183713
Energy: 0.21447022412796804
Energy: 0.28704900861777444
Energy: 0.2535559484209452
Energy: 0.2319221212867735
Energy: 0.25355594842064677
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Energy: 0.25355594842064677
Energy: 0.2319221212867735
Energy: 0.2520556015671913
Energy: 0.23583658662894175
Energy: 0.25205560156629603
Energy: 0.235836586627748
Energy: 0.2520556015671913
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Energy: 0.2126711713110627
Energy: 0.2315808615181022
Energy: 0.21267117131225644
Energy: 0.2315808615160131
Energy: 0.21267117131225644
Energy: 0.2315808615204897
Energy: 0.26235238956928914
Energy: 0.2060999956171629
Energy: 0.26235238956988594
Energy: 0.20609999561746137
Energy: 0.2623523895674985
Energy: 0.2060999956171629
Energy: 0.2069597131785255
Energy: 0.23489602003174115
Energy: 0.2069597131785255
Energy: 0.2348960200347255
Energy: 0.2069597131770333
Energy: 0.2348960200335318
Energy: 0.2871035330658976
Energy: 0.2270729632782004
Energy: 0.2871035330658976
Energy: 0.2270729632784988
Energy: 0.287103533066196
Energy: 0.22707296327790194
Energy: 0.29907574808395665
Energy: 0.2218736827360999
Energy: 0.2990757480893285
Energy: 0.22187368273580146
Energy: 0.29907574808634413
Energy: 0.22187368273520458
Energy: 0.20603061126681843
Energy: 0.21816491483557615
Energy: 0.20603061126771374
Energy: 0.2181649148352777
Energy: 0.2060306112674153
Energy: 0.2181649148352777
Energy: 0.21862143249455307
Energy: 0.24919655514581798
Energy: 0.21862143249485153
Energy: 0.2491965551461164
Energy: 0.21862143249365776
Energy: 0.24919655514551953
Energy: 0.2520591269285719
Energy: 0.21639791502449832
Energy: 0.2520591269273782
Energy: 0.21639791502479674
Energy: 0.2520591269276766
Energy: 0.21639791502360303
Energy: 0.20530323011455928
Energy: 0.275420509694759
Energy: 0.20530323011455928
Energy: 0.2754205096968481
Energy: 0.20530323011426083
Energy: 0.275420509694759
Energy: 0.2358917716519255
Energy: 0.20600244609878007
Energy: 0.23589177165398748
Energy: 0.20600244609848165
Energy: 0.2358917716477474
Energy: 0.20600244609848165
Energy: 0.2148865917961642
Energy: 0.25231063107667445
Energy: 0.2148865917955673
Energy: 0.2523106310754806
Energy: 0.21488659179467198
Energy: 0.25231063107607754
Energy: 0.24738330423659632
Energy: 0.233134174500689
Energy: 0.247383304235701
Energy: 0.23313417450009213
Energy: 0.24738330423599944
Energy: 0.2331341745003906
Energy: 0.21736103398023768
Energy: 0.20590793401028754
Energy: 0.2173610339796408
Energy: 0.2059079340099891
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Energy: 0.2869783456575564
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Energy: 0.2869783456560642
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Energy: 0.22654939642375663
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Energy: 0.2869561835945282
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Energy: 0.2091790506933593
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Energy: 0.21324516348948838
Energy: 0.2074286761377583
Energy: 0.21324516348918995
Energy: 0.207428676136863
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Energy: 0.25217021078151647
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Energy: 0.2521702107818149
Energy: 0.20787423662009258
Energy: 0.21326413788849352
Energy: 0.20787423662546445
Energy: 0.21326413788879195
Energy: 0.2078742366233754
Energy: 0.21326413788879195
Energy: 0.205338584679447
Energy: 0.28228115824551436
Energy: 0.20533858467914853
Energy: 0.2822811582470066
Energy: 0.20533858467855165
Energy: 0.2822811582470066
Energy: 0.23575134215432778
Energy: 0.20916988884327997
Energy: 0.23575134215462618
Energy: 0.20916988884327997
Energy: 0.23575134215462618
Energy: 0.2091698888435784
Energy: 0.2265487041718608
Energy: 0.2870089828208499
Energy: 0.2265487041715624
Energy: 0.2870089828205515
Energy: 0.2265487041715624
Energy: 0.28700898282025306
Energy: 0.21699273218206408
Energy: 0.2869342057128847
Energy: 0.21699273218206408
Energy: 0.28693420571258627
Energy: 0.21699273218236254
Energy: 0.2869342057122878
Energy: 0.21734837060962162
Energy: 0.2058004595400226
Energy: 0.21734837061051696
Energy: 0.20580045954032106
Energy: 0.21734837060962162
Energy: 0.20580045954032106
Energy: 0.24737119444256708
Energy: 0.23311167373291275
Energy: 0.24737119444167177
Energy: 0.23311167373291275
Energy: 0.24737119444226865
Energy: 0.23311167373291275
Energy: 0.2148608144637967
Energy: 0.2520502706120898
Energy: 0.21486081446349828
Energy: 0.25205027061298513
Energy: 0.2148608144623045
Energy: 0.2520502706111945
Energy: 0.23652571832498287
Energy: 0.20600980452087486
Energy: 0.23652571833095162
Energy: 0.2060098045205764
Energy: 0.23652571832557975
Energy: 0.20600980452087486
Energy: 0.205300952710934
Energy: 0.27605290202987703
Energy: 0.20530095271153087
Energy: 0.27605290203017546
Energy: 0.20530095271123242
Energy: 0.27605290203017546
Energy: 0.2519335859895241
Energy: 0.21671088539413313
Energy: 0.25193358599071786
Energy: 0.21671088539323782
Energy: 0.2519335859886288
Energy: 0.2167108853923425
Energy: 0.21861241989498256
Energy: 0.24928716006027135
Energy: 0.21861241989587787
Energy: 0.2492871600590776
Energy: 0.21861241989557942
Energy: 0.24928716005997292

minimum gb energy = 0.205300952710934 eV
minimum distance =  2.6938704047857 Angstroms
sigma value = 67


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

Energy: 0.21273113496205773
Energy: 0.2208360480357996
Energy: 0.21273113496205773
Energy: 0.2208360480357996
Energy: 0.21273113496205773
Energy: 0.22083604803600357
Energy: 0.21278375445001282
Energy: 0.22024879905197509
Energy: 0.21278375445021683
Energy: 0.22024879905197509
Energy: 0.21278375445021683
Energy: 0.22024879905177108
Energy: 0.35296150663480985
Energy: 0.28671324554559374
Energy: 0.35296150663480985
Energy: 0.2867132455457977
Energy: 0.2378114878972887
Energy: 0.28671324554559374
Energy: 0.21276379358058797
Energy: 0.22025280867089564
Energy: 0.212763793580384
Energy: 0.22025280867069166
Energy: 0.21276379358058797
Energy: 0.22025280867089564
Energy: 0.21273113496205773
Energy: 0.2208360480363889
Energy: 0.21273113496185375
Energy: 0.2208360480363889
Energy: 0.21273113496185375
Energy: 0.2208360480361849
Energy: 0.2127837544510101
Energy: 0.22024879905138578
Energy: 0.2127837544510101
Energy: 0.22024879905158976
Energy: 0.21278375445121409
Energy: 0.22024879905158976
Energy: 0.237811487898286
Energy: 0.28671324554559374
Energy: 0.237811487898082
Energy: 0.2867132455457977
Energy: 0.237811487897878
Energy: 0.28671324554520844

minimum gb energy = 0.21273113496185375 eV
minimum distance =  2.72341425797255 Angstroms
sigma value = 3


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

Energy: 0.332886476566241
Energy: 0.2792816057141602
Energy: 0.3328864765673266
Energy: 0.2792816057144069
Energy: 0.3328864765667838
Energy: 0.2792816057144069
Energy: 0.2912747307730386
Energy: 0.281223367938435
Energy: 0.29127473077274246
Energy: 0.2812233679378922
Energy: 0.2912747307703244
Energy: 0.28122336793818825
Energy: 0.2972467525322525
Energy: 0.3347740926120116
Energy: 0.29724675253092014
Energy: 0.3347740926120116
Energy: 0.2972467525330915
Energy: 0.33477409261176483
Energy: 0.28110300328746696
Energy: 0.279531506943535
Energy: 0.2811030032880098
Energy: 0.27953150694299217
Energy: 0.28110300328963833
Energy: 0.2795315069438311
Energy: 0.2934293439168024
Energy: 0.29738493292789
Energy: 0.2934293439157168
Energy: 0.2973849329275939
Energy: 0.2934293439146804
Energy: 0.29738493292789
Energy: 0.2899770432041637
Energy: 0.29816902587995253
Energy: 0.28997704320223905
Energy: 0.29816902587995253
Energy: 0.2899770432019923
Energy: 0.29816902587995253
Energy: 0.29796426312827806
Energy: 0.2933409763245102
Energy: 0.2979642631299066
Energy: 0.29334097632505307
Energy: 0.29796426312882085
Energy: 0.29334097632505307
Energy: 0.28152537419039864
Energy: 0.28505988685412553
Energy: 0.28152537419202717
Energy: 0.28505988685412553
Energy: 0.28152537419118817
Energy: 0.28505988685412553
Energy: 0.2809898732299085
Energy: 0.2953251840788001
Energy: 0.28098987323124097
Energy: 0.29532518407855335
Energy: 0.28098987323015523
Energy: 0.2953251840788001
Energy: 0.2846031388923698
Energy: 0.29586859502535967
Energy: 0.2846031388921231
Energy: 0.29586859502373114
Energy: 0.2846031388934555
Energy: 0.2958685950259025
Energy: 0.29084225899984095
Energy: 0.3045677751152054
Energy: 0.2908422589984591
Energy: 0.30456777511495864
Energy: 0.2908422589984591
Energy: 0.30456777511466254
Energy: 0.28690473646018483
Energy: 0.28406404450371403
Energy: 0.28690473645964193
Energy: 0.2840640445039608
Energy: 0.2869047364607276
Energy: 0.28406404450341793
Energy: 0.2823838021609943
Energy: 0.2895877279803568
Energy: 0.28238380216129033
Energy: 0.2895877279803568
Energy: 0.2823838021615371
Energy: 0.2895877279803568
Energy: 0.28378654393981106
Energy: 0.2919311467683299
Energy: 0.28378654393956426
Energy: 0.2919311467680337
Energy: 0.2837865439403539
Energy: 0.29193114676857657
Energy: 0.29275278774165003
Energy: 0.29177115468766424
Energy: 0.2927527877402683
Energy: 0.29177115468766424
Energy: 0.2927527877411072
Energy: 0.2917711546874175
Energy: 0.2900199553047884
Energy: 0.2813783518332649
Energy: 0.2900199553042455
Energy: 0.28137835183272203
Energy: 0.29001995530587404
Energy: 0.28137835183272203
Energy: 0.285905611056782
Energy: 0.29214762647734616
Energy: 0.28590561105485734
Energy: 0.2921476264776423
Energy: 0.2859056110551535
Energy: 0.2921476264770994
Energy: 0.27586013330147185
Energy: 0.3012310391975828
Energy: 0.27586013330201475
Energy: 0.3012310391972867
Energy: 0.2758601333003862
Energy: 0.30123103919704003
Energy: 0.2984743071638244
Energy: 0.30187832033612877
Energy: 0.2984743071652062
Energy: 0.30187832033721446
Energy: 0.2984743071646634
Energy: 0.30187832033751055
Energy: 0.28700422398037906
Energy: 0.2857731320909729
Energy: 0.2870042239800829
Energy: 0.2857731320909729
Energy: 0.2870042239784544
Energy: 0.28577313209072613
Energy: 0.2842707155757833
Energy: 0.3277258368691578
Energy: 0.2842707155771651
Energy: 0.327725836868615
Energy: 0.2842707155787937
Energy: 0.327725836868615
Energy: 0.27167910930400585
Energy: 0.30938664645410935
Energy: 0.27167910930321626
Energy: 0.3093866464551951
Energy: 0.2716791093021305
Energy: 0.309386646454899
Energy: 0.3150355578034136
Energy: 0.27840760806726456
Energy: 0.3150355578031669
Energy: 0.27840760806726456
Energy: 0.31503555780504217
Energy: 0.2784076080670178
Energy: 0.2767698460514082
Energy: 0.28406143365922953
Energy: 0.27676984605116145
Energy: 0.2840614336595256
Energy: 0.2767698460508653
Energy: 0.2840614336595256
Energy: 0.28680264399671557
Energy: 0.3277252946035777
Energy: 0.28680264399671557
Energy: 0.32772529460303484
Energy: 0.2868026439961727
Energy: 0.32772529460333094
Energy: 0.28067224448932615
Energy: 0.29312487228549666
Energy: 0.28067224448690803
Energy: 0.2931248722846577
Energy: 0.2806722444887833
Energy: 0.29312487228549666
Energy: 0.2973128310997266
Energy: 0.29299089479389984
Energy: 0.29731283110081225
Energy: 0.29299089479389984
Energy: 0.297312831101059
Energy: 0.29299089479389984
Energy: 0.27670573818317157
Energy: 0.2971007161771676
Energy: 0.27670573818317157
Energy: 0.28400820661580656
Energy: 0.2767057381826288
Energy: 0.29710071618313894
Energy: 0.28632623259997597
Energy: 0.2922086445409048
Energy: 0.2863262325996799
Energy: 0.2922086445409048
Energy: 0.28632623259913703
Energy: 0.2922086445409048
Energy: 0.3082252539225329
Energy: 0.28033418369468277
Energy: 0.3082252539206083
Energy: 0.28033418369468277
Energy: 0.3082252539206083
Energy: 0.2803341836941399
Energy: 0.31446038428557216
Energy: 0.2748479040468394
Energy: 0.31446038428799034
Energy: 0.2748479040473822
Energy: 0.31446038428527606
Energy: 0.274847904047629
Energy: 0.28226501298121176
Energy: 0.29206041855767645
Energy: 0.28226501298254414
Energy: 0.29206041855846604
Energy: 0.28226501298066886
Energy: 0.29206041855821924
Energy: 0.28257435478677023
Energy: 0.2880179571508426
Energy: 0.28257435478514165
Energy: 0.28801795715054657
Energy: 0.2825743547862274
Energy: 0.2880179571502998
Energy: 0.2940481734890775
Energy: 0.3028016784313882
Energy: 0.29404817348690615
Energy: 0.30280167843193107
Energy: 0.2940481734879918
Energy: 0.30280167843168426
Energy: 0.29203880355013684
Energy: 0.290066089532669
Energy: 0.2920388035506797
Energy: 0.29006608953321183
Energy: 0.29203880354984074
Energy: 0.29006608953242224
Energy: 0.2805715528750524
Energy: 0.3275239165035686
Energy: 0.2805715528725849
Energy: 0.32752391650332185
Energy: 0.28057155287559526
Energy: 0.32752391650302576
Energy: 0.27955978358875555
Energy: 0.2954309897964386
Energy: 0.2795597835890023
Energy: 0.2954309897969814
Energy: 0.27955978358984124
Energy: 0.2954309897966853
Energy: 0.3113380844563201
Energy: 0.28142708270766903
Energy: 0.31133808445661626
Energy: 0.28142708270737293
Energy: 0.3113380844563201
Energy: 0.28142708270766903
Energy: 0.28359191149610047
Energy: 0.29631968918870716
Energy: 0.2835919114928434
Energy: 0.29631968918900325
Energy: 0.2835919114947681
Energy: 0.29631968918870716
Energy: 0.2909290099153757
Energy: 0.3248173546383
Energy: 0.2909290099140432
Energy: 0.3248173546385962
Energy: 0.29092900991621456
Energy: 0.3248173546385962
Energy: 0.29315375980121977
Energy: 0.2963300468494539
Energy: 0.2931537598003808
Energy: 0.29633004684970066
Energy: 0.2931537598003808
Energy: 0.2963300468494539
Energy: 0.3185962054377444
Energy: 0.2742923202472013
Energy: 0.31859620543695477
Energy: 0.2742923202464117
Energy: 0.3185962054380405
Energy: 0.2742923202464117
Energy: 0.28178935532446125
Energy: 0.29192426235975594
Energy: 0.28178935532120414
Energy: 0.2919242623562521
Energy: 0.28178935532416516
Energy: 0.2919242623557092
Energy: 0.28722558516195806
Energy: 0.2919346729362587
Energy: 0.28722558516062563
Energy: 0.29193467293571584
Energy: 0.28722558516062563
Energy: 0.2919346729362587
Energy: 0.3208155999889712
Energy: 0.2843420276913976
Energy: 0.32081559998842835
Energy: 0.2843420276913976
Energy: 0.32081559998734266
Energy: 0.2843420276916444
Energy: 0.3065594897667676
Energy: 0.2797669395601778
Energy: 0.30655948976538583
Energy: 0.279766939559635
Energy: 0.30655948976538583
Energy: 0.27976693956042464
Energy: 0.2863552471703745
Energy: 0.29005416577834925
Energy: 0.28635524716983163
Energy: 0.2900541657786454
Energy: 0.286355247168746
Energy: 0.290054165779435
Energy: 0.28591565152555654
Energy: 0.2859973774811321
Energy: 0.28591565152827075
Energy: 0.28599737748088533
Energy: 0.28591565152555654
Energy: 0.2859973774805892
Energy: 0.29320020984889916
Energy: 0.29158082331813473
Energy: 0.29320020984919526
Energy: 0.291580823317888
Energy: 0.2932002098478135
Energy: 0.2915808233175919
Energy: 0.30430194277084915
Energy: 0.2873439737933767
Energy: 0.3043019427695167
Energy: 0.28734397379258714
Energy: 0.30430194277005956
Energy: 0.2873439738009766
Energy: 0.2783303667178825
Energy: 0.29584862063040523
Energy: 0.278330366716254
Energy: 0.2958486206309481
Energy: 0.2783303667157111
Energy: 0.2958486206311948

minimum gb energy = 0.2716791093021305 eV
minimum distance =  2.606306528984 Angstroms
sigma value = 81


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

Energy: 0.3136651784612635
Energy: 0.28665554590404463
Energy: 0.2771400404915523
Energy: 0.28665554590441716
Energy: 0.3136651784612635
Energy: 0.28665554590404463
Energy: 0.3100147881335276
Energy: 0.3153274798229977
Energy: 0.31001478813166494
Energy: 0.3153274798229977
Energy: 0.3100147881331551
Energy: 0.3153274798218801
Energy: 0.32574308579739286
Energy: 0.2611176770673992
Energy: 0.32619687952882753
Energy: 0.2611176770670267
Energy: 0.32574308579702027
Energy: 0.2611176770677717
Energy: 0.27809977804486763
Energy: 0.3022476942704684
Energy: 0.27809977804710284
Energy: 0.3022476942704684
Energy: 0.27809977804486763
Energy: 0.30224769427009585
Energy: 0.31824111596967974
Energy: 0.27818412205111426
Energy: 0.31824111596893473
Energy: 0.2781841220514868
Energy: 0.3182411159693072
Energy: 0.27818412205074167
Energy: 0.28801658832620286
Energy: 0.2663934487049359
Energy: 0.2880165883250853
Energy: 0.2663934487049359
Energy: 0.28801658832620286
Energy: 0.2663934487034458
Energy: 0.2625894798819797
Energy: 0.2610161528656254
Energy: 0.2625894798830973
Energy: 0.2610161528656254
Energy: 0.2625894798819797
Energy: 0.26101615286525287
Energy: 0.3189097277731017
Energy: 0.32735715876911425
Energy: 0.31892747206551775
Energy: 0.32735715876836924
Energy: 0.31890972777235665
Energy: 0.3273571587687417
Energy: 0.31224567450955365
Energy: 0.2952958751907918
Energy: 0.3122456745091811
Energy: 0.2952958751907918
Energy: 0.31224567450992613
Energy: 0.29529587519116435
Energy: 0.3144210304455999
Energy: 0.2952373514921336
Energy: 0.31442103044448233
Energy: 0.2952373514925062
Energy: 0.3144210304459724
Energy: 0.29523735149325125
Energy: 0.29850762978566614
Energy: 0.30172585254452794
Energy: 0.29850762978566614
Energy: 0.3017258525441554
Energy: 0.2985076297871562
Energy: 0.30172585254527307
Energy: 0.275882331112484
Energy: 0.282988727221202
Energy: 0.31530320981783116
Energy: 0.282988727221202
Energy: 0.27588233111211147
Energy: 0.282988727221202
Energy: 0.32289867223458657
Energy: 0.3192650861920905
Energy: 0.3228986722383118
Energy: 0.31926508619171795
Energy: 0.3228986722349591
Energy: 0.31926508619134536
Energy: 0.28228194764124176
Energy: 0.2678707453538762
Energy: 0.28228194764273185
Energy: 0.2678707453553663
Energy: 0.28228194764124176
Energy: 0.2678707453546213
Energy: 0.2627657740148686
Energy: 0.3079940662367479
Energy: 0.2627657740133785
Energy: 0.3079940662367479
Energy: 0.2627657740152411
Energy: 0.3079940662367479
Energy: 0.2948571594159539
Energy: 0.27397926630287694
Energy: 0.2948571594111111
Energy: 0.2739792663025044
Energy: 0.2948571594159539
Energy: 0.27397926630138686
Energy: 0.2866467884941812
Energy: 0.27737803774749087
Energy: 0.2866467884941812
Energy: 0.27737803774711833
Energy: 0.28664678849455366
Energy: 0.2773780377486085
Energy: 0.32598887724938325
Energy: 0.31413507043706773
Energy: 0.32595546835232336
Energy: 0.31413507043706773
Energy: 0.32598887724938325
Energy: 0.3141350704378128
Energy: 0.2592812402594846
Energy: 0.30871557548930634
Energy: 0.2592812402587396
Energy: 0.308715575491169
Energy: 0.2592812402598572
Energy: 0.30871557549899203
Energy: 0.30848084826695565
Energy: 0.3004991120437857
Energy: 0.3084808482680733
Energy: 0.3004991120437857
Energy: 0.30848084826695565
Energy: 0.30049911204527585
Energy: 0.2771243042111307
Energy: 0.3192953446388821
Energy: 0.27712430421411094
Energy: 0.31929534463925463
Energy: 0.27712430421150325
Energy: 0.31929534464037224
Energy: 0.3093972107356357
Energy: 0.3047071370127802
Energy: 0.26265974948178983
Energy: 0.30470713701240765
Energy: 0.3093972107356357
Energy: 0.30470713701240765
Energy: 0.3027635112325088
Energy: 0.2645869731550649
Energy: 0.26267263624593656
Energy: 0.2645869731550649
Energy: 0.3027635112325088
Energy: 0.2645869731543199
Energy: 0.3240853041270266
Energy: 0.32068489247822207
Energy: 0.324085304126654
Energy: 0.32068489247822207
Energy: 0.32408530412739905
Energy: 0.32068489247859455
Energy: 0.2934081819377117
Energy: 0.31467743497889766
Energy: 0.29340818194106444
Energy: 0.31467743497889766
Energy: 0.2934081819377117
Energy: 0.31467743498076023
Energy: 0.30067504738936107
Energy: 0.3734981330817921
Energy: 0.3006750473882435
Energy: 0.3734981330817921
Energy: 0.30067504738861606
Energy: 0.37349813308216456
Energy: 0.31823240354079063
Energy: 0.2717412875725176
Energy: 0.3182324035385555
Energy: 0.2717412875728562
Energy: 0.31823240354079063
Energy: 0.2717412875717725
Energy: 0.2858619741290577
Energy: 0.2775007418665165
Energy: 0.2858619741290577
Energy: 0.2775007418665165
Energy: 0.2858619741283126
Energy: 0.277500741866144
Energy: 0.32001992957873665
Energy: 0.3112047977996505
Energy: 0.3200348395363796
Energy: 0.3112047977996505
Energy: 0.32001992957873665
Energy: 0.3112047978003955
Energy: 0.2643719155219666
Energy: 0.29930511891946
Energy: 0.264371915520849
Energy: 0.29930511891946
Energy: 0.2643719155223391
Energy: 0.29930511891946
Energy: 0.2990529838697492
Energy: 0.26514036669328994
Energy: 0.2990529838693767
Energy: 0.26514036669291735
Energy: 0.2990529838697492
Energy: 0.2651403666921723
Energy: 0.2794989137173158
Energy: 0.31765249574038834
Energy: 0.2794989137169433
Energy: 0.31765249574038834
Energy: 0.2794989137173158
Energy: 0.3176524957407608
Energy: 0.2764618451417177
Energy: 0.2876879523748855
Energy: 0.312804874597788
Energy: 0.28768795237451295
Energy: 0.2764618451417177
Energy: 0.28768795237525807
Energy: 0.26041787165183694
Energy: 0.26305922877586974
Energy: 0.2990149168527026
Energy: 0.2630592287754972
Energy: 0.26041787165183694
Energy: 0.2630592287762423
Energy: 0.296258521602013
Energy: 0.31968863589624935
Energy: 0.34783131077772206
Energy: 0.31968863589624935
Energy: 0.29625852160164046
Energy: 0.31968863589587687
Energy: 0.2967848538859599
Energy: 0.3110012552562227
Energy: 0.2967848538841311
Energy: 0.31100125525585015
Energy: 0.2967848538867049
Energy: 0.3110012552554776
Energy: 0.3203352827007208
Energy: 0.2757396692463113
Energy: 0.3203352827007208
Energy: 0.2757396692470564
Energy: 0.32033528269997574
Energy: 0.2757396692463113
Energy: 0.30220577030583695
Energy: 0.2594689200385593
Energy: 0.30220577030509194
Energy: 0.2594689200385593
Energy: 0.3022057703054644
Energy: 0.25946892003930433

minimum gb energy = 0.2592812402587396 eV
minimum distance =  2.70522219904384 Angstroms
sigma value = 43


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

Energy: 0.313268431562443
Energy: 0.2873182991264245
Energy: 0.3132684315619854
Energy: 0.2873182991259669
Energy: 0.313268431562443
Energy: 0.2873182991259669
Energy: 0.2825815545096334
Energy: 0.2622643401487959
Energy: 0.2825815545096334
Energy: 0.2622643401487959
Energy: 0.282581554510091
Energy: 0.2622643401487959
Energy: 0.30837829635382336
Energy: 0.29499605493323167
Energy: 0.3209023099065498
Energy: 0.29499605493323167
Energy: 0.30367515488007374
Energy: 0.2949960549327741
Energy: 0.26006957587478174
Energy: 0.27269704444273807
Energy: 0.2600695758752393
Energy: 0.27269704444273807
Energy: 0.2600695758752393
Energy: 0.27269704444273807
Energy: 0.28635724559582326
Energy: 0.29697073547949543
Energy: 0.28635724559582326
Energy: 0.29697073547949543
Energy: 0.28635724559582326
Energy: 0.29697073547903785
Energy: 0.2792601639134321
Energy: 0.2790711516647575
Energy: 0.2792601639134321
Energy: 0.27907115166429985
Energy: 0.27926016391251696
Energy: 0.2790711516647575
Energy: 0.2951836672830816
Energy: 0.2931838504094909
Energy: 0.2951836672844544
Energy: 0.29318385040994843
Energy: 0.295183667282624
Energy: 0.2931838504117788
Energy: 0.28506674836534834
Energy: 0.279371612720991
Energy: 0.2850667483667211
Energy: 0.279371612720991
Energy: 0.2850667483662635
Energy: 0.279371612720991
Energy: 0.2965085834635866
Energy: 0.2894141585651008
Energy: 0.29650858346312897
Energy: 0.2894141585651008
Energy: 0.29650858346312897
Energy: 0.2894141585651008
Energy: 0.2804931740803271
Energy: 0.27597483895020203
Energy: 0.28049317408078467
Energy: 0.27597483895020203
Energy: 0.2804931740812422
Energy: 0.27597483895020203
Energy: 0.2779593227166424
Energy: 0.26729311458472504
Energy: 0.2779593227161849
Energy: 0.2672931145851826
Energy: 0.2779593227161849
Energy: 0.2672931145851826
Energy: 0.2849064655887487
Energy: 0.29666034554939696
Energy: 0.28490646558920624
Energy: 0.29666034554939696
Energy: 0.2849064655882911
Energy: 0.29666034554939696
Energy: 0.2936750436027149
Energy: 0.3070507776350669
Energy: 0.2936750436027149
Energy: 0.3070507776350669
Energy: 0.2936750436027149
Energy: 0.3070507776350669
Energy: 0.2660450749237288
Energy: 0.2830100194785273
Energy: 0.2660450749237288
Energy: 0.2830100194780697
Energy: 0.26604507492327123
Energy: 0.2830100194785273
Energy: 0.2863908399115266
Energy: 0.2777505644007254
Energy: 0.2863908399106114
Energy: 0.2777505644007254
Energy: 0.28639083990923864
Energy: 0.2777505644007254
Energy: 0.285398550611252
Energy: 0.29400287142125653
Energy: 0.285398550611252
Energy: 0.29400287142125653
Energy: 0.2853985506117096
Energy: 0.294002871420799
Energy: 0.2762823356839768
Energy: 0.288279257878534
Energy: 0.2762823356839768
Energy: 0.28827925787899156
Energy: 0.2762823356839768
Energy: 0.288279257878534
Energy: 0.2883789210799535
Energy: 0.2716196029644709
Energy: 0.2883789210799535
Energy: 0.2716196029644709
Energy: 0.2883789210794959
Energy: 0.2716196029649285
Energy: 0.2984288233122031
Energy: 0.2757027905802709
Energy: 0.29842882331266063
Energy: 0.2757027905802709
Energy: 0.29842882331266063
Energy: 0.2757027905802709
Energy: 0.27827214578118686
Energy: 0.2877229079490475
Energy: 0.27827214578118686
Energy: 0.2877229079490475
Energy: 0.27827214578118686
Energy: 0.2877229079485899
Energy: 0.26935639038351006
Energy: 0.29560898270012753
Energy: 0.2693563903844252
Energy: 0.29560898270012753
Energy: 0.26935639038351006
Energy: 0.29560898270012753
Energy: 0.2996254074557272
Energy: 0.3134456428160814
Energy: 0.2996254074557272
Energy: 0.3134456428160814
Energy: 0.2996254074552696
Energy: 0.3134456428160814
Energy: 0.26392258226777165
Energy: 0.27927356022076394
Energy: 0.2639225822673141
Energy: 0.27927356022076394
Energy: 0.26392258226777165
Energy: 0.27927356022076394
Energy: 0.2930066187432673
Energy: 0.3065154529271688
Energy: 0.29300661874372486
Energy: 0.3065154529271688
Energy: 0.2930066187432673
Energy: 0.3065154529271688
Energy: 0.2660303450999425
Energy: 0.28439267732274826
Energy: 0.2660303450994849
Energy: 0.28439267732229073
Energy: 0.26603034510085766
Energy: 0.28439267732229073
Energy: 0.28834186164933023
Energy: 0.3006007532728542
Energy: 0.28834186164887265
Energy: 0.3006007532728542
Energy: 0.28834186164887265
Energy: 0.30060075327331176
Energy: 0.2799666641242857
Energy: 0.2637834767191338
Energy: 0.27996666412382815
Energy: 0.2637834767191338
Energy: 0.2799666641242857
Energy: 0.2637834767191338
Energy: 0.29496244303240443
Energy: 0.2894921518016273
Energy: 0.294962443032862
Energy: 0.2894921518016273
Energy: 0.29496244303240443
Energy: 0.2894921518016273
Energy: 0.26596360558863075
Energy: 0.2816319687215647
Energy: 0.2659636055877156
Energy: 0.2816319687211071
Energy: 0.26596360558863075
Energy: 0.2816319687215647
Energy: 0.2808400273911611
Energy: 0.28316589724075825
Energy: 0.2808400273911611
Energy: 0.28316589724075825
Energy: 0.2808400273907035
Energy: 0.28316589723984315
Energy: 0.2807492545073678
Energy: 0.27829068072362356
Energy: 0.2807492545064527
Energy: 0.27829068072362356
Energy: 0.2807492545073678
Energy: 0.27829068072408114

minimum gb energy = 0.26006957587478174 eV
minimum distance =  2.65495481718786 Angstroms
sigma value = 57


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

Energy: 0.2932022254747421
Energy: 0.2579694810403541
Energy: 0.29320222547355723
Energy: 0.2579694810421316
Energy: 0.2932022254747421
Energy: 0.2579694810415391
Energy: 0.26941614840602035
Energy: 0.2394139258060417
Energy: 0.26941614840661277
Energy: 0.23941392580544923
Energy: 0.26941614840483535
Energy: 0.23941392580781917
Energy: 0.2993319519095016
Energy: 0.2973006667284063
Energy: 0.2993319519095016
Energy: 0.2973006667284063
Energy: 0.2993319519095016
Energy: 0.2973006667284063
Energy: 0.2516538946012986
Energy: 0.27088407737422965
Energy: 0.25165389460011367
Energy: 0.27088407737422965
Energy: 0.2516538945995212
Energy: 0.27088407737422965
Energy: 0.29948631788292635
Energy: 0.2936191190510017
Energy: 0.29948631788292635
Energy: 0.2936191190510017
Energy: 0.29948631788292635
Energy: 0.2936191190510017
Energy: 0.30029092239517363
Energy: 0.2712474381858152
Energy: 0.3002909223939887
Energy: 0.2712474381858152
Energy: 0.30029092239517363
Energy: 0.27124743818522273
Energy: 0.2898856631818063
Energy: 0.29641216094917877
Energy: 0.2898856631818063
Energy: 0.29641216094858636
Energy: 0.2898856631818063
Energy: 0.29641216094858636
Energy: 0.28220120077000743
Energy: 0.2652505103543085
Energy: 0.2822012007705999
Energy: 0.265250510353716
Energy: 0.28220120076822997
Energy: 0.2652505103543085
Energy: 0.29217351561955335
Energy: 0.2689323440722426
Energy: 0.29217351561955335
Energy: 0.2689323440716501
Energy: 0.29217351561955335
Energy: 0.26893234406987265
Energy: 0.2612697311562335
Energy: 0.26760923849639856
Energy: 0.26126973115504853
Energy: 0.2676092384946211
Energy: 0.26126973115564106
Energy: 0.2676092384940286
Energy: 0.2897473680506178
Energy: 0.26955341506185626
Energy: 0.2897473680506178
Energy: 0.26955341506185626
Energy: 0.2897473680500253
Energy: 0.2695534150612638
Energy: 0.2868598548867702
Energy: 0.29773618945810854
Energy: 0.2868598548855853
Energy: 0.29773618945751607
Energy: 0.2868598548879551
Energy: 0.29773618945810854
Energy: 0.291592985094303
Energy: 0.26916650820368276
Energy: 0.291592985094303
Energy: 0.26916650820131294
Energy: 0.291592985094303
Energy: 0.2691665081995355
Energy: 0.31492276965753163
Energy: 0.24281265941691493
Energy: 0.31492276965634675
Energy: 0.24281265941691493
Energy: 0.31492276965753163
Energy: 0.24281265941691493
Energy: 0.28418424175242046
Energy: 0.26257808806009425
Energy: 0.28418424175182794
Energy: 0.26257808806009425
Energy: 0.28418424175182794
Energy: 0.26257808806009425
Energy: 0.30394406603813723
Energy: 0.2830927404180912
Energy: 0.30394406603932217
Energy: 0.2830927404174987
Energy: 0.30394406603813723
Energy: 0.2830927404180912
Energy: 0.25893794877874365
Energy: 0.26936040809448103
Energy: 0.25893794878170606
Energy: 0.26936040809448103
Energy: 0.2589379487799286
Energy: 0.26936040809566597
Energy: 0.2886635378594155
Energy: 0.2590037393736767
Energy: 0.288663537860008
Energy: 0.25900373937308424
Energy: 0.2886635378594155
Energy: 0.2590037393736767
Energy: 0.258834795942112
Energy: 0.26929156694154704
Energy: 0.2588347959427045
Energy: 0.2692915669421395
Energy: 0.25883479594151954
Energy: 0.26929156693917716
Energy: 0.30393483877295635
Energy: 0.2830708673105679
Energy: 0.3039348387741413
Energy: 0.2830708673105679
Energy: 0.3039348387735488
Energy: 0.2830708673105679
Energy: 0.28430807575907724
Energy: 0.2625718124885998
Energy: 0.2843080757584848
Energy: 0.2625718124885998
Energy: 0.28430807575966976
Energy: 0.2625718124885998
Energy: 0.3148380284866822
Energy: 0.2893416050872685
Energy: 0.3148380284884596
Energy: 0.2893416050872685
Energy: 0.3148380284866822
Energy: 0.2893416050872685
Energy: 0.29152131360940114
Energy: 0.26918501418268914
Energy: 0.2915213136088086
Energy: 0.26918501418268914
Energy: 0.2915213136088086
Energy: 0.2691850141820967
Energy: 0.286898569055561
Energy: 0.2977457224954888
Energy: 0.28689856905733846
Energy: 0.2977457224954888
Energy: 0.2868985690561535
Energy: 0.29774572249608133

minimum gb energy = 0.23941392580544923 eV
minimum distance =  2.68064947587012 Angstroms
sigma value = 17


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

Energy: 0.319505545582413
Energy: 0.24334511981929505
Energy: 0.3195055455832509
Energy: 0.24334511981929505
Energy: 0.319505545582413
Energy: 0.24334511981929505
Energy: 0.2675475992317713
Energy: 0.22613752368087328
Energy: 0.26754759923093335
Energy: 0.22613752368087328
Energy: 0.2675475992317713
Energy: 0.22613752368087328
Energy: 0.27435209697007296
Energy: 0.2630932384569362
Energy: 0.27435209697091084
Energy: 0.2630932384569362
Energy: 0.27435209697091084
Energy: 0.26309323845609833
Energy: 0.29652355005719955
Energy: 0.25600492675848585
Energy: 0.29652355005719955
Energy: 0.2560049267568291
Energy: 0.29652355005719955
Energy: 0.25600492675848585
Energy: 0.3007653204057132
Energy: 0.2479322119223755
Energy: 0.3007653204057132
Energy: 0.2479322119223755
Energy: 0.3007653204057132
Energy: 0.2479322119223755
Energy: 0.24768433009414034
Energy: 0.2261147144194814
Energy: 0.24768433009330248
Energy: 0.2261147144194814
Energy: 0.24768433009330248
Energy: 0.2261147144194814
Energy: 0.22456369581817112
Energy: 0.24894200398107053
Energy: 0.22456369581733326
Energy: 0.24894200398107053
Energy: 0.22456369581733326
Energy: 0.24894200398023264
Energy: 0.29660824160961213
Energy: 0.2915398617633226
Energy: 0.29660824161045
Energy: 0.2915398617633226
Energy: 0.29660824161045
Energy: 0.2915398617633226
Energy: 0.2593942778807177
Energy: 0.22597860238329945
Energy: 0.2593942778807177
Energy: 0.2259786023841373
Energy: 0.2593942778807177
Energy: 0.22597860238329945
Energy: 0.24931882026495114
Energy: 0.2384305898941172
Energy: 0.24931882026578905
Energy: 0.2384305898941172
Energy: 0.24931882026578905
Energy: 0.2384305898941172
Energy: 0.24425331204665462
Energy: 0.2769959721406912
Energy: 0.24425331204665462
Energy: 0.2769959721406912
Energy: 0.2442533120458167
Energy: 0.2769959721406912
Energy: 0.29568720928663234
Energy: 0.2923839147427417
Energy: 0.2956872092874702
Energy: 0.2923839147427417
Energy: 0.2956872092874702
Energy: 0.2923839147427417
Energy: 0.2245135942889816
Energy: 0.26943658546942184
Energy: 0.2245135942889816
Energy: 0.26943658546942184
Energy: 0.2245135942889816
Energy: 0.2694365854685839
Energy: 0.24933854665414476
Energy: 0.27182947675278185
Energy: 0.2493385466533069
Energy: 0.27182947675194397
Energy: 0.2493385466533069
Energy: 0.27182947675278185
Energy: 0.24700580458203858
Energy: 0.30882444830844463
Energy: 0.24700580458203858
Energy: 0.30882444830844463
Energy: 0.24700580458203858
Energy: 0.30882444830844463
Energy: 0.247316512836345
Energy: 0.22553724145104112
Energy: 0.247316512836345
Energy: 0.22553724144852746
Energy: 0.247316512836345
Energy: 0.22553724144852746
Energy: 0.24869237796262664
Energy: 0.2711272396054171
Energy: 0.24869237796262664
Energy: 0.2711272396054171
Energy: 0.24869237796262664
Energy: 0.2711272396054171

minimum gb energy = 0.2245135942889816 eV
minimum distance =  2.61998142045868 Angstroms
sigma value = 17


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

Energy: 0.3142688565504426
Energy: 0.23426981031304775
Energy: 0.31426885654882486
Energy: 0.2342698103127242
Energy: 0.31426885654947195
Energy: 0.23426981031304775
Energy: 0.27248843300138187
Energy: 0.2292640865229739
Energy: 0.2724884330036468
Energy: 0.22926408652232674
Energy: 0.27248843300202896
Energy: 0.22926408652232674
Energy: 0.250643391033673
Energy: 0.24798049004287687
Energy: 0.2506433910330259
Energy: 0.24798049004287687
Energy: 0.2506433910333495
Energy: 0.24798049004287687
Energy: 0.29287683985546104
Energy: 0.24849396428773507
Energy: 0.2928768398561082
Energy: 0.24849396428773507
Energy: 0.2928768398551375
Energy: 0.24849396428773507
Energy: 0.2736714835468901
Energy: 0.22221087122909655
Energy: 0.27367148354559584
Energy: 0.22221087122909655
Energy: 0.27367148354721366
Energy: 0.22221087122909655
Energy: 0.2490796974314278
Energy: 0.23526476167585297
Energy: 0.2490796974323985
Energy: 0.2389917705268012
Energy: 0.2490796974323985
Energy: 0.23526476167585297
Energy: 0.23793337743962373
Energy: 0.2367572875943851
Energy: 0.2379333774405944
Energy: 0.23675728759535583
Energy: 0.23793337743832949
Energy: 0.23675728759470868
Energy: 0.28594674699597383
Energy: 0.28617954521974537
Energy: 0.2859467469950031
Energy: 0.28617954521974537
Energy: 0.28594674699467953
Energy: 0.28617954521974537
Energy: 0.24354649690926042
Energy: 0.24158427382962822
Energy: 0.24354649691087818
Energy: 0.24158427382962822
Energy: 0.24354649690926042
Energy: 0.24158427382962822
Energy: 0.23961620903688385
Energy: 0.2172884858338245
Energy: 0.2396162090372074
Energy: 0.2172884858338245
Energy: 0.23961620903623673
Energy: 0.21728848583414806
Energy: 0.26365928697790947
Energy: 0.28102384391247004
Energy: 0.2636592869766153
Energy: 0.28102384391247004
Energy: 0.26365928697790947
Energy: 0.28102384391214646
Energy: 0.24864040148788014
Energy: 0.2686093343551162
Energy: 0.24864040148626235
Energy: 0.2686093343547927
Energy: 0.2486404014875566
Energy: 0.2686093343551162
Energy: 0.25223962949468937
Energy: 0.22575911672886054
Energy: 0.2522396294940422
Energy: 0.22575911672853696
Energy: 0.2522396294950129
Energy: 0.22575911672918408
Energy: 0.22585192824721612
Energy: 0.2567942999224211
Energy: 0.22585192824721612
Energy: 0.2567942999220975
Energy: 0.22585192824721612
Energy: 0.2567942999224211
Energy: 0.24948607325857036
Energy: 0.2947870653062201
Energy: 0.24948607325630545
Energy: 0.2947870653062201
Energy: 0.24948607325662903
Energy: 0.2947870653062201
Energy: 0.21692909788502848
Energy: 0.246484772439551
Energy: 0.2169290978856756
Energy: 0.246484772439551
Energy: 0.21692909788535206
Energy: 0.246484772439551
Energy: 0.23233326782170685
Energy: 0.2385581840249416
Energy: 0.23233326781944194
Energy: 0.2385581840249416
Energy: 0.2323332678213833
Energy: 0.2385581840249416
Energy: 0.24820592526860003
Energy: 0.28928931887699755
Energy: 0.24820592526924715
Energy: 0.28928931887732107
Energy: 0.24820592526860003
Energy: 0.28928931887732107
Energy: 0.22867125795121346
Energy: 0.27101630159735446
Energy: 0.22867125794765428
Energy: 0.27101630159735446
Energy: 0.22867125795121346
Energy: 0.2710163015983251
Energy: 0.23145289212513115
Energy: 0.25312640608285336
Energy: 0.23145289212739606
Energy: 0.25312640608285336
Energy: 0.23145289212642534
Energy: 0.24258955872381785
Energy: 0.22860012688135314
Energy: 0.2712964488534802
Energy: 0.228600126880706
Energy: 0.27129644885153886
Energy: 0.228600126880706
Energy: 0.2712964488538038
Energy: 0.2481941419758861
Energy: 0.2893177596771087
Energy: 0.24819414197459186
Energy: 0.28931775967678514
Energy: 0.24819414197459186
Energy: 0.2893177596771087
Energy: 0.2324505710327975
Energy: 0.2385215861621383
Energy: 0.23245057103344463
Energy: 0.2385215861621383
Energy: 0.23245057103312103
Energy: 0.2385215861621383
Energy: 0.21695831165498183
Energy: 0.2712164113949168
Energy: 0.21695831165336402
Energy: 0.2712164113949168
Energy: 0.2169583116536876
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Energy: 0.24946532896755005
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Energy: 0.24946532896981496
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Energy: 0.2494653289672265
Energy: 0.2947042898480945
Energy: 0.22584188675669048
Energy: 0.2567457832020579
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Energy: 0.2567457832020579
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Energy: 0.2567457832020579
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Energy: 0.2522034024813187
Energy: 0.225406738664848
Energy: 0.25220340248067163
Energy: 0.22540673866581865
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Energy: 0.26501276873464935
Energy: 0.24866348507275096
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Energy: 0.2486634850724274
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Energy: 0.2811946194273881
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Energy: 0.2510625696184351
Energy: 0.23972442508621997
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Energy: 0.2510625696181115
Energy: 0.2435851529685369
Energy: 0.24182610428625687
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Energy: 0.24182610428625687
Energy: 0.24358515296918398
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Energy: 0.2859838525928835
Energy: 0.2863244466523516
Energy: 0.2859838525928835
Energy: 0.2863244466526752
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Energy: 0.2385029618852426
Energy: 0.23672607414512867
Energy: 0.23850296188297768
Energy: 0.23672607414545221
Energy: 0.238502961884919
Energy: 0.23672607414545221
Energy: 0.24919373795560731
Energy: 0.2239623311172061
Energy: 0.24919373795560731
Energy: 0.22396233111688255
Energy: 0.24919373795625446
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Energy: 0.27347493684948876
Energy: 0.22229976501465057
Energy: 0.2734749368485181
Energy: 0.22229976501432702
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Energy: 0.22229976501432702
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Energy: 0.238361521493311
Energy: 0.2928621201126477
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Energy: 0.2928621201126477
Energy: 0.23836152149363454
Energy: 0.2507684127720061
Energy: 0.24796744585766206
Energy: 0.2507684127726532
Energy: 0.24796744585798564
Energy: 0.25076841277232964
Energy: 0.24796744585766206
Energy: 0.27255317385928746
Energy: 0.21848705857412337
Energy: 0.27255317385928746
Energy: 0.21848705857347625
Energy: 0.27255317385831673
Energy: 0.21848705857412337
Energy: 0.31426885654655995
Energy: 0.2342698103133713
Energy: 0.3142688565455892
Energy: 0.23426981031401845
Energy: 0.31426885654720704
Energy: 0.2342698103133713
Energy: 0.2724884330007347
Energy: 0.22217106547409066
Energy: 0.2724884330036468
Energy: 0.22217106547409066
Energy: 0.27248843300138187
Energy: 0.22217106547376708
Energy: 0.25064339103723215
Energy: 0.24798049004093556
Energy: 0.2506433910378793
Energy: 0.24798049004125908
Energy: 0.2506433910369086
Energy: 0.24798049004093556
Energy: 0.2928768398557846
Energy: 0.25056298678078676
Energy: 0.29287683985707885
Energy: 0.2505629867804926
Energy: 0.2928768398557846
Energy: 0.2505629867804926
Energy: 0.2736714835465665
Energy: 0.2222108712310379
Energy: 0.27367148354559584
Energy: 0.2222108712310379
Energy: 0.27367148354591936
Energy: 0.22221087123136146

minimum gb energy = 0.21692909788502848 eV
minimum distance =  2.660358262874 Angstroms
sigma value = 57


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

Energy: 0.30850743254161705
Energy: 0.22134350088107457
Energy: 0.30850743254214386
Energy: 0.22134350088107457
Energy: 0.30850743254214386
Energy: 0.22134350088054774
Energy: 0.2550145480618065
Energy: 0.23707121185672372
Energy: 0.25501454806338697
Energy: 0.23707121185725058
Energy: 0.25501454806338697
Energy: 0.23707121185672372
Energy: 0.25104553574745986
Energy: 0.23504586434945957
Energy: 0.2510455357485135
Energy: 0.23504586434945957
Energy: 0.25104553574745986
Energy: 0.23504586434893274
Energy: 0.2903101873842738
Energy: 0.23870473371812267
Energy: 0.2903101873853275
Energy: 0.23870473371706902
Energy: 0.29031018738480063
Energy: 0.23870473371706902
Energy: 0.25549645981102503
Energy: 0.2034192148799937
Energy: 0.2554964598083909
Energy: 0.20341921487894007
Energy: 0.2554964598083909
Energy: 0.2034192148799937
Energy: 0.23163537254703678
Energy: 0.2173414613935025
Energy: 0.23163537254861727
Energy: 0.21734146139402932
Energy: 0.23163537254756364
Energy: 0.2173414613935025
Energy: 0.28822742561723524
Energy: 0.22755311606590123
Energy: 0.28822742561723524
Energy: 0.22755311606590123
Energy: 0.28822742561565473
Energy: 0.22755311606590123
Energy: 0.2761621791925343
Energy: 0.27187027675743636
Energy: 0.27616217919411473
Energy: 0.2718702767569095
Energy: 0.27616217919411473
Energy: 0.2718702767569095
Energy: 0.2209450434474927
Energy: 0.21789099362719694
Energy: 0.22094504344538535
Energy: 0.21789099362667008
Energy: 0.2209450434474927
Energy: 0.21789099362719694
Energy: 0.2248723860920643
Energy: 0.2204011725961706
Energy: 0.22487238609153753
Energy: 0.2204011725961706
Energy: 0.22487238609048385
Energy: 0.2204011725961706
Energy: 0.2841451661137129
Energy: 0.27179461278991335
Energy: 0.28414516611270707
Energy: 0.27179461278991335
Energy: 0.28414516611270707
Energy: 0.27179461278991335
Energy: 0.2288023947382706
Energy: 0.25313533627590207
Energy: 0.22880239473774375
Energy: 0.25313533627642887
Energy: 0.22880239473774375
Energy: 0.2531353362769557
Energy: 0.22406096255764482
Energy: 0.239866277260428
Energy: 0.22406096255869848
Energy: 0.239866277260428
Energy: 0.22406096255817162
Energy: 0.23986627726095483
Energy: 0.20636720817573842
Energy: 0.2581679150312366
Energy: 0.20636720817679208
Energy: 0.2581679150312366
Energy: 0.20636720817731893
Energy: 0.2581679150307098
Energy: 0.2421617039397632
Energy: 0.29418603592558573
Energy: 0.24216170393765582
Energy: 0.2941860359261126
Energy: 0.24216170393923633
Energy: 0.29418603592558573
Energy: 0.2223477333760749
Energy: 0.2562194095401237
Energy: 0.2223477333760749
Energy: 0.2562194095395969
Energy: 0.2223477333760749
Energy: 0.2562194095395969
Energy: 0.22789217931179753
Energy: 0.2568772376318068
Energy: 0.22789217931074388
Energy: 0.2568772376318068
Energy: 0.22789217931074388
Energy: 0.25687723763127995
Energy: 0.2399865167728327
Energy: 0.2932133644592037
Energy: 0.2399865167733595
Energy: 0.2932133644592037
Energy: 0.2399865167733595
Energy: 0.2932133644592037
Energy: 0.21088219784739354
Energy: 0.2696711378355697
Energy: 0.2108821978505545
Energy: 0.2696711378355697
Energy: 0.21088219784950088
Energy: 0.2696711378355697
Energy: 0.21323751319110046
Energy: 0.23270429196744222
Energy: 0.21323751319057366
Energy: 0.23270429196744222
Energy: 0.21323751319004683
Energy: 0.23270429196796902
Energy: 0.2459920880479359
Energy: 0.2815555750736315
Energy: 0.24599208805004324
Energy: 0.2815555750741104
Energy: 0.24599208804740907
Energy: 0.2815555750741104
Energy: 0.21759929957900082
Energy: 0.2685494234965426
Energy: 0.21759929957583984
Energy: 0.26854942349706945
Energy: 0.21759929957900082
Energy: 0.2685494234965426
Energy: 0.22197190702672995
Energy: 0.230528023780339
Energy: 0.22197190702620312
Energy: 0.23052802377981216
Energy: 0.22197190702672995
Energy: 0.23052802377981216
Energy: 0.2315231382081857
Energy: 0.2826944918708313
Energy: 0.23152313820713205
Energy: 0.2826944918708313
Energy: 0.2315231382081857
Energy: 0.2826944918708313
Energy: 0.23453749727313686
Energy: 0.2853838851210014
Energy: 0.23453749727155634
Energy: 0.2853838851210014
Energy: 0.23453749727313686
Energy: 0.28538388512152824
Energy: 0.2228030635980921
Energy: 0.23084339843965065
Energy: 0.2228030635986189
Energy: 0.2308433984401775
Energy: 0.22280306359914576
Energy: 0.23084339843965065
Energy: 0.21497254349753073
Energy: 0.26872199333451374
Energy: 0.21497254349278921
Energy: 0.26872199333451374
Energy: 0.21497254349278921
Energy: 0.2687219933339869

minimum gb energy = 0.20341921487894007 eV
minimum distance =  2.63100623849969 Angstroms
sigma value = 43


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

Energy: 0.2847414425918452
Energy: 0.20027646428259552
Energy: 0.2847414425926129
Energy: 0.20027646428336324
Energy: 0.2847414425926129
Energy: 0.20027646428259552
Energy: 0.22394050410100594
Energy: 0.19226971167252485
Energy: 0.22394050410062208
Energy: 0.19226971167214105
Energy: 0.22394050410100594
Energy: 0.1922697116729087
Energy: 0.2186912103101052
Energy: 0.20725516661846402
Energy: 0.2186912103108729
Energy: 0.20725516661846402
Energy: 0.2186912103108729
Energy: 0.20725516661846402
Energy: 0.2680266291045002
Energy: 0.20771625269400432
Energy: 0.2680266291045002
Energy: 0.20771625269400432
Energy: 0.2680266291045002
Energy: 0.20771625269400432
Energy: 0.22435335896959524
Energy: 0.17843547475244237
Energy: 0.2243533589692114
Energy: 0.17843547475359392
Energy: 0.2243533589684437
Energy: 0.1784354747532101
Energy: 0.20031599234956243
Energy: 0.18842158096446257
Energy: 0.200315992350714
Energy: 0.18842158096407874
Energy: 0.2003159923510979
Energy: 0.18842158096407874
Energy: 0.25759601782645797
Energy: 0.19608135114078307
Energy: 0.25759601782645797
Energy: 0.19608135114001538
Energy: 0.2575960178272257
Energy: 0.19608135113963152
Energy: 0.22512874285273773
Energy: 0.17867178733528213
Energy: 0.22512874285388929
Energy: 0.17867178733451441
Energy: 0.2251287428535054
Energy: 0.17867178733451441
Energy: 0.1985749473968428
Energy: 0.19009922659901643
Energy: 0.19857494739645898
Energy: 0.19009922659863257
Energy: 0.1985749473979944
Energy: 0.19009922659863257
Energy: 0.2157629967054558
Energy: 0.1909631250106314
Energy: 0.21576299670622354
Energy: 0.19096312501024754
Energy: 0.21576299670622354
Energy: 0.19096312501101523
Energy: 0.2431543982978223
Energy: 0.1892051273605628
Energy: 0.24315439829743843
Energy: 0.18920512736017897
Energy: 0.2431543982978223
Energy: 0.18920512736094663
Energy: 0.19164729295938837
Energy: 0.1907247089016514
Energy: 0.19164729295938837
Energy: 0.19072470890203527
Energy: 0.19164729295938837
Energy: 0.1907247089016514
Energy: 0.21136289528133154
Energy: 0.19030417456469012
Energy: 0.21136289528171542
Energy: 0.19030417456507398
Energy: 0.21136289528209926
Energy: 0.1903041745654578
Energy: 0.2471726738748999
Energy: 0.24277714846016366
Energy: 0.24717267387528377
Energy: 0.24277714846016366
Energy: 0.24717267387451605
Energy: 0.24277714845977982
Energy: 0.19515810300188993
Energy: 0.19016194369884476
Energy: 0.19515810300035455
Energy: 0.19016194369884476
Energy: 0.19515810300227382
Energy: 0.19016194369846093
Energy: 0.19392156160412843
Energy: 0.20192035975973596
Energy: 0.1939215616048961
Energy: 0.2019203597593521
Energy: 0.19392156160374455
Energy: 0.2019203597593521
Energy: 0.19289141215963382
Energy: 0.24074565677895535
Energy: 0.19289141215925
Energy: 0.24074565677857146
Energy: 0.19289141215925
Energy: 0.24074565677857146
Energy: 0.19771889048457614
Energy: 0.24919932185496857
Energy: 0.19771889048342456
Energy: 0.24919932185535246
Energy: 0.19771889048419228
Energy: 0.24919932185496857
Energy: 0.18191417502948806
Energy: 0.20758355688788635
Energy: 0.1819141750291042
Energy: 0.20758355688788635
Energy: 0.1819141750291042
Energy: 0.20758355688788635
Energy: 0.18282309647728157
Energy: 0.22176055269619072
Energy: 0.18282309647766543
Energy: 0.22176055269657452
Energy: 0.18282309647766543
Energy: 0.2217605526969584
Energy: 0.21475343056616017
Energy: 0.28100816097623355
Energy: 0.21475343056577634
Energy: 0.28100816097623355
Energy: 0.21475343056577634
Energy: 0.28100816097623355
Energy: 0.21044261701960182
Energy: 0.22493311645480202
Energy: 0.21044261702075337
Energy: 0.22493311645441813
Energy: 0.210442617019218
Energy: 0.22493311645441813
Energy: 0.19372895957770728
Energy: 0.22423915792623358
Energy: 0.19372895957885883
Energy: 0.22423915792623358
Energy: 0.1937289595780911
Energy: 0.22423915792623358
Energy: 0.21126245194113855
Energy: 0.28049028834748957
Energy: 0.21126245193960316
Energy: 0.28049028834710577
Energy: 0.211262451939987
Energy: 0.28049028834710577
Energy: 0.18032957744669495
Energy: 0.22650588517025622
Energy: 0.18032957744707878
Energy: 0.22650588517025622
Energy: 0.18032957744669495
Energy: 0.2265058851706052
Energy: 0.1871500085965148
Energy: 0.2057217728980711
Energy: 0.18715000859421166
Energy: 0.2057217728980711
Energy: 0.18715000859613093
Energy: 0.2057217728980711
Energy: 0.20969583129844332
Energy: 0.265733419750213
Energy: 0.20433117144133967
Energy: 0.265733419750213
Energy: 0.20969583129882716
Energy: 0.2657334197505968
Energy: 0.17618323089645344
Energy: 0.2249517558486981
Energy: 0.17618323089568574
Energy: 0.22495175584946578
Energy: 0.17618323089645344
Energy: 0.22495175584908197
Energy: 0.1871645683891716
Energy: 0.19749309065305048
Energy: 0.1871645683891716
Energy: 0.19749309065305048
Energy: 0.18716456838878776
Energy: 0.19749309065305048
Energy: 0.1951951046605802
Energy: 0.2574440255057458
Energy: 0.19519510466249948
Energy: 0.25744402550536194
Energy: 0.1951951046628833
Energy: 0.2574440255057458
Energy: 0.17838057774631622
Energy: 0.22524555604721094
Energy: 0.1783805777455485
Energy: 0.2252455560483625
Energy: 0.1783805777470839
Energy: 0.22524555605104948
Energy: 0.18717557307888733
Energy: 0.1997971301190023
Energy: 0.18717557307888733
Energy: 0.1997971301190023
Energy: 0.18717557307888733
Energy: 0.19979713011938613
Energy: 0.18989672924491316
Energy: 0.2585666642686762
Energy: 0.18989672924606477
Energy: 0.2585666642686762
Energy: 0.1898967292445293
Energy: 0.2585666642690601
Energy: 0.19575841743778535
Energy: 0.24445149088920493
Energy: 0.1957584174370176
Energy: 0.24445149088920493
Energy: 0.19575841743778535
Energy: 0.24445149088920493
Energy: 0.19376556642992884
Energy: 0.22666962163166826
Energy: 0.19376556642954496
Energy: 0.22666962163166826
Energy: 0.19376556642916112
Energy: 0.22666962163166826
Energy: 0.1785683486855326
Energy: 0.2163240495782885
Energy: 0.1785683486839972
Energy: 0.21632404957790463
Energy: 0.17856834868514876
Energy: 0.2163240495782885

minimum gb energy = 0.17618323089568574 eV
minimum distance =  2.62025588883712 Angstroms
sigma value = 81


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

Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.1355971748591444
Energy: 0.029466518050654
Energy: 0.1355971748591444
Energy: 0.029466518049243638
Energy: 0.1355971748591444
Energy: 0.029466518050654
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.02863601273044934
Energy: 0.04864048433417837
Energy: 0.02863601273044934
Energy: 0.04864048433417837
Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.1355971748591444
Energy: 0.029466518049243638
Energy: 0.1355971748591444
Energy: 0.029466518050654
Energy: 0.1355971748591444
Energy: 0.029466518050654
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.13559948776810046
Energy: 0.029520430869779304
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.028636012729038974
Energy: 0.04864048433417837
Energy: 0.1355971748591444
Energy: 0.029466518050654
Energy: 0.1355971748591444
Energy: 0.029466518049243638
Energy: 0.1355971748591444
Energy: 0.029466518050654
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.13559948776810046
Energy: 0.02952043087118967
Energy: 0.02863601273044934
Energy: 0.04864048433417837
Energy: 0.02863601273044934
Energy: 0.04864048433417837
Energy: 0.02863601273044934
Energy: 0.04864048433417837

minimum gb energy = 0.028636012729038974 eV
minimum distance =  2.83485948410395 Angstroms
sigma value = 3


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

Energy: 0.2544506192088436
Energy: 0.18271914952810486
Energy: 0.25445061920926565
Energy: 0.18271914952810486
Energy: 0.2544506192088436
Energy: 0.18271914952810486
Energy: 0.19919655448840226
Energy: 0.19285983313962915
Energy: 0.19919655448755816
Energy: 0.19285983313962915
Energy: 0.19919655448755816
Energy: 0.19285983313962915
Energy: 0.22076209046653353
Energy: 0.19352249856461376
Energy: 0.23288119156831302
Energy: 0.19352249856461376
Energy: 0.21992889920262804
Energy: 0.19352249856419174
Energy: 0.23858908032782508
Energy: 0.1867572986562336
Energy: 0.23858908032824716
Energy: 0.18675729865581156
Energy: 0.23858908032740306
Energy: 0.1867572986562336
Energy: 0.17056442963927182
Energy: 0.20098207976779162
Energy: 0.17056442963842772
Energy: 0.20098207976779162
Energy: 0.17056442963927182
Energy: 0.2009820797682137
Energy: 0.20583472687717796
Energy: 0.21057063195396505
Energy: 0.2058347268767559
Energy: 0.21057063195396505
Energy: 0.20583472687717796
Energy: 0.21057063195396505
Energy: 0.21994313622582928
Energy: 0.19088584990090388
Energy: 0.21994313622540723
Energy: 0.19088584990090388
Energy: 0.21994313622582928
Energy: 0.19088584990090388
Energy: 0.1721839834658688
Energy: 0.2002920824796212
Energy: 0.1721839834658688
Energy: 0.20029208248004324
Energy: 0.17218398346629088
Energy: 0.20029208248004324
Energy: 0.20995740127366652
Energy: 0.21451598861233656
Energy: 0.20995740127366652
Energy: 0.21451598861233656
Energy: 0.20995740127408857
Energy: 0.2145159886127586
Energy: 0.19974833032915265
Energy: 0.18538594066457156
Energy: 0.1997483303295747
Energy: 0.18538594066457156
Energy: 0.19974833032915265
Energy: 0.18538594066457156
Energy: 0.17830534219300462
Energy: 0.21875131570063142
Energy: 0.17830534219216052
Energy: 0.21875131570063142
Energy: 0.17830534219300462
Energy: 0.21875131570063142
Energy: 0.21854912640295845
Energy: 0.22406197787522858
Energy: 0.21854912640295845
Energy: 0.22406197787522858
Energy: 0.21854912640380256
Energy: 0.22406197787522858
Energy: 0.19314576448260212
Energy: 0.1782620017474544
Energy: 0.19314576448218007
Energy: 0.17826200174703236
Energy: 0.19314576448260212
Energy: 0.1782620017466103
Energy: 0.19276365619028624
Energy: 0.224660113536146
Energy: 0.1927636561898642
Energy: 0.224660113536146
Energy: 0.19276365618944213
Energy: 0.224660113536146
Energy: 0.21195258287149668
Energy: 0.21904079413855082
Energy: 0.2119525828719187
Energy: 0.21904079413855082
Energy: 0.2119525828719187
Energy: 0.21904079413855082
Energy: 0.17814048235694946
Energy: 0.17156354496868534
Energy: 0.17814048235779356
Energy: 0.17156354496741916
Energy: 0.1781404823565274
Energy: 0.17156354496741916
Energy: 0.19391344732532131
Energy: 0.2270780425966393
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Energy: 0.22707804259706132
Energy: 0.19408042580700782
Energy: 0.2070342098332034
Energy: 0.19408042580700782
Energy: 0.2070342098332034
Energy: 0.19408042580700782
Energy: 0.2070342098332034
Energy: 0.1941235454621522
Energy: 0.17116758292591072
Energy: 0.1941235454613081
Energy: 0.17116758292591072
Energy: 0.19412354546173013
Energy: 0.1711675829263328
Energy: 0.19001313138335424
Energy: 0.23851176691144413
Energy: 0.1900131313837763
Energy: 0.23851176691144413
Energy: 0.1900131313837763
Energy: 0.23851176691144413
Energy: 0.19644586929689967
Energy: 0.1985022581951667
Energy: 0.19644586929647764
Energy: 0.1985022581951667
Energy: 0.19644586929732175
Energy: 0.1985022581951667
Energy: 0.17724989609537786
Energy: 0.20683620692030028
Energy: 0.17724989609537786
Energy: 0.20683620692030028
Energy: 0.17724989609537786
Energy: 0.20683620692030028
Energy: 0.19747541621077735
Energy: 0.2397166685020987
Energy: 0.19747541621119935
Energy: 0.2397166685020987
Energy: 0.19747541621077735
Energy: 0.2397166685016766
Energy: 0.20092677859446087
Energy: 0.16862176875714638
Energy: 0.20092677859403885
Energy: 0.1686217687588346
Energy: 0.20092677859403885
Energy: 0.16862176875756843
Energy: 0.2100936692740028
Energy: 0.18828731835246923
Energy: 0.2100936692735807
Energy: 0.18828731835246923
Energy: 0.2100936692740028
Energy: 0.18828731835204718
Energy: 0.19122001085816517
Energy: 0.21924592987348662
Energy: 0.19122001085689902
Energy: 0.21924592987348662
Energy: 0.19122001085816517
Energy: 0.21924592987348662
Energy: 0.22200196396736813
Energy: 0.16965962522727698
Energy: 0.22200196396779015
Energy: 0.16965962522727698
Energy: 0.2220019639669461
Energy: 0.16965962522769906
Energy: 0.22104719224186808
Energy: 0.21447719795493403
Energy: 0.22104719224229016
Energy: 0.214477197954512
Energy: 0.22104719224229016
Energy: 0.21447719795493403
Energy: 0.18915462439002403
Energy: 0.19220789672107444
Energy: 0.18915462439002403
Energy: 0.19220789672107444
Energy: 0.18915462439002403
Energy: 0.19220789672107444
Energy: 0.23188633694369426
Energy: 0.17541130095370597
Energy: 0.23188633694285016
Energy: 0.17541130095370597
Energy: 0.23188633694327218
Energy: 0.17541130095370597
Energy: 0.2235118385198737
Energy: 0.20934480548630052
Energy: 0.22351183852027656
Energy: 0.20934480548630052
Energy: 0.2235118385198737
Energy: 0.20934480548630052
Energy: 0.18149875582304914
Energy: 0.17630111265502812
Energy: 0.18149875582389322
Energy: 0.17630111265460605
Energy: 0.1814987558234712
Energy: 0.17630111265502812
Energy: 0.23104993140441724
Energy: 0.1899400021666116
Energy: 0.23104993140483931
Energy: 0.1899400021666116
Energy: 0.23104993140441724
Energy: 0.1899400021666116

minimum gb energy = 0.16862176875714638 eV
minimum distance =  2.65348370224421 Angstroms
sigma value = 67


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

Energy: 0.26913854211610033
Energy: 0.24203382238835117
Energy: 0.26913854211610033
Energy: 0.24203382238835117
Energy: 0.26913854211610033
Energy: 0.24203382238835117
Energy: 0.2344639106387571
Energy: 0.23405415508610775
Energy: 0.23446391063815572
Energy: 0.23405415508670915
Energy: 0.23446391063815572
Energy: 0.23405415508670915
Energy: 0.2528147997505826
Energy: 0.23483063931329556
Energy: 0.2528147997493798
Energy: 0.23483063931329556
Energy: 0.2528147997505826
Energy: 0.23483063931329556
Energy: 0.2564405327001583
Energy: 0.23893830238628064
Energy: 0.2564405326995569
Energy: 0.23893830238628064
Energy: 0.2564405326995569
Energy: 0.23893830238567929
Energy: 0.20940597132592648
Energy: 0.23494507987762472
Energy: 0.20940597132532512
Energy: 0.23494507987702332
Energy: 0.20940597132592648
Energy: 0.23494507987702332
Energy: 0.24833919336402702
Energy: 0.2512258588680515
Energy: 0.24833919336282426
Energy: 0.2512258588686529
Energy: 0.24833919336282426
Energy: 0.2512258588686529
Energy: 0.23908104568864796
Energy: 0.22852223192408933
Energy: 0.23908104568924934
Energy: 0.22852223192469073
Energy: 0.23908104569045213
Energy: 0.22852223192469073
Energy: 0.22657843913563652
Energy: 0.23235638903372008
Energy: 0.22657843913563652
Energy: 0.2323563890343215
Energy: 0.22657843913623787
Energy: 0.23235638903372008
Energy: 0.23064712134791307
Energy: 0.2594674581762153
Energy: 0.23064712134971718
Energy: 0.2594674581762153
Energy: 0.23064712134971718
Energy: 0.2594674581762153
Energy: 0.2346584442163151
Energy: 0.21623511271411733
Energy: 0.2346584442163151
Energy: 0.21623511271411733
Energy: 0.2346584442163151
Energy: 0.2162351127147187
Energy: 0.23327604585893713
Energy: 0.25811931725993076
Energy: 0.23327604585893713
Energy: 0.25811931725993076
Energy: 0.2332760458595385
Energy: 0.25811931725993076
Energy: 0.23387948016090448
Energy: 0.24678053108756232
Energy: 0.23387948015970172
Energy: 0.24678053108756232
Energy: 0.23387948016090448
Energy: 0.24678053108756232
Energy: 0.24530832814956408
Energy: 0.20752341017151404
Energy: 0.2453083281489627
Energy: 0.20752341017091266
Energy: 0.24530832814956408
Energy: 0.2075234101697099
Energy: 0.22885129274303764
Energy: 0.26705448438728263
Energy: 0.22885129274363902
Energy: 0.26705448438728263
Energy: 0.22885129274243626
Energy: 0.26705448438728263
Energy: 0.23086956990886148
Energy: 0.2333040054279945
Energy: 0.23086956990765872
Energy: 0.2333040054279945
Energy: 0.23086956990826007
Energy: 0.2333040054279945
Energy: 0.22022420987590227
Energy: 0.2410755187876359
Energy: 0.22022420987650365
Energy: 0.2410755187876359
Energy: 0.22022420987590227
Energy: 0.2410755187876359
Energy: 0.2318240312363071
Energy: 0.2584310673601048
Energy: 0.23182403123570572
Energy: 0.2584310673601048
Energy: 0.2318240312369085
Energy: 0.2584310673601048
Energy: 0.23606216218555795
Energy: 0.20741413725900407
Energy: 0.23606216218615933
Energy: 0.20741413725900407
Energy: 0.23606216218555795
Energy: 0.20741413725900407
Energy: 0.25297750634655053
Energy: 0.25275903248105386
Energy: 0.25297750634534777
Energy: 0.25275903248165527
Energy: 0.25297750634534777
Energy: 0.25275903248105386
Energy: 0.20736173092856228
Energy: 0.23427158454562413
Energy: 0.20736173092735952
Energy: 0.23427158454502273
Energy: 0.20736173092796087
Energy: 0.23427158454562413
Energy: 0.25651484841654093
Energy: 0.23955825385546428
Energy: 0.2565148484159395
Energy: 0.23955825385546428
Energy: 0.25651484841654093
Energy: 0.23955825385546428
Energy: 0.26221615081316907
Energy: 0.2683837331288314
Energy: 0.26221615081256766
Energy: 0.2683837331288314
Energy: 0.26221615081256766
Energy: 0.2683837331288314
Energy: 0.2186857626369023
Energy: 0.246659936880884
Energy: 0.21868576263810505
Energy: 0.246659936880884
Energy: 0.21868576263810505
Energy: 0.24665993688148538

minimum gb energy = 0.20736173092735952 eV
minimum distance =  2.65668269452455 Angstroms
sigma value = 33


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

Energy: 0.27899153903913027
Energy: 0.24506779755306207
Energy: 0.2789915390395117
Energy: 0.24506779755306207
Energy: 0.27899153903913027
Energy: 0.24506779755306207
Energy: 0.24600386459194962
Energy: 0.2564615843042067
Energy: 0.24600386459194962
Energy: 0.2564615843042067
Energy: 0.24600386459233115
Energy: 0.2564615843038252
Energy: 0.2678899776797192
Energy: 0.2642318565876398
Energy: 0.26788997767857475
Energy: 0.2642318565880213
Energy: 0.2678899776797192
Energy: 0.2642318565880213
Energy: 0.27078067647470366
Energy: 0.2498988252176652
Energy: 0.2707806764766112
Energy: 0.2498988252176652
Energy: 0.2707806764754667
Energy: 0.2498988252176652
Energy: 0.24770529432761565
Energy: 0.2615866596613638
Energy: 0.24770529432647112
Energy: 0.2615866596617452
Energy: 0.24770529432685265
Energy: 0.2615866596613638
Energy: 0.27822287797767253
Energy: 0.2801223074378661
Energy: 0.27822287797652806
Energy: 0.28012230743748456
Energy: 0.27822287797767253
Energy: 0.28012230743748456
Energy: 0.25229293327641167
Energy: 0.2420829352896952
Energy: 0.2522929332748856
Energy: 0.2420829352900767
Energy: 0.25229293327641167
Energy: 0.2420829352900767
Energy: 0.2612332009002764
Energy: 0.27936127572565783
Energy: 0.2612332009006579
Energy: 0.27936127572565783
Energy: 0.2612332008998949
Energy: 0.2793612757260394
Energy: 0.25182296441088764
Energy: 0.2739833537048904
Energy: 0.25182296441203217
Energy: 0.273983353705272
Energy: 0.25182296441203217
Energy: 0.27398335370565347
Energy: 0.2697209676594597
Energy: 0.26295436291052754
Energy: 0.2697209676606042
Energy: 0.262954362910146
Energy: 0.2697209676594597
Energy: 0.262954362910146
Energy: 0.2651411694481261
Energy: 0.2778861865972101
Energy: 0.26514116944774463
Energy: 0.2778861865972101
Energy: 0.26514116944927063
Energy: 0.2778861865975916
Energy: 0.25037695226964857
Energy: 0.25508365677672923
Energy: 0.2503769522681226
Energy: 0.25508365677711065
Energy: 0.25037695226926715
Energy: 0.25508365677711065
Energy: 0.27600233470839053
Energy: 0.2498476213637435
Energy: 0.27600233470533847
Energy: 0.24984762136412503
Energy: 0.276002334707246
Energy: 0.2498476213637435
Energy: 0.2572875603399818
Energy: 0.26540369284002185
Energy: 0.25728756034074485
Energy: 0.26540369284040344
Energy: 0.2572875603399818
Energy: 0.26540369284040344
Energy: 0.2527101733507894
Energy: 0.25647087682729097
Energy: 0.25271017335117085
Energy: 0.25647087682729097
Energy: 0.25271017335117085
Energy: 0.25647087682729097
Energy: 0.270697695659532
Energy: 0.25723157946995195
Energy: 0.2706976956583875
Energy: 0.25723157946995195
Energy: 0.27069769565991353
Energy: 0.25723157947071495
Energy: 0.24063107253938557
Energy: 0.26476483534605255
Energy: 0.2406310725386572
Energy: 0.26476483534605255
Energy: 0.24063107253938557
Energy: 0.26476483534605255
Energy: 0.2771938402173751
Energy: 0.2668237217069473
Energy: 0.27719384021699356
Energy: 0.2668237217069473
Energy: 0.27719384021775656
Energy: 0.2668237217069473
Energy: 0.24739418939197774
Energy: 0.24821089026928564
Energy: 0.2473941893908332
Energy: 0.2482108902666151
Energy: 0.24739418939197774
Energy: 0.2482108902669966
Energy: 0.2530780443844341
Energy: 0.2556232380344749
Energy: 0.25307804438214504
Energy: 0.2556232380344749
Energy: 0.2530780443836711
Energy: 0.25562323803485637
Energy: 0.2723239211219065
Energy: 0.2655024836474221
Energy: 0.27232392112381404
Energy: 0.2655024836474221
Energy: 0.27232392112152504
Energy: 0.26550248364704065
Energy: 0.2545992912400909
Energy: 0.23025704674825026
Energy: 0.2545992912362759
Energy: 0.23025704674825026
Energy: 0.2545992912393279
Energy: 0.23025704674786882
Energy: 0.2619478230886868
Energy: 0.27787928636665016
Energy: 0.2619478230883053
Energy: 0.27787928636665016
Energy: 0.2619478230883053
Energy: 0.27787928636665016
Energy: 0.2702255004338809
Energy: 0.2562264914074092
Energy: 0.27022550043540694
Energy: 0.25622649140702775
Energy: 0.27022550043464394
Energy: 0.25622649140702775
Energy: 0.25267598953853526
Energy: 0.25429684923005935
Energy: 0.2526759895400613
Energy: 0.25429684923005935
Energy: 0.2526759895389168
Energy: 0.25429684922967777
Energy: 0.2639562545134145
Energy: 0.2771570781767523
Energy: 0.26395625451226995
Energy: 0.2771570781767523
Energy: 0.26395625451379595
Energy: 0.27715707817637075
Energy: 0.2522714798083044
Energy: 0.2278796780137856
Energy: 0.252271479809449
Energy: 0.2278796780130226
Energy: 0.2522714798090674
Energy: 0.2278796780137856
Energy: 0.2552867402977689
Energy: 0.27451576017424995
Energy: 0.25528674029815035
Energy: 0.27451576017424995
Energy: 0.25528674029738735
Energy: 0.2745157601746315
Energy: 0.25789168508025334
Energy: 0.26198241786374066
Energy: 0.25789168508216087
Energy: 0.26198241786374066
Energy: 0.25789168508216087
Energy: 0.26198241786374066
Energy: 0.2499309027299095
Energy: 0.23986869918148715
Energy: 0.249930902729528
Energy: 0.23986869918110565
Energy: 0.24993090273029103
Energy: 0.23986869918072412
Energy: 0.27521709305356573
Energy: 0.28394587508997216
Energy: 0.27521709305394726
Energy: 0.28394587508997216
Energy: 0.27521709305471026
Energy: 0.2839458750903536
Energy: 0.24254072879051458
Energy: 0.2550143752356449
Energy: 0.24254072878784405
Energy: 0.2550143752356449
Energy: 0.24254072878898852
Energy: 0.2550143752356449
Energy: 0.26956542960563457
Energy: 0.2570895357709608
Energy: 0.26956542960639757
Energy: 0.2570895357709608
Energy: 0.26956542960525304
Energy: 0.25708953577134225
Energy: 0.25303585525627903
Energy: 0.2566236096212993
Energy: 0.25303585525666056
Energy: 0.2566236096212993
Energy: 0.25303585525666056
Energy: 0.2566236096209178
Energy: 0.25556384482637534
Energy: 0.26467680054570086
Energy: 0.2555638448244678
Energy: 0.26467680054531934
Energy: 0.2555638448256123
Energy: 0.26467680054570086
Energy: 0.28006403290838155
Energy: 0.2426186787426467
Energy: 0.2800640329068555
Energy: 0.2426186787426467
Energy: 0.2800640329072371
Energy: 0.2426186787426467
Energy: 0.24733554186380613
Energy: 0.24972952324566003
Energy: 0.2473355418630431
Energy: 0.24972952324566003
Energy: 0.24733554186342463
Energy: 0.24972952324527858

minimum gb energy = 0.2278796780130226 eV
minimum distance =  2.62722352220885 Angstroms
sigma value = 41


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

Energy: 0.29941192568334696
Energy: 0.30251832232299974
Energy: 0.29941192568334696
Energy: 0.30251832232299974
Energy: 0.29941192568334696
Energy: 0.30251832232299974
Energy: 0.28785361393177805
Energy: 0.30305642473801475
Energy: 0.28785361393177805
Energy: 0.30305642473801475
Energy: 0.28785361393177805
Energy: 0.30305642473801475
Energy: 0.3300268119498977
Energy: 0.3009261342974394
Energy: 0.3259176792480198
Energy: 0.3009261342984811
Energy: 0.31462291653824953
Energy: 0.3009261342984811
Energy: 0.3027143616187331
Energy: 0.2956872837984453
Energy: 0.3027143616187331
Energy: 0.2956872837984453
Energy: 0.3027143616187331
Energy: 0.2956872837984453
Energy: 0.2787070298695548
Energy: 0.30304895093860995
Energy: 0.2787070298705964
Energy: 0.30304895093860995
Energy: 0.2787070298695548
Energy: 0.30304895093860995
Energy: 0.32159568677039957
Energy: 0.31204910232694133
Energy: 0.32159568676935796
Energy: 0.31204910232694133
Energy: 0.32159568676935796
Energy: 0.31204910232694133
Energy: 0.30204780962371836
Energy: 0.28908706672087314
Energy: 0.30204780962371836
Energy: 0.28908706672087314
Energy: 0.30204780962371836
Energy: 0.2890870667198315
Energy: 0.2960503518605121
Energy: 0.30278655715294
Energy: 0.2960503518594705
Energy: 0.30278655715294
Energy: 0.2960503518605121
Energy: 0.30278655715294
Energy: 0.2906438707318883
Energy: 0.2825574342336927
Energy: 0.2906438707318883
Energy: 0.2825574342336927
Energy: 0.2906438707318883
Energy: 0.2825574342336927
Energy: 0.30116083677087596
Energy: 0.297302777779625
Energy: 0.3011608367719176
Energy: 0.297302777779625
Energy: 0.3011608367719176
Energy: 0.297302777779625
Energy: 0.2894938577386817
Energy: 0.30311602775185137
Energy: 0.28949385773764
Energy: 0.30311602775080976
Energy: 0.28949385773764
Energy: 0.30311602775080976
Energy: 0.2969142517449755
Energy: 0.3054769573149615
Energy: 0.2969142517439338
Energy: 0.3054769573149615
Energy: 0.2969142517449755
Energy: 0.3054769573149615
Energy: 0.3115532308522989
Energy: 0.30499176297110264
Energy: 0.3115532308522989
Energy: 0.30499176297110264
Energy: 0.3115532308522989
Energy: 0.30499176297110264
Energy: 0.28183528930210194
Energy: 0.30321866610893305
Energy: 0.28183528930210194
Energy: 0.30321866610893305
Energy: 0.28183528930210194
Energy: 0.30321866610893305

minimum gb energy = 0.2787070298695548 eV
minimum distance =  2.58741736745094 Angstroms
sigma value = 11


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

Energy: 0.33414854070309546
Energy: 0.33776731756652034
Energy: 0.33414854070309546
Energy: 0.33776731756652034
Energy: 0.33414854070309546
Energy: 0.33776731756697786
Energy: 0.3110910663822632
Energy: 0.32760137383107146
Energy: 0.31109106638317835
Energy: 0.32760137383107146
Energy: 0.31109106638272077
Energy: 0.32760137383107146
Energy: 0.34126521204310684
Energy: 0.32562309328593964
Energy: 0.3550749478265455
Energy: 0.32562309328593964
Energy: 0.34126521204264926
Energy: 0.32562309328593964
Energy: 0.3265430261789083
Energy: 0.32330021680579935
Energy: 0.3265430261789083
Energy: 0.32330021680534177
Energy: 0.32654302617936587
Energy: 0.32330021680534177
Energy: 0.317516866769249
Energy: 0.3308379354232503
Energy: 0.317516866769249
Energy: 0.3308379354232503
Energy: 0.31751686676879143
Energy: 0.3308379354232503
Energy: 0.31966397090087856
Energy: 0.33963763964255267
Energy: 0.31966397090087856
Energy: 0.33963763964255267
Energy: 0.319663970900421
Energy: 0.33963763964255267
Energy: 0.3237409840375897
Energy: 0.32324957781952246
Energy: 0.3237409840375897
Energy: 0.32324957781952246
Energy: 0.3237409840375897
Energy: 0.32324957781952246
Energy: 0.31942835583661017
Energy: 0.32639125414501674
Energy: 0.3194283558361526
Energy: 0.32639125414547426
Energy: 0.319428355835695
Energy: 0.32639125414547426
Energy: 0.3177600238833494
Energy: 0.3223938227238484
Energy: 0.3177600238828919
Energy: 0.3223938227238484
Energy: 0.3177600238833494
Energy: 0.3223938227238484
Energy: 0.3240921641826076
Energy: 0.32917053085055764
Energy: 0.32409216418215003
Energy: 0.3291705308510152
Energy: 0.32409216418215003
Energy: 0.32917053085055764
Energy: 0.3168115642125085
Energy: 0.3230952561044174
Energy: 0.3168115642120509
Energy: 0.32309525610487505
Energy: 0.3168115642125085
Energy: 0.32309525610395984
Energy: 0.32278069559037315
Energy: 0.3394189870228583
Energy: 0.32278069558991557
Energy: 0.3394189870228583
Energy: 0.32278069559037315
Energy: 0.3394189870228583
Energy: 0.32586215001101637
Energy: 0.3346937593960442
Energy: 0.32586215001055885
Energy: 0.3346937593955866
Energy: 0.32586215001055885
Energy: 0.3346937593955866
Energy: 0.3200913324323237
Energy: 0.3307592267853825
Energy: 0.3200913324318661
Energy: 0.3307592267853825
Energy: 0.3200913324323237
Energy: 0.3307592267849249
Energy: 0.31875539796368624
Energy: 0.3219027749659338
Energy: 0.3187223567444034
Energy: 0.32190277496501857
Energy: 0.31872235674531857
Energy: 0.32190277496501857
Energy: 0.323104845811199
Energy: 0.32384974336376826
Energy: 0.3231048458121141
Energy: 0.32384974336376826
Energy: 0.32310484581165655
Energy: 0.3238497433642258
Energy: 0.3168472602935405
Energy: 0.3270780132742953
Energy: 0.3168472602935405
Energy: 0.3270780132742953
Energy: 0.3168472602930829
Energy: 0.3270780132742953
Energy: 0.3337479570440219
Energy: 0.33814988271120655
Energy: 0.3337479570444795
Energy: 0.33814988271120655
Energy: 0.3337479570440219
Energy: 0.33814988271120655
Energy: 0.32339306266028756
Energy: 0.3223340824957775
Energy: 0.32339306266028756
Energy: 0.3223340824957775
Energy: 0.3233930626607452
Energy: 0.322334082496235
Energy: 0.3191880052630453
Energy: 0.3250068557357868
Energy: 0.31918800526396046
Energy: 0.3250068557362444
Energy: 0.3191880052630453
Energy: 0.3250068557362444
Energy: 0.3153570148774709
Energy: 0.31876757617726004
Energy: 0.31535701487701334
Energy: 0.31876757617726004
Energy: 0.3153570148774709
Energy: 0.31876757617726004
Energy: 0.32897896284764183
Energy: 0.33211170517864724
Energy: 0.32897896284718425
Energy: 0.3321117051781896
Energy: 0.32897896284764183
Energy: 0.3321117051781896
Energy: 0.3261980430481623
Energy: 0.3243106815241887
Energy: 0.32619804304907746
Energy: 0.3243106815241887
Energy: 0.3261980430481623
Energy: 0.3243106815241887
Energy: 0.32939961696725906
Energy: 0.3258442549849563
Energy: 0.32939961696725906
Energy: 0.3258442549849563
Energy: 0.32939961696771664
Energy: 0.3258442549849563
Energy: 0.3225678508989213
Energy: 0.3282103585832318
Energy: 0.3225678508989213
Energy: 0.3282103585827742
Energy: 0.3225678508989213
Energy: 0.3282103585827742
Energy: 0.3190074303074801
Energy: 0.32822739752334024
Energy: 0.3190074303065649
Energy: 0.3282273975237978
Energy: 0.31900743030702244
Energy: 0.3282273975237978
Energy: 0.3230354619769991
Energy: 0.3354337205802466
Energy: 0.3230354619769991
Energy: 0.3354337205802466
Energy: 0.3230354619774567
Energy: 0.3354337205802466
Energy: 0.32600405095293183
Energy: 0.31863661374880636
Energy: 0.3260040509524742
Energy: 0.31863661374926394
Energy: 0.32600405095293183
Energy: 0.31863661374926394
Energy: 0.31901765013087585
Energy: 0.3282867163008184
Energy: 0.3190176501304183
Energy: 0.3282867163008184
Energy: 0.3190176501299607
Energy: 0.3282867163003609
Energy: 0.31850656671152494
Energy: 0.3136940400365176
Energy: 0.31850656671060973
Energy: 0.3136940400365176
Energy: 0.3185065667110673
Energy: 0.3136940400365176
Energy: 0.3252936264072938
Energy: 0.3400760236654156
Energy: 0.3252936264072938
Energy: 0.3400760236654156
Energy: 0.32529362640683623
Energy: 0.340076023664958

minimum gb energy = 0.3110910663822632 eV
minimum distance =  2.58725273109898 Angstroms
sigma value = 57


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

Energy: 0.30808881133377036
Energy: 0.31013016642923785
Energy: 0.3080888113321418
Energy: 0.3101301664300521
Energy: 0.30808881133295607
Energy: 0.3101301664300521
Energy: 0.31209576167901054
Energy: 0.3357922690742185
Energy: 0.31209576167901054
Energy: 0.3357922690742185
Energy: 0.31209576168063907
Energy: 0.3357922690742185
Energy: 0.33055667004282324
Energy: 0.3334177250615296
Energy: 0.33055667004200895
Energy: 0.3334177250615296
Energy: 0.33055667004282324
Energy: 0.3334177250615296
Energy: 0.3105683460002677
Energy: 0.355809060169044
Energy: 0.3105683460002677
Energy: 0.38357010647842493
Energy: 0.31056834600108196
Energy: 0.355809060169044
Energy: 0.3306088376421662
Energy: 0.33342383970214884
Energy: 0.3306088376421662
Energy: 0.33342383970214884
Energy: 0.3306088376421662
Energy: 0.33342383970214884
Energy: 0.3121246287793723
Energy: 0.3357788778439586
Energy: 0.3121246287793723
Energy: 0.34685725389469324
Energy: 0.31212462878262937
Energy: 0.3337718887216106
Energy: 0.30808881133377036
Energy: 0.31013016642923785
Energy: 0.30808881133295607
Energy: 0.31013016642923785
Energy: 0.30808881133377036
Energy: 0.31013016642923785
Energy: 0.3120957616765677
Energy: 0.3357922690742185
Energy: 0.31209576167819625
Energy: 0.3357922690742185
Energy: 0.3120957616757534
Energy: 0.3357922690742185
Energy: 0.33055667004282324
Energy: 0.3334177250615296
Energy: 0.33055667004282324
Energy: 0.3334177250615296
Energy: 0.33055667004282324
Energy: 0.3334177250615296
Energy: 0.3105683460002677
Energy: 0.3558090601698583
Energy: 0.3105683459994719
Energy: 0.3558090601698583
Energy: 0.3105683460002677
Energy: 0.355809060169044
Energy: 0.33060883764298044
Energy: 0.3334238397029631
Energy: 0.33060883764298044
Energy: 0.3334238397029631
Energy: 0.33060883764298044
Energy: 0.3334238397029631
Energy: 0.3121246287793723
Energy: 0.33577887784558713
Energy: 0.3121246287818151
Energy: 0.33577887784558713
Energy: 0.3121246287818151
Energy: 0.33577887784558713
Energy: 0.30808881133295607
Energy: 0.3101301664300521
Energy: 0.3080888113321418
Energy: 0.31013016642923785
Energy: 0.30808881133295607
Energy: 0.3101301664300521
Energy: 0.31209576167819625
Energy: 0.3357922690742185
Energy: 0.312095761677382
Energy: 0.3357922690742185
Energy: 0.31209576167819625
Energy: 0.3357922690742185
Energy: 0.33055667004200895
Energy: 0.3334177250615296
Energy: 0.33055667004200895
Energy: 0.3334177250615296
Energy: 0.33055667004282324
Energy: 0.3334177250615296
Energy: 0.3105683460002677
Energy: 0.355809060169044
Energy: 0.3105683460002677
Energy: 0.355809060169044
Energy: 0.3105683460002677
Energy: 0.355809060169044
Energy: 0.3306088376421662
Energy: 0.33342383970214884
Energy: 0.3306088376421662
Energy: 0.33342383970214884
Energy: 0.3306088376421662
Energy: 0.33342383970214884

minimum gb energy = 0.3080888113321418 eV
minimum distance =  2.59672986259519 Angstroms
sigma value = 9


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

Energy: 0.33524550404964437
Energy: 0.33986226236838296
Energy: 0.3352455040503092
Energy: 0.33986226236838296
Energy: 0.3352455040503092
Energy: 0.33986226236838296
Energy: 0.3375150829179353
Energy: 0.3293661551873045
Energy: 0.3375150829166056
Energy: 0.3293661551866396
Energy: 0.33751508291727045
Energy: 0.3293661551873045
Energy: 0.3387952097699996
Energy: 0.329370537059464
Energy: 0.32793603451445835
Energy: 0.32937053705879915
Energy: 0.32793603451445835
Energy: 0.329370537059464
Energy: 0.3223427810252658
Energy: 0.3570682993609878
Energy: 0.3223427810246009
Energy: 0.3570682993609878
Energy: 0.3223427810246009
Energy: 0.3570682993609878
Energy: 0.33395234905903187
Energy: 0.3311096372884621
Energy: 0.33395234905903187
Energy: 0.3311096372884621
Energy: 0.33395234905903187
Energy: 0.3311096372884621
Energy: 0.33943222417445734
Energy: 0.32416709421383516
Energy: 0.3394322241751222
Energy: 0.32416709421383516
Energy: 0.3394322241737925
Energy: 0.32416709421383516
Energy: 0.3195738191723681
Energy: 0.3434484509237852
Energy: 0.31957381917303296
Energy: 0.3434484509237852
Energy: 0.31957381917303296
Energy: 0.3434484509237852
Energy: 0.3247953168154416
Energy: 0.3421647228522288
Energy: 0.32479531681610646
Energy: 0.3421647228522288
Energy: 0.3247953168154416
Energy: 0.3421647228522288
Energy: 0.36379321196645903
Energy: 0.32851136043457163
Energy: 0.36379321196712383
Energy: 0.32851136043457163
Energy: 0.36379321196712383
Energy: 0.32851136043457163
Energy: 0.3220001262078863
Energy: 0.3289568290016933
Energy: 0.3220001262085512
Energy: 0.3289568290016933
Energy: 0.3220001262085512
Energy: 0.3289568290016933
Energy: 0.3323958340089756
Energy: 0.3375516655365338
Energy: 0.3323958340096405
Energy: 0.3375516655365338
Energy: 0.3323958340089756
Energy: 0.3375516655365338
Energy: 0.35772375734197925
Energy: 0.323226651387091
Energy: 0.3577237573413144
Energy: 0.323226651387091
Energy: 0.35772375734264406
Energy: 0.3232266513864261
Energy: 0.32444485422352115
Energy: 0.35853231950112535
Energy: 0.32444485422418595
Energy: 0.35853231950112535
Energy: 0.32444485422352115
Energy: 0.35853231950112535
Energy: 0.32761904982862194
Energy: 0.3309811003629943
Energy: 0.3276190498299516
Energy: 0.3309811003629943
Energy: 0.32761904982928675
Energy: 0.3309811003629943
Energy: 0.3530429051169217
Energy: 0.32292610406681044
Energy: 0.35304290511825137
Energy: 0.32292610406681044
Energy: 0.3530429051169217
Energy: 0.32292610406681044
Energy: 0.32896791395857383
Energy: 0.340033642656614
Energy: 0.32896791395857383
Energy: 0.340033642656614
Energy: 0.32896791395857383
Energy: 0.340033642656614
Energy: 0.331515950099083
Energy: 0.34163914479214835
Energy: 0.33151595009974794
Energy: 0.34163914479281315
Energy: 0.331515950099083
Energy: 0.34163914479281315
Energy: 0.3741322831598142
Energy: 0.32034447661374443
Energy: 0.37413228316114394
Energy: 0.32034447661374443
Energy: 0.3741322831604792
Energy: 0.32034447661374443
Energy: 0.32781852173991366
Energy: 0.3278630030198386
Energy: 0.32781852173991366
Energy: 0.3278630030198386
Energy: 0.3278185217405786
Energy: 0.3278630030198386
Energy: 0.33586176495342407
Energy: 0.33253086840061624
Energy: 0.3358617649547538
Energy: 0.33253086840061624
Energy: 0.33586176495408887
Energy: 0.33253086840061624
Energy: 0.3547282365622377
Energy: 0.3233624163257981
Energy: 0.35472823656090796
Energy: 0.3233624163257981
Energy: 0.3547282365622377
Energy: 0.3233624163257981

minimum gb energy = 0.3195738191723681 eV
minimum distance =  2.57823956767174 Angstroms
sigma value = 27


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

Energy: 0.3264943155460147
Energy: 0.3348523191962719
Energy: 0.3264943155460147
Energy: 0.3348523191962719
Energy: 0.3264943155465751
Energy: 0.3348523191968323
Energy: 0.31667277812354716
Energy: 0.312823791644347
Energy: 0.31667277812354716
Energy: 0.312823791644347
Energy: 0.31667277812354716
Energy: 0.312823791644347
Energy: 0.3217777185908267
Energy: 0.3301847392081252
Energy: 0.32177771859138715
Energy: 0.33018473920868563
Energy: 0.3217777185908267
Energy: 0.3301847392081252
Energy: 0.30712122032901806
Energy: 0.3126339365498337
Energy: 0.3071212203284576
Energy: 0.31263393654927324
Energy: 0.30712122032901806
Energy: 0.31263393654927324
Energy: 0.3109637138101613
Energy: 0.33432561375940584
Energy: 0.3109637138107217
Energy: 0.33432561375884545
Energy: 0.3109637138101613
Energy: 0.33432561375884545
Energy: 0.33098547748285034
Energy: 0.3121102685030345
Energy: 0.33098547748228996
Energy: 0.3121102685024741
Energy: 0.33098547748228996
Energy: 0.3121102685024741
Energy: 0.3092145881135289
Energy: 0.32071253070980094
Energy: 0.3092145881129685
Energy: 0.32071253070980094
Energy: 0.3092145881135289
Energy: 0.32071253070980094
Energy: 0.32382106567479074
Energy: 0.32358878750997483
Energy: 0.32382106567479074
Energy: 0.32358878750997483
Energy: 0.3238210656742303
Energy: 0.32358878750997483
Energy: 0.33072633744335966
Energy: 0.3121458397862239
Energy: 0.3307263374439201
Energy: 0.3121458397862239
Energy: 0.3307263374439201
Energy: 0.31214583978566346
Energy: 0.3064989692264815
Energy: 0.3321862066311962
Energy: 0.3064989692270419
Energy: 0.3321862066311962
Energy: 0.30649896922592107
Energy: 0.3321862066311962
Energy: 0.30654504177136316
Energy: 0.31933360488422996
Energy: 0.30654504177248404
Energy: 0.3193336048836695
Energy: 0.3065450417719236
Energy: 0.31933360488422996
Energy: 0.3208473619755204
Energy: 0.3061781165708479
Energy: 0.32084736197495994
Energy: 0.3061781165708479
Energy: 0.3208473619743995
Energy: 0.3061781165708479
Energy: 0.3337750338560332
Energy: 0.3205088460116179
Energy: 0.3337750338560332
Energy: 0.32050884601105745
Energy: 0.33377503385659363
Energy: 0.3205088460116179
Energy: 0.30898262775521523
Energy: 0.32741286603087644
Energy: 0.30898262775521523
Energy: 0.32741286603087644
Energy: 0.30898262775521523
Energy: 0.32741286603087644
Energy: 0.3320723835742319
Energy: 0.3121219805402462
Energy: 0.33207238357255064
Energy: 0.3121219805402462
Energy: 0.33207238357367147
Energy: 0.3121219805402462
Energy: 0.31092765096454256
Energy: 0.33274667209239633
Energy: 0.310927650965103
Energy: 0.33274667209239633
Energy: 0.3109276509639821
Energy: 0.33274667209239633
Energy: 0.3061858862361698
Energy: 0.3214535365341216
Energy: 0.3061858862372907
Energy: 0.3214535365341216
Energy: 0.3061858862361698
Energy: 0.32145353653356123
Energy: 0.31689732170642376
Energy: 0.33476892850550544
Energy: 0.3168973217069842
Energy: 0.334768928504945
Energy: 0.31689732170642376
Energy: 0.33476892850550544
Energy: 0.3090880029817889
Energy: 0.3119976778490823
Energy: 0.3090880029817889
Energy: 0.3119976778490823
Energy: 0.3090880029823493
Energy: 0.3119976778490823
Energy: 0.3264943155482564
Energy: 0.33485231919515107
Energy: 0.3264943155488168
Energy: 0.33485231919515107
Energy: 0.3264943155482564
Energy: 0.33485231919515107
Energy: 0.3166727781213055
Energy: 0.3128237916437866
Energy: 0.3166727781213055
Energy: 0.3128237916437866
Energy: 0.3166727781213055
Energy: 0.3128237916437866
Energy: 0.3217777185908267
Energy: 0.3301847392064439
Energy: 0.32177771859138715
Energy: 0.3301847392064439
Energy: 0.3217777185908267
Energy: 0.3301847392064439
Energy: 0.30712122032789724
Energy: 0.31263393654871285
Energy: 0.30712122032789724
Energy: 0.31263393654871285
Energy: 0.3071212203284576
Energy: 0.31263393654927324
Energy: 0.31096371380960086
Energy: 0.3343256137599663
Energy: 0.3109637138101613
Energy: 0.3343256137599663
Energy: 0.31096371380960086
Energy: 0.3343256137599663
Energy: 0.33098547748004825
Energy: 0.3121102685019137
Energy: 0.3309854774794878
Energy: 0.3121102685019137
Energy: 0.3309854774794878
Energy: 0.3121102685019137

minimum gb energy = 0.3061781165708479 eV
minimum distance =  2.62688743100157 Angstroms
sigma value = 19


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

Energy: 0.30647961404267055
Energy: 0.31828422253215854
Energy: 0.3064796140421868
Energy: 0.31828422253215854
Energy: 0.3064796140421868
Energy: 0.31828422253215854
Energy: 0.3158068779698364
Energy: 0.3104046139844617
Energy: 0.31580687796935264
Energy: 0.31040461398397795
Energy: 0.3158068779698364
Energy: 0.3104046139844617
Energy: 0.3415797043243672
Energy: 0.29213287106572394
Energy: 0.3230969019588246
Energy: 0.29213287106572394
Energy: 0.32309690195834084
Energy: 0.29213287106524016
Energy: 0.2995804000485067
Energy: 0.33158117056440534
Energy: 0.29958040004899045
Energy: 0.33158117056488906
Energy: 0.29958040004899045
Energy: 0.33158117056488906
Energy: 0.30733063400319516
Energy: 0.3146921675695305
Energy: 0.3073306340036789
Energy: 0.3146921675700142
Energy: 0.30733063400319516
Energy: 0.3146921675700142
Energy: 0.329516038390544
Energy: 0.29929976275708153
Energy: 0.3295160383900602
Energy: 0.2992997627575653
Energy: 0.3295160383900602
Energy: 0.29929976275708153
Energy: 0.29703231073591996
Energy: 0.3171308646428962
Energy: 0.29703231073688746
Energy: 0.31713086464338
Energy: 0.29703231073640374
Energy: 0.3171308646428962
Energy: 0.307712380168104
Energy: 0.328343987679809
Energy: 0.3077123801685877
Energy: 0.328343987679809
Energy: 0.30771238016762026
Energy: 0.3283439876793252
Energy: 0.33909411234781445
Energy: 0.2932595303348224
Energy: 0.3390941123482982
Energy: 0.2932595303348224
Energy: 0.3390941123482982
Energy: 0.2932595303348224
Energy: 0.3105338738907027
Energy: 0.31514400944584414
Energy: 0.3105338738907027
Energy: 0.31514400944584414
Energy: 0.3105338738907027
Energy: 0.31514400944584414
Energy: 0.29678441527305094
Energy: 0.32663255356881143
Energy: 0.2967844152725672
Energy: 0.32663255356881143
Energy: 0.2967844152735347
Energy: 0.32663255356881143
Energy: 0.3215569126971182
Energy: 0.29312589901738
Energy: 0.32155691269663456
Energy: 0.29312589901738
Energy: 0.3215569126971182
Energy: 0.29312589901738
Energy: 0.31096437806530397
Energy: 0.30322931745525405
Energy: 0.3109643780648203
Energy: 0.30322931745525405
Energy: 0.31096437806530397
Energy: 0.30322931745525405
Energy: 0.29647712139412735
Energy: 0.33320940447255276
Energy: 0.2964771213936437
Energy: 0.33320940447255276
Energy: 0.29647712139412735
Energy: 0.33320940447255276
Energy: 0.3118532809170442
Energy: 0.29368593962918527
Energy: 0.3118532809180117
Energy: 0.2936859396287015
Energy: 0.3118532809170442
Energy: 0.29368593962918527
Energy: 0.33038066744928557
Energy: 0.29182185998431986
Energy: 0.3303806674488018
Energy: 0.29182185998431986
Energy: 0.33038066744928557
Energy: 0.29182185998431986
Energy: 0.29870391657473083
Energy: 0.3271424829110413
Energy: 0.2987039165732796
Energy: 0.32714248291055753
Energy: 0.2987039165737634
Energy: 0.3271424829110413
Energy: 0.309839498240322
Energy: 0.3192387314452224
Energy: 0.3098394982398382
Energy: 0.3192387314452224
Energy: 0.3098394982398382
Energy: 0.3192387314457062
Energy: 0.32628600347995246
Energy: 0.30024550600848493
Energy: 0.32628600348091996
Energy: 0.30024550600848493
Energy: 0.32628600348091996
Energy: 0.30024550600848493
Energy: 0.2988178181998568
Energy: 0.31722553904225614
Energy: 0.29881781819937303
Energy: 0.31722553904225614
Energy: 0.29881781819937303
Energy: 0.31722553904225614
Energy: 0.29558970723147965
Energy: 0.33075898158634864
Energy: 0.2955897072309959
Energy: 0.33075898158634864
Energy: 0.29558970723196343
Energy: 0.33075898158634864
Energy: 0.33996786443494964
Energy: 0.29341900808508203
Energy: 0.33996786443688465
Energy: 0.29341900808508203
Energy: 0.33996786443688465
Energy: 0.29341900808508203
Energy: 0.32328838940224747
Energy: 0.30635224587035276
Energy: 0.3232883894032149
Energy: 0.30635224587083654
Energy: 0.3232883894032149
Energy: 0.30635224587083654
Energy: 0.31484658305365165
Energy: 0.3214534775358944
Energy: 0.31484658305413543
Energy: 0.3214534775358944
Energy: 0.31484658305365165
Energy: 0.3214534775358944
Energy: 0.32119889398752105
Energy: 0.2934148429489556
Energy: 0.32119889398848855
Energy: 0.29341484294847187
Energy: 0.32119889398752105
Energy: 0.2934148429489556
Energy: 0.305144613693841
Energy: 0.30342869743260675
Energy: 0.3051446136952923
Energy: 0.30342869743260675
Energy: 0.30514461369480855
Energy: 0.30342869743260675
Energy: 0.2989250059446385
Energy: 0.33338480032698886
Energy: 0.2989250059451222
Energy: 0.3333848003265051
Energy: 0.29892500594560595
Energy: 0.3333848003265051
Energy: 0.31829553863333976
Energy: 0.3063968724672279
Energy: 0.3182955386338235
Energy: 0.3063968724672279
Energy: 0.3182955386338235
Energy: 0.3063968724672279
Energy: 0.3191346629980268
Energy: 0.29957409334835444
Energy: 0.31913466299851057
Energy: 0.29957409334835444
Energy: 0.3191346629980268
Energy: 0.29957409334835444

minimum gb energy = 0.29182185998431986 eV
minimum distance =  2.58363190380613 Angstroms
sigma value = 101


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

Energy: 0.2948053973673475
Energy: 0.3212822868810868
Energy: 0.294805397366497
Energy: 0.3212822868810868
Energy: 0.2948053973673475
Energy: 0.3212822868810868
Energy: 0.30104489558325936
Energy: 0.3026312907349575
Energy: 0.3010448955845351
Energy: 0.3026312907349575
Energy: 0.30104489558368464
Energy: 0.29366850343983153
Energy: 0.31604348561764184
Energy: 0.27868906923184816
Energy: 0.31604348561806717
Energy: 0.27868906923184816
Energy: 0.31604348561806717
Energy: 0.27868906923227343
Energy: 0.2817999245232621
Energy: 0.3236734562887612
Energy: 0.28179992452411257
Energy: 0.33790913969461056
Energy: 0.2817999245232621
Energy: 0.31147310112066096
Energy: 0.29182216254988924
Energy: 0.29916801333275733
Energy: 0.29182216254903875
Energy: 0.2991680133331826
Energy: 0.29182216254988924
Energy: 0.29916801333275733
Energy: 0.32663511992547956
Energy: 0.2779721852190865
Energy: 0.3266351199259049
Energy: 0.2779721852190865
Energy: 0.32663511992633004
Energy: 0.2779721852190865
Energy: 0.29379944650743134
Energy: 0.30469236321224247
Energy: 0.29379944650743134
Energy: 0.30469236321224247
Energy: 0.2937994465070061
Energy: 0.3046923632126677
Energy: 0.2816518651198335
Energy: 0.3634969968568927
Energy: 0.281651865118983
Energy: 0.3634969968573179
Energy: 0.2816518651198335
Energy: 0.29481089307010283
Energy: 0.3248792147979287
Energy: 0.2794443457021368
Energy: 0.3248792147975035
Energy: 0.2794443457021368
Energy: 0.3248792147979287
Energy: 0.279444345702562
Energy: 0.2919626138136258
Energy: 0.29326502688948697
Energy: 0.2919626138136258
Energy: 0.320623649089222
Energy: 0.2919626138132005
Energy: 0.29326502688948697
Energy: 0.28084427034149495
Energy: 0.3407453562042323
Energy: 0.28084427034149495
Energy: 0.3407453562042323
Energy: 0.2808442703410697
Energy: 0.3407453562042323
Energy: 0.30132121209772744
Energy: 0.28651134821802926
Energy: 0.30132121209604584
Energy: 0.28651134821802926
Energy: 0.30132121209645174
Energy: 0.28651134821802926
Energy: 0.3116263821738587
Energy: 0.27836468722873525
Energy: 0.3116263821734334
Energy: 0.27836468722873525
Energy: 0.3116263821734334
Energy: 0.27836468722831
Energy: 0.2962523108982105
Energy: 0.3154541240137611
Energy: 0.2962523108982105
Energy: 0.3154541240146116
Energy: 0.2962523108986358
Energy: 0.31545412401333583
Energy: 0.3018612880379054
Energy: 0.2997873924439129
Energy: 0.3018612880379054
Energy: 0.2997873924434877
Energy: 0.3018612880379054
Energy: 0.2997873924434877
Energy: 0.3135461549179657
Energy: 0.27771814234166614
Energy: 0.31354615491839094
Energy: 0.277718142341241
Energy: 0.31354615491839094
Energy: 0.27771814234166614
Energy: 0.2805959848661043
Energy: 0.31959083355946616
Energy: 0.2805959848669547
Energy: 0.3195908335598914
Energy: 0.2805959848661043
Energy: 0.3195908335598914
Energy: 0.28094213712891564
Energy: 0.2998955231634023
Energy: 0.28094213712891564
Energy: 0.29989552316382756
Energy: 0.28094213712806515
Energy: 0.29989552316382756
Energy: 0.3254913833828857
Energy: 0.2795390263278238
Energy: 0.32549138338331096
Energy: 0.2795390263278238
Energy: 0.3254913833820352
Energy: 0.2795390263278238
Energy: 0.29389417906589077
Energy: 0.28860389278641435
Energy: 0.2938941790650403
Energy: 0.28860389278641435
Energy: 0.29389417906589077
Energy: 0.28860389278600845
Energy: 0.2804828670869974
Energy: 0.3415814633987498
Energy: 0.2804828670869974
Energy: 0.34158146339834383
Energy: 0.2804828670869974
Energy: 0.3415814633987498
Energy: 0.312364632652751
Energy: 0.27748923358230126
Energy: 0.312364632652751
Energy: 0.27748923358187605
Energy: 0.3123646326523257
Energy: 0.27748923358187605
Energy: 0.3074444664857049
Energy: 0.2782462270933517
Energy: 0.3074444664865554
Energy: 0.27824622709292635
Energy: 0.3074444664857049
Energy: 0.2782462270933517
Energy: 0.2820173581661032
Energy: 0.32632513676736585
Energy: 0.2820173581656779
Energy: 0.32632513676736585
Energy: 0.2820173581661032
Energy: 0.32632513676736585
Energy: 0.3023719438879087
Energy: 0.28375518610262923
Energy: 0.30237194388748345
Energy: 0.28375518610303513
Energy: 0.30237194388748345
Energy: 0.28375518610262923
Energy: 0.3112953381266832
Energy: 0.27788729159864095
Energy: 0.311295338126258
Energy: 0.27788729159864095
Energy: 0.311295338126258
Energy: 0.27788729159864095
Energy: 0.29982162497748327
Energy: 0.3090692332851807
Energy: 0.299821624977058
Energy: 0.3090692332851807
Energy: 0.299821624977058
Energy: 0.30906923328475544
Energy: 0.30592330369087867
Energy: 0.3121343988684488
Energy: 0.3059233036913039
Energy: 0.3121343988684488
Energy: 0.3059233036913039
Energy: 0.3121343988684488
Energy: 0.326399232791779
Energy: 0.2775905840827724
Energy: 0.32639923279135374
Energy: 0.2775905840827724
Energy: 0.32639923279092853
Energy: 0.2775905840827724
Energy: 0.2809711873397645
Energy: 0.29148379569832705
Energy: 0.280971187340615
Energy: 0.29148379569832705
Energy: 0.2809711873397645
Energy: 0.29148379569832705
Energy: 0.28055493289445954
Energy: 0.3076572394370553
Energy: 0.28055493289445954
Energy: 0.3076572394370553
Energy: 0.28055493289445954
Energy: 0.3076572394370553
Energy: 0.30552645579767185
Energy: 0.27753283345462265
Energy: 0.3055264557955456
Energy: 0.2775328334541974
Energy: 0.3055264557963961
Energy: 0.2775328334541974
Energy: 0.3126689545391635
Energy: 0.27836921708304635
Energy: 0.3126689545395887
Energy: 0.2783692170826211
Energy: 0.3126689545395887
Energy: 0.27836921708304635

minimum gb energy = 0.27748923358187605 eV
minimum distance =  2.59118023910436 Angstroms
sigma value = 33


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

Energy: 0.012550349612027785
Energy: 0.2930257280153842
Energy: 0.012550349611694097
Energy: 0.29302572801503085
Energy: 0.012550349612027785
Energy: 0.2930257280146775
Energy: 0.013264171824644419
Energy: 0.13108442348039792
Energy: 0.013264171824310729
Energy: 0.1310844234797109
Energy: 0.013264171824644419
Energy: 0.13108442348075122
Energy: 0.5914215300634336
Energy: 0.1301568787246587
Energy: 0.2933286373697244
Energy: 0.1301568787239717
Energy: 0.2933286373700581
Energy: 0.1301568787239717
Energy: 0.013264171824997738
Energy: 0.1310844234800446
Energy: 0.013264171824644419
Energy: 0.1310844234800446
Energy: 0.013264171824997738
Energy: 0.13108442348075122

minimum gb energy = 0.012550349611694097 eV
minimum distance =  2.84076130823906 Angstroms
sigma value = 1