Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Ni__MO_937008984446_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000256299973
cohesive_energy=4.4503499779377105
mass=58.6934
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: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.9432662152368588
Energy: 1.0427548716974417
Energy: 0.9432662152365282
Energy: 1.0427548716974417
Energy: 0.9432662152368588
Energy: 1.0427548716983972
Energy: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.9432662152368588
Energy: 1.0427548716977724
Energy: 0.9432662152368588
Energy: 1.0427548716977724
Energy: 0.9432662152368588
Energy: 1.0427548716974417
Energy: 0.018146703953543866
Energy: 0.9432662152368588
Energy: 0.018146703953543866
Energy: 0.9432662152365282
Energy: 0.018146703953213102
Energy: 0.9432662152368588
Energy: 0.9432662152368588
Energy: 1.0427548716977724
Energy: 0.9432662152368588
Energy: 1.0427548716981032
Energy: 0.9432662152368588
Energy: 1.0427548716977724

minimum gb energy = 0.018146703953213102 eV
minimum distance =  2.30846370382236 Angstroms
sigma value = 1


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

Energy: 1.279862986107886
Energy: 1.3002389300842316
Energy: 1.2798629861070898
Energy: 1.300238930085824
Energy: 1.279862986107886
Energy: 1.3002389300850277
Energy: 1.3914521556205717
Energy: 1.2268158949665988
Energy: 1.3914521556173869
Energy: 1.2268158949665988
Energy: 1.3914521556189792
Energy: 1.2268158949665988
Energy: 1.2289036306944998
Energy: 1.3087800603158122
Energy: 1.2289036306952958
Energy: 1.3087800603158122
Energy: 1.2289036306937757
Energy: 1.3087800603158122
Energy: 1.3990216813560126
Energy: 1.2592023438245703
Energy: 1.399021672254834
Energy: 1.2592023438253666
Energy: 1.3990216811825156
Energy: 1.2592023438253666
Energy: 1.2381226038034916
Energy: 1.320086566627522
Energy: 1.2381226038034916
Energy: 1.320086566699107
Energy: 1.2381226038058801
Energy: 1.3200865667134383
Energy: 1.3018010383011813
Energy: 1.206781435265927
Energy: 1.3018010383011813
Energy: 1.206781435262742
Energy: 1.3018010383035699
Energy: 1.20678143526115
Energy: 1.2340839532709038
Energy: 1.2506351687979917
Energy: 1.2340839532748848
Energy: 1.2506351688003803
Energy: 1.2340839532724963
Energy: 1.2506351687995843
Energy: 1.2440718409197484
Energy: 1.3249398012172122
Energy: 1.2440718409205445
Energy: 1.3249394690588625
Energy: 1.2440718409197484
Energy: 1.3249393842472992
Energy: 1.3529205274289018
Energy: 1.2496736565329793
Energy: 1.3529205274265133
Energy: 1.2496736565313868
Energy: 1.3529205274265133
Energy: 1.2496736565289985
Energy: 1.1904378254221553
Energy: 1.3086417793557394
Energy: 1.190437825422951
Energy: 1.3086417641123147
Energy: 1.190437825422951
Energy: 1.3086418443875476
Energy: 1.5112421120090533
Energy: 1.2056524657859953
Energy: 1.511242112007461
Energy: 1.2056524657851992
Energy: 1.5112421120090533
Energy: 1.2056524657851992
Energy: 1.2097564619562202
Energy: 1.602143912085633
Energy: 1.2097564619562202
Energy: 1.602143912085633
Energy: 1.2097564619570162
Energy: 1.6021439120840406
Energy: 1.4177751765235247
Energy: 1.218773894560717
Energy: 1.4177751765243207
Energy: 1.218773894560717
Energy: 1.4177751765227287
Energy: 1.2187738945599207
Energy: 1.2288148915333514
Energy: 1.2633503419570933
Energy: 1.2288148915333514
Energy: 1.2633503419578893
Energy: 1.2288148915333514
Energy: 1.2633503419586853
Energy: 1.3805606459158342
Energy: 1.2072219932905037
Energy: 1.3805606453682726
Energy: 1.2072219932857267
Energy: 1.3805606450053545
Energy: 1.2072219932897077
Energy: 1.375489116870988
Energy: 1.2954393278868233
Energy: 1.3754891164436507
Energy: 1.295439327911505
Energy: 1.3754891145416246
Energy: 1.2954393281112766
Energy: 1.2339175783864755
Energy: 1.2841454271117771
Energy: 1.233917578384883
Energy: 1.2841454271125734
Energy: 1.233917578384883
Energy: 1.2841454271117771
Energy: 1.2357473960825178
Energy: 1.2430004866176732
Energy: 1.235747396084834
Energy: 1.2430004866312083
Energy: 1.2357473960880185
Energy: 1.243000486620858
Energy: 1.2712145390475345
Energy: 1.2668926172552706
Energy: 1.2712145390475345
Energy: 1.266892617256067
Energy: 1.2712145390475345
Energy: 1.2668926172552706
Energy: 1.32083700239831
Energy: 1.2067108390382528
Energy: 1.320836975289696
Energy: 1.206710839035864
Energy: 1.3208369577550527
Energy: 1.2067108390366603
Energy: 1.2242570874316343
Energy: 1.5785017666354941
Energy: 1.2242570874316343
Energy: 1.5785017666354941
Energy: 1.2242570874316343
Energy: 1.578501766634698
Energy: 1.3011804509077596
Energy: 1.2533667717223895
Energy: 1.301180450905371
Energy: 1.2533667717207972
Energy: 1.3011804509069635
Energy: 1.2533667717207972
Energy: 1.2521271048715747
Energy: 1.3742833616088554
Energy: 1.2006972422904476
Energy: 1.3742833616104477
Energy: 1.2006972422912436
Energy: 1.3742833616072634

minimum gb energy = 1.1904378254221553 eV
minimum distance =  2.24657760023148 Angstroms
sigma value = 33


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

Energy: 1.2372768443595743
Energy: 1.30503847493115
Energy: 1.2372768443591216
Energy: 1.30503847493115
Energy: 1.2372768443595743
Energy: 1.3050384749316029
Energy: 1.3849992156252895
Energy: 1.2525849075799458
Energy: 1.3849992156257425
Energy: 1.25258490758221
Energy: 1.3849992156252895
Energy: 1.2525849075808515
Energy: 1.2238177698751127
Energy: 1.252767171429517
Energy: 1.2238177698755657
Energy: 1.2527671714286115
Energy: 1.2238177698746597
Energy: 1.252767171429517
Energy: 1.3044022824402894
Energy: 1.35518367268264
Energy: 1.3044022824402894
Energy: 1.3551836726821873
Energy: 1.3044022824407422
Energy: 1.3551836726821873
Energy: 1.2256474673259572
Energy: 1.3005370298971677
Energy: 1.2256474674476971
Energy: 1.3005370298985262
Energy: 1.2256474679402138
Energy: 1.3005370298971677
Energy: 1.2575702408243683
Energy: 1.2225594217127096
Energy: 1.2575702408243683
Energy: 1.2225594217683717
Energy: 1.257570240824821
Energy: 1.222559421715427
Energy: 1.3048610212059388
Energy: 1.236804779805083
Energy: 1.304861021205033
Energy: 1.2368047798059885
Energy: 1.3048610212077503
Energy: 1.2368047798064414
Energy: 1.191438640087607
Energy: 1.2404803667527038
Energy: 1.1914386399744308
Energy: 1.2404803667517983
Energy: 1.1914386400944001
Energy: 1.2404803667513453
Energy: 1.2873211917325915
Energy: 1.2219491856377522
Energy: 1.2873211917325915
Energy: 1.2219491856372995
Energy: 1.2873211917330445
Energy: 1.2219491856368465
Energy: 1.1880278675542242
Energy: 1.2948899383162762
Energy: 1.1880278675537712
Energy: 1.2948899383171817
Energy: 1.188027867557847
Energy: 1.2948899383162762
Energy: 1.2953706957108375
Energy: 1.2049986636908625
Energy: 1.2953706957076674
Energy: 1.2049986636908625
Energy: 1.2953706957108375
Energy: 1.2049986636904095
Energy: 1.2046339619620146
Energy: 1.2902160338672972
Energy: 1.2046339619624675
Energy: 1.2902160338672972
Energy: 1.2046339619615616
Energy: 1.2902160338672972
Energy: 1.2388754388154255
Energy: 1.213476652635997
Energy: 1.238875438813614
Energy: 1.2134766526369027
Energy: 1.2388754388145196
Energy: 1.2134766526369027
Energy: 1.2367774018346591
Energy: 1.3115617164011006
Energy: 1.2367774018328477
Energy: 1.3115617164011006
Energy: 1.2367774018333006
Energy: 1.3115617164015534
Energy: 1.2684262708316367
Energy: 1.2382278355842267
Energy: 1.2684262708289196
Energy: 1.2382278355819623
Energy: 1.2684262708311838
Energy: 1.2382278355810568
Energy: 1.2026544031409399
Energy: 1.227285040386812
Energy: 1.2026544767698548
Energy: 1.2272850403804718
Energy: 1.2026544439739824
Energy: 1.2272850403886235
Energy: 1.3091209380819895
Energy: 1.3046528565259594
Energy: 1.309120938079725
Energy: 1.3046528565273179
Energy: 1.3091209380819895
Energy: 1.3046528565259594
Energy: 1.2497280160092217
Energy: 1.2221081793513435
Energy: 1.2497280160083157
Energy: 1.2221081793486264
Energy: 1.2497280160096744
Energy: 1.2221081793481736
Energy: 1.2390825860622088
Energy: 1.2499956152593443
Energy: 1.2390825860631143
Energy: 1.2499956152607032
Energy: 1.2390825860626615
Energy: 1.2499956152611558
Energy: 1.3074733003979686
Energy: 1.2414880657193894
Energy: 1.30747330039978
Energy: 1.2414880657189364
Energy: 1.3074733003970627
Energy: 1.2414880657189364
Energy: 1.2130685079103887
Energy: 1.2390831390170214
Energy: 1.2130685079103887
Energy: 1.239083139017927
Energy: 1.2130685079099357
Energy: 1.2390831390174744
Energy: 1.238859279726958
Energy: 1.2218842551380955
Energy: 1.2388592797314868
Energy: 1.2218842551385485
Energy: 1.2388592797292224
Energy: 1.2218842551367368
Energy: 1.205201984158694
Energy: 1.2957785544925906
Energy: 1.2052019841577883
Energy: 1.2957785544934963
Energy: 1.205201984158241
Energy: 1.2957785544898734
Energy: 1.2922124565106494
Energy: 1.2310352122864918
Energy: 1.2922124565120081
Energy: 1.2310352122851334
Energy: 1.2922124565138196
Energy: 1.231035212285586
Energy: 1.2234247208751317
Energy: 1.2392749973140629
Energy: 1.223424720874679
Energy: 1.239274997320403
Energy: 1.2234247208755844
Energy: 1.2392749973176858
Energy: 1.237697540491535
Energy: 1.272981312102818
Energy: 1.2376975404928936
Energy: 1.272981312102818
Energy: 1.2376975404897235
Energy: 1.2729813121073468
Energy: 1.237774874354849
Energy: 1.2728952191096516
Energy: 1.2377748743589247
Energy: 1.2728952191091987
Energy: 1.2377748743553019
Energy: 1.2728952191101044
Energy: 1.2234322768397934
Energy: 1.2388811228297998
Energy: 1.2234322768402461
Energy: 1.2388811228279883
Energy: 1.2234322768397934
Energy: 1.2388811228275354
Energy: 1.2921997911910132
Energy: 1.2311781866727556
Energy: 1.2921997911896546
Energy: 1.2311781866709441
Energy: 1.2921997911923717
Energy: 1.2311781866723028
Energy: 1.2051808388910497
Energy: 1.296259560562342
Energy: 1.2051808388910497
Energy: 1.296259560561889
Energy: 1.2051808388915026
Energy: 1.2962595605627947
Energy: 1.239693838917159
Energy: 1.2213494447299977
Energy: 1.2396938388709662
Energy: 1.221349444728639
Energy: 1.239693838989577
Energy: 1.2213494447295448
Energy: 1.2128433916151247
Energy: 1.2383550277426605
Energy: 1.2128433916155774
Energy: 1.2383550277394906
Energy: 1.2128433916155774
Energy: 1.2383550277345088
Energy: 1.3071240073599686
Energy: 1.2413880521532528
Energy: 1.3071240073613273
Energy: 1.2413880521532528
Energy: 1.3071240073604216
Energy: 1.2413880521537057
Energy: 1.2396948257177614
Energy: 1.2485022180637027
Energy: 1.2396948257191198
Energy: 1.2485021298023042
Energy: 1.2396948257182143
Energy: 1.2485004510330266
Energy: 1.2498118576080035
Energy: 1.2220708357963512
Energy: 1.249811857606645
Energy: 1.2220708357977097
Energy: 1.249811857608909
Energy: 1.2220708357954455
Energy: 1.3091523979448045
Energy: 1.3048386404371826
Energy: 1.3091523979452575
Energy: 1.304838640438994
Energy: 1.3091523979452575
Energy: 1.304838640436277
Energy: 1.2020598773117395
Energy: 1.2265767338234705
Energy: 1.2020598908501707
Energy: 1.2265767338270936
Energy: 1.2020598820407746
Energy: 1.2265767338180362
Energy: 1.2681280781436828
Energy: 1.2380031720681444
Energy: 1.2681280781387012
Energy: 1.238003172066333
Energy: 1.2681280781436828
Energy: 1.2380031720685973
Energy: 1.2367432905777482
Energy: 1.305862122743865
Energy: 1.2367432905763898
Energy: 1.3058621227434124
Energy: 1.2367432905750309
Energy: 1.305862122744318
Energy: 1.2394508194435918
Energy: 1.2136999734041387
Energy: 1.239450819442686
Energy: 1.2136999734027802
Energy: 1.2394508194413276
Energy: 1.2136999734059501
Energy: 1.2050121689375115
Energy: 1.2900611934786739
Energy: 1.2050121689370588
Energy: 1.290061193477768
Energy: 1.2050121689357
Energy: 1.290061193477315

minimum gb energy = 1.1880278675537712 eV
minimum distance =  2.33646328659627 Angstroms
sigma value = 51


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

Energy: 1.2964375162802735
Energy: 1.3144227729668265
Energy: 1.2964375162802735
Energy: 1.3144227729668265
Energy: 1.2964375162802735
Energy: 1.3144227729668265
Energy: 1.3899247083397614
Energy: 1.2746406223236284
Energy: 1.3899247083387123
Energy: 1.2746406223236284
Energy: 1.389924708340811
Energy: 1.2746406223236284
Energy: 1.224859209808011
Energy: 1.3100935814311332
Energy: 1.224859209808011
Energy: 1.3100935814311332
Energy: 1.2248592098090605
Energy: 1.3100935814311332
Energy: 1.2906203763894333
Energy: 1.242082986179919
Energy: 1.2906203763852362
Energy: 1.2420829861809684
Energy: 1.2906203763894333
Energy: 1.242082986179919
Energy: 1.326846040627548
Energy: 1.246475356530919
Energy: 1.3268460403569255
Energy: 1.2464753565298696
Energy: 1.3268460400034567
Energy: 1.2464753565288205
Energy: 1.3264175713546358
Energy: 1.2454760621888874
Energy: 1.3264180876883755
Energy: 1.2454760621888874
Energy: 1.3264172943801789
Energy: 1.245476062187838
Energy: 1.2941044456251396
Energy: 1.2459352963713133
Energy: 1.294104445626189
Energy: 1.2459352963713133
Energy: 1.2941044456251396
Energy: 1.245935296370264
Energy: 1.227927845058656
Energy: 1.2467580240451077
Energy: 1.227927845058656
Energy: 1.2467580240451077
Energy: 1.227927845058656
Energy: 1.2467580240451077
Energy: 1.4623479335804297
Energy: 1.2372920576577242
Energy: 1.4623480393987354
Energy: 1.2372920576577242
Energy: 1.462348244774975
Energy: 1.2372920576577242
Energy: 1.267400698544883
Energy: 1.5094119391727836
Energy: 1.267400698544883
Energy: 1.5094119391727836
Energy: 1.2674006985438337
Energy: 1.5094119391717344
Energy: 1.4290774377926072
Energy: 1.2271194921657165
Energy: 1.4290774377926072
Energy: 1.227119492167815
Energy: 1.4290774377926072
Energy: 1.227119492167815
Energy: 1.2939524755024603
Energy: 1.3140320226189801
Energy: 1.293952475501411
Energy: 1.314032022617931
Energy: 1.293952475501411
Energy: 1.3140320226189801
Energy: 1.4415909470935975
Energy: 1.2763164302907986
Energy: 1.4415908690440367
Energy: 1.276316430291848
Energy: 1.4415909393238642
Energy: 1.276316430291848
Energy: 1.225421093474589
Energy: 1.2539477830185826
Energy: 1.2254210934756382
Energy: 1.2539477830185826
Energy: 1.2254210934756382
Energy: 1.2539477830185826
Energy: 1.2765654870412515
Energy: 1.307789209387636
Energy: 1.2765654870402023
Energy: 1.3077892093865866
Energy: 1.276565487039153
Energy: 1.3077892093865866
Energy: 1.32820085364972
Energy: 1.2456066163537236
Energy: 1.3282008536014525
Energy: 1.2456066163526744
Energy: 1.3282008492624326
Energy: 1.2456066163526744
Energy: 1.3263956870377116
Energy: 1.3185233628271356
Energy: 1.3263956870303666
Energy: 1.3185233628281847
Energy: 1.3263956870408595
Energy: 1.3185233628659117
Energy: 1.296283411725266
Energy: 1.2508740997567334
Energy: 1.296283411725266
Energy: 1.2508740997577825
Energy: 1.2962834117263151
Energy: 1.2508740997567334

minimum gb energy = 1.224859209808011 eV
minimum distance =  2.25055880120703 Angstroms
sigma value = 19


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

Energy: 1.2289530454568047
Energy: 1.288544837785542
Energy: 1.1512914101919371
Energy: 1.28854483778492
Energy: 1.2289530454561823
Energy: 1.288544837783675
Energy: 1.297102230239309
Energy: 1.2912577548536848
Energy: 1.2971022302405537
Energy: 1.2912577548549296
Energy: 1.297102230241176
Energy: 1.2912577548549296
Energy: 1.1589482724743476
Energy: 1.2889071537331278
Energy: 1.1589482724731026
Energy: 1.2889071537337502
Energy: 1.1589482724731026
Energy: 1.2889071537337502
Energy: 1.346421514178365
Energy: 1.1590690719605485
Energy: 1.34642151417961
Energy: 1.1590960098452914
Energy: 1.3464215141802323
Energy: 1.159069071961171
Energy: 1.243817212413051
Energy: 1.1892453697707535
Energy: 1.243817212414296
Energy: 1.1505299119618058
Energy: 1.243817212413051
Energy: 1.1892453697707535
Energy: 1.126024757886163
Energy: 1.189585923724003
Energy: 1.1260247578867857
Energy: 1.1503932639058767
Energy: 1.126024757886163
Energy: 1.1895859237252477
Energy: 1.2100674899193538
Energy: 1.1589748472579204
Energy: 1.2100674899212214
Energy: 1.158974847257298
Energy: 1.2100674899187316
Energy: 1.1589748472579204
Energy: 1.1592090837444826
Energy: 1.4112768251383385
Energy: 1.1592172100064846
Energy: 1.4112768251358487
Energy: 1.1592090837426154
Energy: 1.4112768251414505
Energy: 1.2297498892612027
Energy: 1.3379658087082826
Energy: 1.2297498892618248
Energy: 1.3379658087089052
Energy: 1.22974988926058
Energy: 1.3379658087089052
Energy: 1.1512914101919371
Energy: 1.28854483778492
Energy: 1.1512914101913148
Energy: 1.28854483778492
Energy: 1.1512914101919371
Energy: 1.288544837783675
Energy: 1.2971022302405537
Energy: 1.2912577548536848
Energy: 1.297102230239309
Energy: 1.2912577548549296
Energy: 1.297102230241176
Energy: 1.2912577548536848
Energy: 1.1589482724743476
Energy: 1.2889071537349952
Energy: 1.1589482724731026
Energy: 1.2889071537349952
Energy: 1.1589482724731026
Energy: 1.2889071537337502
Energy: 1.346421514178365
Energy: 1.1591159480990312
Energy: 1.3464215141789875
Energy: 1.159073991129908
Energy: 1.34642151417961
Energy: 1.1591159480977866
Energy: 1.2438172124124287
Energy: 1.1505299119611831
Energy: 1.2438172124136735
Energy: 1.18924693651316
Energy: 1.2438172124136735
Energy: 1.1505299119618058
Energy: 1.126024757886163
Energy: 1.1503932639077439
Energy: 1.1260247578880305
Energy: 1.1896348320291148
Energy: 1.1260247578880305
Energy: 1.1503932639064989
Energy: 1.2100674899193538
Energy: 1.1589748472579204
Energy: 1.2100674899205988
Energy: 1.158974847257298
Energy: 1.2100674899187316
Energy: 1.1589748472579204
Energy: 1.1590207184760082
Energy: 1.4112768251383385
Energy: 1.1592406921284184
Energy: 1.4112768251402057
Energy: 1.1590207184760082
Energy: 1.4112768251414505
Energy: 1.2269432564818383
Energy: 1.337965808707038
Energy: 1.2297498892612027
Energy: 1.3379658087076605
Energy: 1.2269432564793485
Energy: 1.3379658087089052
Energy: 1.2289530454561823
Energy: 1.2885448377842974
Energy: 1.1512914101919371
Energy: 1.2885448377842974
Energy: 1.2289530454561823
Energy: 1.2885448377842974
Energy: 1.2971022302405537
Energy: 1.2912577548543072
Energy: 1.2971022302424209
Energy: 1.2912577548549296
Energy: 1.2971022302417985
Energy: 1.2912577548543072
Energy: 1.1589482724737252
Energy: 1.2889071537331278
Energy: 1.1589482724731026
Energy: 1.2889071537349952
Energy: 1.1589482724731026
Energy: 1.2889071537337502
Energy: 1.3464215141777425
Energy: 1.1590690719605485
Energy: 1.34642151417961
Energy: 1.1590960098446688
Energy: 1.34642151417961
Energy: 1.159069071961793
Energy: 1.243817212413051
Energy: 1.1892453697707535
Energy: 1.2438172124136735
Energy: 1.1505299119611831
Energy: 1.2438172124136735
Energy: 1.1892453697707535
Energy: 1.126024757887408
Energy: 1.1895859237246253
Energy: 1.1260247578880305
Energy: 1.1503932639058767
Energy: 1.1260247578886529
Energy: 1.1895859237246253
Energy: 1.2100674899199764
Energy: 1.1589748472579204
Energy: 1.2100674899212214
Energy: 1.1589748472579204
Energy: 1.2100674899193538
Energy: 1.1589748472579204
Energy: 1.1592090837438604
Energy: 1.4112768251370935
Energy: 1.159217210007107
Energy: 1.4112768251352266
Energy: 1.1592090837426154
Energy: 1.4112768251383385
Energy: 1.2297498892612027
Energy: 1.337965808707038
Energy: 1.2297498892618248
Energy: 1.3379658087082826
Energy: 1.22974988926058
Energy: 1.3379658087082826
Energy: 1.1512914101913148
Energy: 1.288544837785542
Energy: 1.1512914101913148
Energy: 1.288544837785542
Energy: 1.1512914101919371
Energy: 1.2885448377842974
Energy: 1.297102230241176
Energy: 1.2912577548536848
Energy: 1.2971022302399313
Energy: 1.2912577548543072
Energy: 1.2971022302417985
Energy: 1.2912577548543072
Energy: 1.1589482724737252
Energy: 1.2889071537349952
Energy: 1.1589482724731026
Energy: 1.2889071537349952
Energy: 1.1589482724731026
Energy: 1.2889071537343726

minimum gb energy = 1.126024757886163 eV
minimum distance =  2.24952811855564 Angstroms
sigma value = 27


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

Energy: 1.1114971016312276
Energy: 1.0667255660645856
Energy: 1.1114971016297033
Energy: 1.0667255660645856
Energy: 1.1114971016297033
Energy: 1.0667255660645856
Energy: 1.3743525497856304
Energy: 1.0209696825468793
Energy: 1.3743525497856304
Energy: 1.0207508798490963
Energy: 1.3743525497856304
Energy: 1.020969298103644
Energy: 1.1423462025302198
Energy: 1.2848109949407893
Energy: 1.1423462025302198
Energy: 1.2848109949407893
Energy: 1.1423462025302198
Energy: 1.2848109949407893
Energy: 1.2032377673142862
Energy: 1.0345837723856257
Energy: 1.2032377673142862
Energy: 1.0345837723841012
Energy: 1.2032377673142862
Energy: 1.0345837723841012
Energy: 1.242711128620317
Energy: 1.0345728972736707
Energy: 1.2427111286218413
Energy: 1.034572897272146
Energy: 1.242711128623366
Energy: 1.034572897272146
Energy: 1.1902108588888476
Energy: 1.2831957345053717
Energy: 1.1902108588888476
Energy: 1.2831957345053717
Energy: 1.1902108588888476
Energy: 1.2831957345053717
Energy: 1.0348040911116327
Energy: 1.1114404101696729
Energy: 1.0348040911101084
Energy: 1.1114404101681485
Energy: 1.0348040911421246
Energy: 1.1114404101681485
Energy: 1.109704820885731
Energy: 1.071900304920281
Energy: 1.109704820885731
Energy: 1.071900304920281
Energy: 1.109704820885731
Energy: 1.071900304920281
Energy: 1.1361053534836332
Energy: 1.1186275847839475
Energy: 1.1361053534821086
Energy: 1.1186275847869969
Energy: 1.1361053534836332
Energy: 1.1186275847869969
Energy: 1.1902708625400067
Energy: 1.2060702144669098
Energy: 1.1902708625400067
Energy: 1.2060702144684345
Energy: 1.1902708625400067
Energy: 1.2060702144669098
Energy: 1.130741138022284
Energy: 1.035003842601807
Energy: 1.130741138022284
Energy: 1.035003842601807
Energy: 1.1307411380238086
Energy: 1.035003842601807
Energy: 1.2422832084574897
Energy: 1.134768289121612
Energy: 1.2422832084574897
Energy: 1.134768289121612
Energy: 1.2422832084574897
Energy: 1.1347682891231365

minimum gb energy = 1.0207508798490963 eV
minimum distance =  2.24405283255095 Angstroms
sigma value = 9


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

Energy: 1.0113748684826884
Energy: 1.0824413651689133
Energy: 1.0113748684826884
Energy: 1.0824413651693419
Energy: 1.0113748684835455
Energy: 1.0824413651693419
Energy: 1.3856135799524332
Energy: 0.9213430306186318
Energy: 1.3856135799515763
Energy: 0.9213430306182034
Energy: 1.3856135799520046
Energy: 0.9213430306186318
Energy: 0.9501447703337271
Energy: 1.0964752222174707
Energy: 0.950144770335869
Energy: 1.0964752222174707
Energy: 0.9501447703345838
Energy: 1.096475222100136
Energy: 0.9654980697773905
Energy: 0.9343363079716556
Energy: 0.9654980697782471
Energy: 0.9343363082302755
Energy: 0.9654980697778189
Energy: 0.934336309906185
Energy: 1.0350053322409203
Energy: 1.0153907088342224
Energy: 1.0350053322417772
Energy: 1.0153907088329375
Energy: 1.0350053322409203
Energy: 1.0153907088333658
Energy: 1.0362737788098426
Energy: 1.0332706698452403
Energy: 1.036273778821837
Energy: 0.9992438447096899
Energy: 1.036273778808986
Energy: 0.9992438447041209
Energy: 0.9577985361474447
Energy: 1.034056948725642
Energy: 0.9577985361483015
Energy: 1.0340569487483455
Energy: 0.9577985361521567
Energy: 1.0340569487290687
Energy: 0.905366603494377
Energy: 1.1449064611461242
Energy: 0.9053666034948052
Energy: 1.1449064611461242
Energy: 0.9053666034948052
Energy: 1.1449064611465525
Energy: 1.006057112892744
Energy: 1.0169206817018954
Energy: 1.0060571128918872
Energy: 1.0169206817023237
Energy: 1.0060571128906022
Energy: 1.016920681701467
Energy: 1.0448717512319539
Energy: 1.1596589796667176
Energy: 1.0448717512332388
Energy: 1.1596589796680028
Energy: 1.044871751232382
Energy: 1.1596589796675743
Energy: 0.9655679676921837
Energy: 0.9395095198878759
Energy: 0.9655679676900417
Energy: 0.9395095198874475
Energy: 0.9655679676883283
Energy: 0.9395095198870191
Energy: 0.97698325688184
Energy: 1.043054566833415
Energy: 0.97698325688184
Energy: 1.0430755942295846
Energy: 0.9769832568814117
Energy: 1.0430739291520945
Energy: 0.9928089566107746
Energy: 0.9815436090790842
Energy: 0.9928089566129166
Energy: 0.9815436090739438
Energy: 0.9928089566056342
Energy: 0.9815436090795127
Energy: 1.006731136553951
Energy: 0.9555516026168521
Energy: 1.0067311365522376
Energy: 0.9555516026172803
Energy: 1.0067311365543794
Energy: 0.9555516026172803
Energy: 0.9465857958485419
Energy: 1.023631439240303
Energy: 0.9465857958476851
Energy: 1.02363143924116
Energy: 0.9465857958481136
Energy: 1.02363143924116
Energy: 0.9312977570478956
Energy: 0.9697244019882041
Energy: 0.9312977570457537
Energy: 0.9697244020031971
Energy: 0.9312977570491806
Energy: 0.9697244020014836
Energy: 1.2276398169265266
Energy: 0.934466886499293
Energy: 1.2276398169260985
Energy: 0.9344668871167332
Energy: 1.2276398169260985
Energy: 0.9344668873483658
Energy: 0.9600799563719189
Energy: 1.038575029731254
Energy: 0.9600799563723473
Energy: 1.0385750297321106
Energy: 0.9600799563727755
Energy: 1.038575029731254
Energy: 0.9019980573221984
Energy: 1.3177771772381075
Energy: 0.901998057367606
Energy: 1.3177771772385358
Energy: 0.90199805732177
Energy: 1.317777177238964
Energy: 1.234517972774222
Energy: 1.1259682152338117
Energy: 1.234517972775507
Energy: 1.12596821523424
Energy: 1.2345179727746503
Energy: 1.1259682152338117
Energy: 0.902004279439079
Energy: 1.3178814803384313
Energy: 0.9020042794412209
Energy: 1.3178814803388597
Energy: 0.9020042794279414
Energy: 1.3178814803384313
Energy: 0.9600860014367512
Energy: 0.9893923009205381
Energy: 0.9600860014376081
Energy: 0.9893923009209663
Energy: 0.9600860014384648
Energy: 0.9893923009205381
Energy: 1.2276828365596657
Energy: 0.9347089859311306
Energy: 1.2276828365605224
Energy: 0.9347089859251335
Energy: 1.2276828365600938
Energy: 0.9347089859204214
Energy: 0.9314848262916466
Energy: 0.9812619602402196
Energy: 0.9314848262916466
Energy: 0.981261960239363
Energy: 0.9314848262920751
Energy: 0.9812619602205146
Energy: 0.9465415427348371
Energy: 1.0235074007111016
Energy: 0.9465415427344087
Energy: 1.0235074007085312
Energy: 0.9465415427344087
Energy: 1.0235074007089597
Energy: 1.0068375412261918
Energy: 1.0093723195814281
Energy: 1.0068375412236217
Energy: 1.0093723195827131
Energy: 1.0068375412253352
Energy: 1.0093723195822848
Energy: 0.9943578919773302
Energy: 0.9820529042297058
Energy: 0.9943578919636613
Energy: 0.9820529042382734
Energy: 0.9943578919790437
Energy: 0.9820529042399868
Energy: 0.9769930677396849
Energy: 0.975143554032825
Energy: 0.9769930677396849
Energy: 0.9751435540482075
Energy: 0.9769930677392565
Energy: 0.9751435540691977
Energy: 0.965210347119629
Energy: 0.9396999593421848
Energy: 0.9652103471217711
Energy: 0.9396999593426131
Energy: 0.9652103471234844
Energy: 0.9396999593426131
Energy: 1.0448249468685908
Energy: 0.9574880905371768
Energy: 1.0448249468681625
Energy: 0.957488090534178
Energy: 1.0448249468681625
Energy: 0.9574880905264674
Energy: 1.0067855116332822
Energy: 1.0169707792158393
Energy: 1.0067855116324256
Energy: 1.0169707792149827
Energy: 1.0067855116379945
Energy: 1.016970779215411
Energy: 0.9053298348024752
Energy: 1.145218618417932
Energy: 0.9053298348033318
Energy: 1.145218618416647
Energy: 0.9053298348033318
Energy: 1.1452186184170754
Energy: 0.957222203009508
Energy: 1.0342029200554634
Energy: 0.9572222030133634
Energy: 1.034202920055853
Energy: 0.957222203003939
Energy: 1.0342029200550351
Energy: 1.0366000495329646
Energy: 1.0018138105250436
Energy: 1.0366000495351064
Energy: 1.0018138105263288
Energy: 1.0366000495359633
Energy: 1.0018138105280425
Energy: 1.0347391862534812
Energy: 1.0160986770910574
Energy: 1.0347391862534812
Energy: 1.0160986770914857
Energy: 1.0347391862534812
Energy: 1.016098677092771
Energy: 0.9655218106228968
Energy: 0.9346564086936359
Energy: 0.9655218106228968
Energy: 0.9346564090588817
Energy: 0.9655218106211833
Energy: 0.934656409016473
Energy: 0.9501370603006398
Energy: 1.096662067440601
Energy: 0.9501370603019248
Energy: 1.0966620674401726
Energy: 0.9501370603019248
Energy: 1.0966620674397443
Energy: 1.3860754074894086
Energy: 0.8760157139835654
Energy: 1.3860754074902653
Energy: 0.8760157139839936
Energy: 1.3860754074894086
Energy: 0.8760157139835654
Energy: 1.0113748684848307
Energy: 1.0824413651693419
Energy: 1.0113748684835455
Energy: 1.0824413651689133
Energy: 1.0113748684826884
Energy: 1.0824413651684852
Energy: 1.3856135799550036
Energy: 0.9213430306177751
Energy: 1.3856135799550036
Energy: 0.9213430306203454
Energy: 1.3856135799558602
Energy: 0.9213430306173468
Energy: 0.9501447703354405
Energy: 1.0964752222684082
Energy: 0.9501447703375825
Energy: 1.0964752223656098
Energy: 0.9501447703367256
Energy: 1.0964752222744054
Energy: 0.9654980697786757
Energy: 0.9343363073824489
Energy: 0.9654980697773905
Energy: 0.934336308015739
Energy: 0.9654980697773905
Energy: 0.9343363074984988
Energy: 1.0350053322413488
Energy: 1.0153907088342224
Energy: 1.0350053322413488
Energy: 1.0153907088337943
Energy: 1.0350053322409203
Energy: 1.0153907088363645

minimum gb energy = 0.8760157139835654 eV
minimum distance =  2.31271339786508 Angstroms
sigma value = 57


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

Energy: 0.3953393963653425
Energy: 0.40823494254323967
Energy: 0.3953393963653425
Energy: 0.40823494254421483
Energy: 0.3953393963653425
Energy: 0.40823494254421483
Energy: 0.5625251325226229
Energy: 0.6006850799950763
Energy: 0.5625251325235979
Energy: 0.6006850799950763
Energy: 0.5625251325226229
Energy: 0.6006850799950763
Energy: 0.47058161436912094
Energy: 0.536083583758163
Energy: 0.470581614370096
Energy: 0.536083583758163
Energy: 0.47058161436912094
Energy: 0.536083583758163
Energy: 0.4097184308816818
Energy: 0.3951116619366144
Energy: 0.4097184308797316
Energy: 0.3951116619375895
Energy: 0.4097184308797316
Energy: 0.3951116619375895
Energy: 0.5625667180441818
Energy: 0.5675315008696606
Energy: 0.5625667180432067
Energy: 0.5675315008696606
Energy: 0.5625667180441818
Energy: 0.5675315008696606
Energy: 0.39539569162151805
Energy: 0.47001577821112833
Energy: 0.39539569162151805
Energy: 0.4700157782101533
Energy: 0.39539569162151805
Energy: 0.47001577821112833
Energy: 0.39539172956293256
Energy: 0.47010326271247965
Energy: 0.39539172956293256
Energy: 0.47010326271247965
Energy: 0.39539172956390767
Energy: 0.47010326271247965
Energy: 0.56255800309777
Energy: 0.5675048898036846
Energy: 0.5625580030967949
Energy: 0.5675048898036846
Energy: 0.5625580030967949
Energy: 0.5675048898036846
Energy: 0.4096759244693341
Energy: 0.39510441229515847
Energy: 0.40967592447030915
Energy: 0.39510441229515847
Energy: 0.40967592447030915
Energy: 0.39510441229515847
Energy: 0.4705276698862522
Energy: 0.5358576006630993
Energy: 0.4705276698852771
Energy: 0.5358576006640745
Energy: 0.4705276698852771
Energy: 0.5358576006640745
Energy: 0.5625063999502357
Energy: 0.6006276543837707
Energy: 0.5625063999512108
Energy: 0.6006276543856767
Energy: 0.5625063999512108
Energy: 0.600627654384746
Energy: 0.3953393963653425
Energy: 0.40823494254421483
Energy: 0.3953393963653425
Energy: 0.40823494254421483
Energy: 0.3953393963653425
Energy: 0.40823494254421483
Energy: 0.5625251325226229
Energy: 0.6006850799950763
Energy: 0.5625251325226229
Energy: 0.6006850799950763
Energy: 0.5625251325226229
Energy: 0.6006850799950763
Energy: 0.47058161436912094
Energy: 0.5360835837601132
Energy: 0.47058161436814583
Energy: 0.536083583758163
Energy: 0.47058161436912094
Energy: 0.5360835837601132
Energy: 0.4097184308797316
Energy: 0.3951116619366144
Energy: 0.4097184308807067
Energy: 0.39511166193563924
Energy: 0.4097184308807067
Energy: 0.3951116619375895
Energy: 0.5625667180441818
Energy: 0.5675315008686855
Energy: 0.5625667180441818
Energy: 0.5675315008696606
Energy: 0.5625667180441818
Energy: 0.5675315008696606
Energy: 0.39539569162151805
Energy: 0.4700157782101533
Energy: 0.39539569162151805
Energy: 0.4700157782101533
Energy: 0.39539569162151805
Energy: 0.47001577821112833
Energy: 0.39539172956390767
Energy: 0.47010326271247965
Energy: 0.39539172956293256
Energy: 0.47010326271247965
Energy: 0.39539172956293256
Energy: 0.47010326271345476
Energy: 0.56255800309777
Energy: 0.5675048898046599
Energy: 0.5625580030967949
Energy: 0.5675048898036846
Energy: 0.56255800309777
Energy: 0.5675048898046599

minimum gb energy = 0.39510441229515847 eV
minimum distance =  2.39383216948565 Angstroms
sigma value = 11


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

Energy: 0.8884382913916093
Energy: 0.9980473578152735
Energy: 0.888438291390895
Energy: 0.9980473578152735
Energy: 0.8884382913923237
Energy: 0.9980473578145592
Energy: 0.9574585365826793
Energy: 0.8725567357956535
Energy: 0.957458536586251
Energy: 0.8725567357963678
Energy: 0.9574585365855367
Energy: 0.8725567357970822
Energy: 0.9971827161383836
Energy: 1.3798119597896557
Energy: 0.9971827161376694
Energy: 1.3798119597896557
Energy: 0.9971827161376694
Energy: 1.3798119597889413
Energy: 1.1364187347122425
Energy: 0.7964032224439612
Energy: 1.1364187347122425
Energy: 0.7964032224446754
Energy: 1.1364187347122425
Energy: 0.7964032224446754
Energy: 0.9595759778951186
Energy: 0.7596005675266041
Energy: 0.9595759778958329
Energy: 0.7596005675273183
Energy: 0.9595759778951186
Energy: 0.7596005675266041
Energy: 0.9265863089622229
Energy: 0.7869754109109193
Energy: 0.9265863089622229
Energy: 0.7869754109116336
Energy: 0.9265863089629371
Energy: 0.7869754109095557
Energy: 0.8332892284767781
Energy: 1.0456716876184715
Energy: 0.7527822206543043
Energy: 1.0456716876184715
Energy: 0.7527822206564473
Energy: 1.0456716876191856
Energy: 0.9952332045745841
Energy: 0.7223919674578138
Energy: 0.9952332045745841
Energy: 0.7223919674578138
Energy: 0.9952332045738698
Energy: 0.7223919674578138
Energy: 0.9899126392068445
Energy: 0.7273121141860648
Energy: 0.9899126392068445
Energy: 0.727312114184636
Energy: 0.9899126392068445
Energy: 0.7273121141860648
Energy: 0.7443953113681492
Energy: 1.0903378166041022
Energy: 0.7443953113660062
Energy: 1.0903378166069595
Energy: 0.7443953113652919
Energy: 1.0903378166091022
Energy: 1.1734158872765688
Energy: 0.937235123934642
Energy: 1.1734158872765688
Energy: 0.937235123934642
Energy: 1.1734158872758544
Energy: 0.9372351239353562
Energy: 0.9642415560691782
Energy: 0.7620972944442692
Energy: 0.9642415560684638
Energy: 0.7620972944456978
Energy: 0.9642415560684638
Energy: 0.7620972944442692
Energy: 1.0192044595598655
Energy: 0.802698416978688
Energy: 1.0192044595598655
Energy: 0.8026984169779738
Energy: 1.0192044595598655
Energy: 0.8026984169794024
Energy: 1.0610287249912258
Energy: 1.335498937384697
Energy: 1.06102872499194
Energy: 1.3354989373875543
Energy: 1.06102872499194
Energy: 1.3354989373854114
Energy: 1.0291180451671302
Energy: 0.870208359785488
Energy: 1.029118045170702
Energy: 0.870208359787631
Energy: 1.0291180451678448
Energy: 0.8702083597862024
Energy: 0.826674943176886
Energy: 1.0003886283494146
Energy: 0.8266749435995578
Energy: 1.0003886283494146
Energy: 0.826674943488906
Energy: 1.0003886283501289
Energy: 0.8793461731005462
Energy: 0.8654757662289465
Energy: 0.8793461730991174
Energy: 0.8654757662282322
Energy: 0.8793461731005462
Energy: 0.8654757662289465
Energy: 1.22864172748314
Energy: 1.1954571064800121
Energy: 1.22864172748314
Energy: 1.1954571064800121
Energy: 1.22864172748314
Energy: 1.1954571064807265
Energy: 1.1362538236972761
Energy: 0.7918923196609959
Energy: 1.1362538236979904
Energy: 0.7918923196602817
Energy: 1.1362538236965618
Energy: 0.7918923196602817
Energy: 0.9641704666778834
Energy: 0.8850453522754655
Energy: 0.9641704666771692
Energy: 0.8850453522747512
Energy: 0.9641704666778834
Energy: 0.8850453522747512
Energy: 0.745708608723487
Energy: 0.7903753572956436
Energy: 0.745708608723487
Energy: 0.7903753572928514
Energy: 0.7457086087213441
Energy: 0.7903753572914227
Energy: 1.0119744860784972
Energy: 0.980789779329474
Energy: 1.0119744860777828
Energy: 0.9811544833663076
Energy: 1.0119744860792115
Energy: 0.980786229021485
Energy: 1.0006821263727375
Energy: 0.8951332657814566
Energy: 1.0006821263727375
Energy: 0.8951332657793136
Energy: 1.0006821263727375
Energy: 0.8951332657807423
Energy: 0.9910875735864537
Energy: 0.8580661588572822
Energy: 0.9910875735864537
Energy: 0.8580661588551394
Energy: 0.9910875735864537
Energy: 0.8580661588565679
Energy: 0.7455042009762692
Energy: 1.0908246200001432
Energy: 0.7455042009755549
Energy: 1.0908246199887142
Energy: 0.7455042009755549
Energy: 1.0908246200001432
Energy: 1.3967201054911844
Energy: 0.9366124830311593
Energy: 1.3967201054911844
Energy: 0.9366124830340165
Energy: 1.3967201054911844
Energy: 0.9366124830347308

minimum gb energy = 0.7223919674578138 eV
minimum distance =  2.30723921600942 Angstroms
sigma value = 41


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

Energy: 1.002882530371423
Energy: 0.8681119585758846
Energy: 1.002882530371423
Energy: 0.8681119585747585
Energy: 1.0028825303708602
Energy: 0.8681119585736325
Energy: 1.1079540329943987
Energy: 1.0487855940019646
Energy: 1.1079540329943987
Energy: 1.0487855940019646
Energy: 1.1079540329943987
Energy: 1.0487855940025275
Energy: 1.3609125525470704
Energy: 1.0474047769529578
Energy: 1.3609125525476333
Energy: 1.0474047769523946
Energy: 1.3609125525476333
Energy: 1.0474047769523946
Energy: 0.9304666172212608
Energy: 0.8580143500523063
Energy: 0.9304666172212608
Energy: 0.8580143500534322
Energy: 0.9304666172229498
Energy: 0.8580143500545583
Energy: 0.8271389284477549
Energy: 0.9156649453246936
Energy: 0.8271389284477549
Energy: 0.9156649453258198
Energy: 0.827138928448881
Energy: 0.9156649453246936
Energy: 1.0815104946729033
Energy: 1.066341922744612
Energy: 1.081510494674592
Energy: 1.066341922744612
Energy: 1.081510494674029
Energy: 1.0663419227451751
Energy: 0.8517142094532781
Energy: 1.2026404501603385
Energy: 0.851714209452152
Energy: 1.2026404501592636
Energy: 0.851714209452152
Energy: 1.2026404501603385
Energy: 0.8269471951637739
Energy: 0.8583356840863479
Energy: 0.8269471951626478
Energy: 0.8583356840869109
Energy: 0.8269471951626478
Energy: 0.8583356840857851
Energy: 0.843031109447486
Energy: 0.8917061236848636
Energy: 0.843031109447486
Energy: 0.8917061236843006
Energy: 0.843031109447486
Energy: 0.8917061236848636
Energy: 0.9297808930790127
Energy: 0.9589195127637982
Energy: 0.9297808930795757
Energy: 0.9589195127649242
Energy: 0.9297808930795757
Energy: 0.9589195127632352
Energy: 0.9215606160322193
Energy: 1.0450184290479148
Energy: 0.9215606160322193
Energy: 1.0450184290467888
Energy: 0.9215606160327822
Energy: 1.0450184290496036
Energy: 0.8136916660203766
Energy: 1.0196944026948223
Energy: 0.8136916660226287
Energy: 1.0196944026953854
Energy: 0.8136916660215026
Energy: 1.0196944026948223
Energy: 0.8260821242257741
Energy: 0.8567875357030389
Energy: 0.8260821242263371
Energy: 0.8567875357013498
Energy: 0.8260821242263371
Energy: 0.8567875357002238
Energy: 0.7923601195472912
Energy: 1.2173380047422402
Energy: 0.7923601195472912
Energy: 1.2173380047411142
Energy: 0.7923601195472912
Energy: 1.2173380047371734
Energy: 1.077567803985747
Energy: 1.0637204460417953
Energy: 1.077567803986873
Energy: 1.0637204460440473
Energy: 1.0775678039863101
Energy: 1.0637204460412324
Energy: 0.7893853065770972
Energy: 1.0407731287319446
Energy: 0.7893853065782231
Energy: 1.0407731287319446
Energy: 0.7893853065765342
Energy: 1.0407731287319446
Energy: 0.8417610594600514
Energy: 0.856484029595974
Energy: 0.8417610594600514
Energy: 0.8564840295987888
Energy: 0.8417610594594884
Energy: 0.8564840295976629
Energy: 0.8694411058910468
Energy: 1.3088879939332358
Energy: 0.869441105890484
Energy: 1.3088879939326727
Energy: 0.869441105888232
Energy: 1.3088879939343616
Energy: 1.1068122967399863
Energy: 1.1334791072259605
Energy: 1.1068122967405492
Energy: 1.1334791072259605
Energy: 1.1068122967394232
Energy: 1.1334791072259605
Energy: 0.92050645633838
Energy: 0.8631574870714022
Energy: 0.92050645633838
Energy: 0.8631574870708392
Energy: 0.920506456337817
Energy: 0.8631574870719652
Energy: 0.8450630263456932
Energy: 1.0409269554302918
Energy: 0.8450630263473821
Energy: 1.040926955429729
Energy: 0.8450630263468192
Energy: 1.0409269554291658
Energy: 1.2714977856949157
Energy: 1.5888913572628365
Energy: 1.2714977856943528
Energy: 1.5888913572628365
Energy: 1.2714977856926635
Energy: 1.5888913572628365
Energy: 0.9302169830354677
Energy: 0.8554102767836587
Energy: 0.9302169830320899
Energy: 0.8554102767836587
Energy: 0.930216983034342
Energy: 0.8554102767830958
Energy: 0.7892348052836929
Energy: 1.037807466241594
Energy: 0.789234805280315
Energy: 1.0378074662421568
Energy: 0.789234805282567
Energy: 1.037807466241594
Energy: 0.7907093436548338
Energy: 1.0756677911969623
Energy: 0.7907093436542708
Energy: 1.0756677911963992
Energy: 0.7907093436548338
Energy: 1.0756677911975252
Energy: 0.85055869569954
Energy: 1.2191490025204088
Energy: 0.8505586956972879
Energy: 1.219149002520972
Energy: 0.850558695698977
Energy: 1.219149002520972
Energy: 0.8268232168560837
Energy: 0.8554926034193411
Energy: 0.8268232168555207
Energy: 0.8554926034193411
Energy: 0.8268232168555207
Energy: 0.8554926034193411
Energy: 0.8413912085260746
Energy: 1.021847490365491
Energy: 0.8413912085249485
Energy: 1.021847490366054
Energy: 0.8413912085255116
Energy: 1.021847490365491
Energy: 0.9205159907734392
Energy: 1.0523591496204363
Energy: 0.9205159907706241
Energy: 1.0523591496204363
Energy: 0.9205159907717503
Energy: 1.0523591496204363
Energy: 1.2886118216881706
Energy: 1.167014355664069
Energy: 1.2886118216881706
Energy: 1.1670143556646322
Energy: 1.2886118216881706
Energy: 1.1670143556646322
Energy: 0.8207345868774594
Energy: 1.0136955413460123
Energy: 0.8207345868768964
Energy: 1.0136955413454494
Energy: 0.8207345868763333
Energy: 1.0136955413454494
Energy: 0.8568059477193073
Energy: 0.8939058035419016
Energy: 0.8568059477187444
Energy: 0.8939058035419016
Energy: 0.8568059477187444
Energy: 0.8939058035424645
Energy: 0.7994656518246324
Energy: 1.0425343917253278
Energy: 0.7994656518246324
Energy: 1.0425343917258907
Energy: 0.7994656518246324
Energy: 1.0425343917247647

minimum gb energy = 0.789234805280315 eV
minimum distance =  2.34438068255444 Angstroms
sigma value = 33


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

Energy: 1.058656967074369
Energy: 0.9490316426075136
Energy: 1.0039831207348444
Energy: 0.9490316426078729
Energy: 1.0586569670735788
Energy: 0.949031642608663
Energy: 1.0755528083111179
Energy: 0.907784611251263
Energy: 1.075552808267296
Energy: 0.9077846112516224
Energy: 1.0755528081365497
Energy: 0.907784611251263
Energy: 0.9791843924678943
Energy: 1.2355168035373978
Energy: 0.9791843924650927
Energy: 1.2355168035373978
Energy: 0.9791843924647335
Energy: 1.2355168035361768
Energy: 1.010405454299117
Energy: 0.9337249510243939
Energy: 1.0104054542959557
Energy: 0.9337249510251842
Energy: 1.0104054542995478
Energy: 0.9337249510255434
Energy: 0.9663616511239485
Energy: 0.9368922141241045
Energy: 0.9663760346135922
Energy: 0.9368922141248948
Energy: 0.9663616511235894
Energy: 0.9368922141252538
Energy: 1.2431692078507117
Energy: 0.9215393041620094
Energy: 1.2431692078530825
Energy: 0.9215393041620094
Energy: 1.243169207851502
Energy: 0.9215393041659604
Energy: 0.9581007396329733
Energy: 1.144800775640323
Energy: 0.958100739632614
Energy: 1.1448007755968606
Energy: 0.9581007396321829
Energy: 1.144800775609145
Energy: 1.042128562725619
Energy: 0.9802106599790398
Energy: 1.0421285627240384
Energy: 0.9802106599782496
Energy: 1.042128562725978
Energy: 0.9802106599806203
Energy: 0.9636823597596916
Energy: 0.9911810519167302
Energy: 0.9637170917498747
Energy: 0.9911810519163708
Energy: 0.9636823597617029
Energy: 0.9911810519140002
Energy: 1.3098684428780174
Energy: 0.9460211887596909
Energy: 1.3098684428756469
Energy: 0.9460211887596909
Energy: 1.3098684428784486
Energy: 0.9460211887616307
Energy: 1.0173150352981093
Energy: 0.9682605612124763
Energy: 1.0173150352953795
Energy: 0.9682605612120452
Energy: 1.0173150352961695
Energy: 0.9682605612120452
Energy: 1.23910294586813
Energy: 0.9336617000205111
Energy: 1.2391029458689202
Energy: 0.9336617000205111
Energy: 1.2391029458689202
Energy: 0.9336617000220916
Energy: 0.9457179491412985
Energy: 0.9640059337644649
Energy: 0.9457179491408673
Energy: 0.9640059337641055
Energy: 0.9457179491408673
Energy: 0.9640059337609447
Energy: 0.9963992251515882
Energy: 1.02380984898888
Energy: 0.9963992251523784
Energy: 1.02380984898888
Energy: 0.9963992251523784
Energy: 1.0238098489852883
Energy: 0.9832570408515858
Energy: 0.9097206494931356
Energy: 0.9832570408507956
Energy: 0.9097206494927045
Energy: 0.983257040851155
Energy: 0.9097206494934946
Energy: 0.9783273827102057
Energy: 1.2387298588411217
Energy: 0.9783273827117862
Energy: 1.2387298588411217
Energy: 0.9783273827113552
Energy: 1.2387298588387512
Energy: 0.8843493083879826
Energy: 0.9263164593264169
Energy: 0.8843493083879826
Energy: 0.9263164593284282
Energy: 0.8843493083887729
Energy: 0.9263164593272071
Energy: 0.9286031535547816
Energy: 0.9813628301763069
Energy: 0.9286047727357731
Energy: 0.9813628293015265
Energy: 0.9286031535539914
Energy: 0.9813628299255179
Energy: 1.290074448083066
Energy: 1.048682360220966
Energy: 1.290074448083066
Energy: 1.048682360238279
Energy: 1.290074448083066
Energy: 1.0486823602469717
Energy: 1.2185014647608086
Energy: 0.9396021981832092
Energy: 1.218501464759659
Energy: 0.9396021981839995
Energy: 1.2185014647600183
Energy: 0.9396021981836403
Energy: 0.9318242954678889
Energy: 1.0128595624121965
Energy: 0.9318242954674578
Energy: 1.0128595624129868
Energy: 0.9318242954690383
Energy: 1.012859562411047
Energy: 0.9027558714291054
Energy: 1.0759241858102835
Energy: 0.9027074890085922
Energy: 1.0759241845674015
Energy: 0.9027558714291054
Energy: 1.0759241843466407
Energy: 1.2243150879327018
Energy: 1.2157049261096307
Energy: 1.224315087933923
Energy: 1.2157049261091994
Energy: 1.2243150879331328
Energy: 1.2157049261096307
Energy: 0.9280658877542669
Energy: 1.009969943340681
Energy: 0.9280658877507467
Energy: 1.009969943340681
Energy: 0.9280658877534766
Energy: 1.0099699433391007
Energy: 0.9309860043909323
Energy: 0.926433572732781
Energy: 0.9309860043909323
Energy: 0.92643357273235
Energy: 0.9309860043921536
Energy: 0.926433572732781
Energy: 0.9175423944802831
Energy: 1.2388512133407354
Energy: 0.9175423944814324
Energy: 1.2388512133411664
Energy: 0.9175423944806422
Energy: 1.2388512133435372
Energy: 1.0272714432688705
Energy: 0.9611906630456194
Energy: 1.0272714432693018
Energy: 0.9611906630444701
Energy: 1.0272714432680803
Energy: 0.9611906630397288
Energy: 1.0361675102891266
Energy: 0.9277673342906357
Energy: 0.9906239418241118
Energy: 0.9277673342917852
Energy: 1.0361675102899168
Energy: 0.9277673342902046
Energy: 0.9906669822845738
Energy: 0.9637928008659857
Energy: 0.9906669822845738
Energy: 0.9637928008651956
Energy: 0.9906669822845738
Energy: 0.9637928008679972
Energy: 0.9410451589557794
Energy: 1.3061487956157687
Energy: 0.941045158957719
Energy: 1.3061487956153375
Energy: 0.9410451589557794
Energy: 1.3061487956153375
Energy: 0.9324898368889155
Energy: 0.9258558446434606
Energy: 0.932489836890496
Energy: 0.9258558446423111
Energy: 0.9324898368893465
Energy: 0.9258558446466214
Energy: 0.9281651232220461
Energy: 1.5016181335448038
Energy: 0.9281625910593001
Energy: 1.5016181335455938
Energy: 0.9281651232224054
Energy: 1.5016181335448038
Energy: 0.9644328088871151
Energy: 0.937908194151885
Energy: 0.9644328088863249
Energy: 0.937908194151885
Energy: 0.9644328088891267
Energy: 0.9379081941503046
Energy: 1.0195174872997474
Energy: 0.9887273638133391
Energy: 1.0195174873013277
Energy: 0.9887273638137701
Energy: 1.0195174873001782
Energy: 0.9887273638145603
Energy: 1.042422542890574
Energy: 0.9886264897428193
Energy: 1.042422542890574
Energy: 0.9886264897423883
Energy: 1.042422542890215
Energy: 0.988626489742029
Energy: 1.2180813111261464
Energy: 0.9724806100380555
Energy: 1.2181371664098968
Energy: 0.9724806100356849
Energy: 1.2180813111257156
Energy: 0.9724806100372654
Energy: 0.940471410846983
Energy: 1.464443670991436
Energy: 0.9404714108481323
Energy: 1.464443670991795
Energy: 0.940471410846983
Energy: 1.464443670991005
Energy: 0.9810604476045117
Energy: 0.925923777701118
Energy: 0.981060447598621
Energy: 0.9259237777007587
Energy: 0.9810604476033624
Energy: 0.9259237776968076
Energy: 0.9901151829786602
Energy: 1.2939771692574995
Energy: 0.990117463565706
Energy: 1.2939771692582898
Energy: 0.9901151829783009
Energy: 1.2939771692582898
Energy: 0.9383375505294
Energy: 0.9638824060578387
Energy: 0.9383375505262391
Energy: 0.9638824060578387
Energy: 0.9383375505309804
Energy: 0.963882406055468
Energy: 0.9899878972914138
Energy: 0.9431903664577003
Energy: 0.9899878972901924
Energy: 0.9431903664572694
Energy: 0.9899878972901924
Energy: 0.9431903664616514
Energy: 1.076691909911849
Energy: 0.9143447447070775
Energy: 1.0766919099170211
Energy: 0.9143447447074367
Energy: 1.0766919099197512
Energy: 0.9143447447082268
Energy: 0.9697304842380108
Energy: 1.2264145521020058
Energy: 0.9697304842372205
Energy: 1.2264145521020058
Energy: 0.9697304842375799
Energy: 1.226414552099276
Energy: 0.8834715979500674
Energy: 0.9300484166775868
Energy: 0.8834715979500674
Energy: 0.9300484166771558
Energy: 0.8834715979481278
Energy: 0.9300484166787363
Energy: 0.9405892586723529
Energy: 0.982467328302063
Energy: 0.9405895454902746
Energy: 0.9824673283103246
Energy: 0.9405892586723529
Energy: 0.982467328319017
Energy: 1.1650716850068112
Energy: 1.1158194003525266
Energy: 1.1650716850044407
Energy: 1.1158194003651702
Energy: 1.165071685007961
Energy: 1.1158194002944808
Energy: 0.9028040654126339
Energy: 1.0276679334552303
Energy: 0.9028040654122749
Energy: 1.0276679334556615
Energy: 0.9028040654126339
Energy: 1.0276679334572418

minimum gb energy = 0.8834715979481278 eV
minimum distance =  2.32353265967815 Angstroms
sigma value = 67


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

Energy: 1.0393510034871394
Energy: 0.9552783372727581
Energy: 1.0393510034871394
Energy: 0.9552783372727581
Energy: 1.0393510034871394
Energy: 0.9552783372727581
Energy: 1.0077766105657953
Energy: 0.929039181060161
Energy: 1.0077766105657953
Energy: 0.929039181060161
Energy: 1.0077766105657953
Energy: 0.929039181060161
Energy: 1.348859630006879
Energy: 1.201879920870099
Energy: 0.934451897612663
Energy: 1.201879920870099
Energy: 0.934451897612663
Energy: 1.201879920870099
Energy: 1.007711096515875
Energy: 0.9285076608682143
Energy: 1.007711096515875
Energy: 0.9285076608682143
Energy: 1.0077110965132343
Energy: 0.9285076608682143
Energy: 1.0393510034871394
Energy: 0.9552783372727581
Energy: 1.0393510034871394
Energy: 0.9552783372727581
Energy: 1.0393510034871394
Energy: 0.9552783372701175
Energy: 1.0077766105657953
Energy: 0.929039181060161
Energy: 1.0077766105657953
Energy: 0.929039181060161
Energy: 1.0077766105657953
Energy: 0.9290391810628016
Energy: 1.348859630006879
Energy: 1.201879920870099
Energy: 0.934451897612663
Energy: 1.201879920870099
Energy: 0.934451897612663
Energy: 1.201879920870099

minimum gb energy = 0.9285076608682143 eV
minimum distance =  2.33708179562103 Angstroms
sigma value = 3


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

Energy: 1.3700862964027747
Energy: 1.1134828524209794
Energy: 1.3700862964207423
Energy: 1.1134828524209794
Energy: 1.3700862964135552
Energy: 1.1134828524209794
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Energy: 1.3382075489990852
Energy: 1.1921059127190567
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Energy: 1.3382075489954919
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Energy: 1.232439069288313
Energy: 1.178207831336635
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Energy: 1.2324390692990934
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Energy: 1.3071667025877551
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Energy: 1.3348995464076447
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Energy: 1.3348995464076447
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Energy: 1.1099187707746343
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Energy: 1.1099187707782276
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Energy: 1.1734868189406056
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Energy: 1.250289071686114
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Energy: 1.250289071686114
Energy: 1.1102215539739357
Energy: 1.250289071686114
Energy: 1.2414160668221883
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Energy: 1.0618815353217137
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Energy: 1.1497961856641292
Energy: 1.1751549285134288
Energy: 1.1544073819716565
Energy: 1.1751549285170222
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Energy: 1.1544073819680631
Energy: 1.2649728550978905
Energy: 1.1082613576850604
Energy: 1.264972855101484
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Energy: 1.264972855123045
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Energy: 1.0751080998772
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Energy: 1.0701414678966952
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Energy: 1.070141467864354
Energy: 1.2025040122474946
Energy: 1.133731129140434
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Energy: 1.133731129140434
Energy: 1.2025040122474946
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Energy: 1.242244266132302
Energy: 1.1537789174754784
Energy: 1.242244266132302
Energy: 1.153778917479072
Energy: 1.242244266132302
Energy: 1.153778917479072
Energy: 1.208635536165967
Energy: 1.1622845193718296
Energy: 1.2086355361623737
Energy: 1.1622845193826101
Energy: 1.208635536165967
Energy: 1.1622845193682363
Energy: 1.1638174766969693
Energy: 1.2560196628394134
Energy: 1.1638174766969693
Energy: 1.25601966283582
Energy: 1.163817476693376
Energy: 1.2560196628394134
Energy: 1.0448413516934176
Energy: 1.1752649956655545
Energy: 1.0448413516898243
Energy: 1.1752649956655545
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Energy: 1.1752649956655545
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Energy: 1.0826016916637191
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Energy: 1.0826016916637191
Energy: 1.2878273997149128
Energy: 1.0826016916637191
Energy: 1.0746751688441245
Energy: 1.305583876084426
Energy: 1.0746751688441245
Energy: 1.3055838760880196
Energy: 1.0746751688441245
Energy: 1.305583876091613
Energy: 1.1826772959343477
Energy: 1.2561278318912625
Energy: 1.1826772959199738
Energy: 1.256127831887669
Energy: 1.1826772962181027
Energy: 1.2561278318912625
Energy: 1.1122980627876435
Energy: 1.1697683627049489
Energy: 1.1122980627876435
Energy: 1.1697754250180672
Energy: 1.1122980627804564
Energy: 1.1697676486723942
Energy: 1.3853464503630661
Energy: 1.0323316137395178
Energy: 1.3853464503666595
Energy: 1.0323316137395178
Energy: 1.3853464503666595
Energy: 1.0323316137395178
Energy: 1.0669796731325067
Energy: 1.2551459869146342
Energy: 1.0669796731325067
Energy: 1.2551459869182278
Energy: 1.0669796731325067
Energy: 1.2551459869182278
Energy: 1.2793464142422555
Energy: 1.0700604582233095
Energy: 1.2793464142458488
Energy: 1.070060458226903
Energy: 1.2793464142422555
Energy: 1.070060458226903
Energy: 1.23591503895249
Energy: 1.1523586714794185
Energy: 1.2359150389201483
Energy: 1.1523586714866054
Energy: 1.2359150389273355
Energy: 1.1523586714866054
Energy: 1.3865052554106048
Energy: 1.0759011483960574
Energy: 1.3865052554106048
Energy: 1.0759011483888703
Energy: 1.3865052554106048
Energy: 1.0759011483924639
Energy: 1.1374512856114098
Energy: 1.191916070530741
Energy: 1.1374512856114098
Energy: 1.191916070530741
Energy: 1.1374512856114098
Energy: 1.191916070530741
Energy: 1.136442704219785
Energy: 1.0729737722361705
Energy: 1.136442704219785
Energy: 1.0729737722361705
Energy: 1.136442704219785
Energy: 1.0729737722397639
Energy: 1.1129317654483162
Energy: 1.1591907168389644
Energy: 1.1129317654662836
Energy: 1.1591907168317772
Energy: 1.1129317654483162
Energy: 1.1591907168317772
Energy: 1.247950724520319
Energy: 1.2062626374075407
Energy: 1.247950724520319
Energy: 1.2062626374075407
Energy: 1.247950724520319
Energy: 1.2062626374075407
Energy: 1.1891222424171235
Energy: 1.2796047861303224
Energy: 1.1891222424171235
Energy: 1.279604786126729
Energy: 1.1891222424171235
Energy: 1.2796047861303224

minimum gb energy = 1.0323316137395178 eV
minimum distance =  2.27344689686086 Angstroms
sigma value = 81


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

Energy: 1.2306587435650447
Energy: 1.138848631486535
Energy: 1.2306587435650447
Energy: 1.138848631486535
Energy: 1.2306587435660312
Energy: 1.138848631486535
Energy: 1.12554104312628
Energy: 1.210837577503879
Energy: 1.1255410431267732
Energy: 1.210837577503879
Energy: 1.1255410431257866
Energy: 1.210837577503879
Energy: 1.240555930860553
Energy: 1.2890872822620614
Energy: 1.2405559308600598
Energy: 1.2890872822625548
Energy: 1.2405559308600598
Energy: 1.289087282263048
Energy: 1.122061717787584
Energy: 1.147510449121986
Energy: 1.1220617177865975
Energy: 1.1475104491209998
Energy: 1.1220617177870909
Energy: 1.1475104491205066
Energy: 1.1482469046119574
Energy: 1.0407311381455044
Energy: 1.1482469046119574
Energy: 1.040731138144518
Energy: 1.148246904610478
Energy: 1.0407311381425899
Energy: 1.0739529808158037
Energy: 1.0376282313986664
Energy: 1.0739529808158037
Energy: 1.0376282313981733
Energy: 1.0739529808162969
Energy: 1.0376282313981733
Energy: 1.0363598866657437
Energy: 1.042739540192919
Energy: 1.0363598866652504
Energy: 1.042739540193412
Energy: 1.036359886666237
Energy: 1.0427395401924255
Energy: 1.146464450799321
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Energy: 1.1258086100286175
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Energy: 1.1258478077899012
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Energy: 1.5473819366249544
Energy: 1.1265948144045366
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Energy: 1.0965200308645897
Energy: 1.0379803172849977
Energy: 1.0743268965657782
Energy: 1.0379803172849977
Energy: 1.0743268965667647
Energy: 1.0379803172854911
Energy: 1.0743268965667647
Energy: 1.134157301613429
Energy: 1.147860368296925
Energy: 1.1341573016149085
Energy: 1.1478603682954456
Energy: 1.1341573016154016
Energy: 1.1478603682954456
Energy: 1.1776560994540333
Energy: 1.2869078876592797
Energy: 1.1776560994530467
Energy: 1.2869078876592797
Energy: 1.1776560994535399
Energy: 1.2869078876587863
Energy: 1.3661553076205586
Energy: 1.0922322569768612
Energy: 1.366155307621545
Energy: 1.0922322569773544
Energy: 1.3661553076205586
Energy: 1.0922322569822864
Energy: 1.146855832789079
Energy: 1.0405904638909238
Energy: 1.1468558327875993
Energy: 1.040590463891417
Energy: 1.1468558327885856
Energy: 1.040590463891417
Energy: 1.1671801507767259
Energy: 1.140774240326785
Energy: 1.1671801507767259
Energy: 1.1407742403228396
Energy: 1.1671801507752464
Energy: 1.1407742403257985
Energy: 1.0784656304741902
Energy: 1.225260527364935
Energy: 1.0784656304746831
Energy: 1.2252605273654285
Energy: 1.0784656304751765
Energy: 1.2252605273659214
Energy: 1.2898268375013375
Energy: 1.2232743135285555
Energy: 1.2898268375008441
Energy: 1.2232743135305284
Energy: 1.2898268375013375
Energy: 1.2232743135275692
Energy: 1.1455373458640934
Energy: 1.242595357533209
Energy: 1.1455373458640934
Energy: 1.2425953575327155
Energy: 1.14553734586508
Energy: 1.2425953575327155
Energy: 1.0880574102347262
Energy: 1.1476109385525886
Energy: 1.0880574102347262
Energy: 1.1476109385530817
Energy: 1.0880574102352196
Energy: 1.1476109385525886
Energy: 1.1250921429599199
Energy: 1.0985500730356421
Energy: 1.1250921429609064
Energy: 1.0985500730356421
Energy: 1.125092142960413
Energy: 1.0985500730361353
Energy: 1.1392142531144003
Energy: 1.0067534564888243
Energy: 1.1392142531124276
Energy: 1.0067534564903038
Energy: 1.1392142531114413
Energy: 1.0067534564917835
Energy: 1.1290296782593818
Energy: 1.1470254580532402
Energy: 1.1290296782579021
Energy: 1.1470254580532402
Energy: 1.1290296782608615
Energy: 1.1470254580537336
Energy: 1.1765656487004061
Energy: 1.220183501201252
Energy: 1.176565648699913
Energy: 1.220183501201252
Energy: 1.1765656487008995
Energy: 1.220183501201252
Energy: 1.368024870394864
Energy: 1.3390804618032837
Energy: 1.368024870394864
Energy: 1.3390804618047631
Energy: 1.368024870394864
Energy: 1.3390804618032837
Energy: 1.0839160286900358
Energy: 1.1230886172859016
Energy: 1.0839160286890495
Energy: 1.123088617284915
Energy: 1.0839160286905292
Energy: 1.123088617284915
Energy: 1.17779361507084
Energy: 1.140334553977411
Energy: 1.1777936150698536
Energy: 1.1403345539808636
Energy: 1.1777936150698536
Energy: 1.1403345539769179
Energy: 1.1568834395056815
Energy: 1.127419850613478
Energy: 1.1568834395066678
Energy: 1.127419850613478
Energy: 1.1568834395051883
Energy: 1.127419850613478
Energy: 1.2909785704598313
Energy: 1.0190634746123257
Energy: 1.2909785704613108
Energy: 1.0190634746118326
Energy: 1.2909785704608177
Energy: 1.0190634746113394
Energy: 1.1482006711490707
Energy: 1.3680553998120517
Energy: 1.1482006711505501
Energy: 1.368055399812545
Energy: 1.1482006711500572
Energy: 1.3680553998110654
Energy: 1.0406025582853946
Energy: 1.1473564439445791
Energy: 1.0406025582858878
Energy: 1.1473564439455655
Energy: 1.0406025582858878
Energy: 1.1473564439455655
Energy: 1.038021532571407
Energy: 1.1625940601523626
Energy: 1.038021532571407
Energy: 1.162594992741685
Energy: 1.0380215325709137
Energy: 1.162594959930721
Energy: 1.0380194880238918
Energy: 1.099311249722485
Energy: 1.038019488024385
Energy: 1.099311249721992
Energy: 1.038019488024385
Energy: 1.099311249722485
Energy: 1.1430534890741193
Energy: 1.5881773816977374
Energy: 1.1430534890736261
Energy: 1.5881773816972444
Energy: 1.1430534890741193
Energy: 1.5881773816982308
Energy: 1.24414335258261
Energy: 1.219890970791931
Energy: 1.244143352582117
Energy: 1.2198909707914376
Energy: 1.244143352582117
Energy: 1.2198909707934105
Energy: 1.1491634791581575
Energy: 1.0920946404135816
Energy: 1.1491634791611167
Energy: 1.0920946404125953
Energy: 1.1491634791581575
Energy: 1.0920946404111156
Energy: 1.0991960433095054
Energy: 1.0379582942428809
Energy: 1.099196043309012
Energy: 1.0379582942418946
Energy: 1.099196043309012
Energy: 1.037958294243374

minimum gb energy = 1.0067534564888243 eV
minimum distance =  2.35979845373763 Angstroms
sigma value = 43


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

Energy: 1.3411348152286866
Energy: 1.1506674358981597
Energy: 1.3411348152268694
Energy: 1.1506674358981597
Energy: 1.3411348152286866
Energy: 1.1506674358981597
Energy: 1.198565934175674
Energy: 1.0701936065284776
Energy: 1.1985659341762795
Energy: 1.0701936065278719
Energy: 1.1985659341762795
Energy: 1.0701936065278719
Energy: 1.1665554391552224
Energy: 1.3857456253442284
Energy: 1.1665554391552224
Energy: 1.3857456253442284
Energy: 1.1665554391552224
Energy: 1.3857456253448341
Energy: 1.3217035059298046
Energy: 1.0911140792647402
Energy: 1.3217035059304103
Energy: 1.0911140792635283
Energy: 1.3217035059298046
Energy: 1.0911140792641343
Energy: 1.1658906346788631
Energy: 1.1347031066516198
Energy: 1.165890634679469
Energy: 1.1347031066516198
Energy: 1.1658906346788631
Energy: 1.1347031066522255
Energy: 1.198881463064549
Energy: 1.1799765955824575
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Energy: 1.1988814630639433
Energy: 1.1799765955818518
Energy: 1.2019944896786265
Energy: 1.2816294240411106
Energy: 1.2019944896780206
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Energy: 1.2019944896780206
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Energy: 1.1210125458278133
Energy: 1.1900731304446972
Energy: 1.121012545828419
Energy: 1.1900731304446972
Energy: 1.1210125458290248
Energy: 1.1900731304453032
Energy: 1.2394232078862422
Energy: 1.0399293799115368
Energy: 1.2394232078862422
Energy: 1.0399293799103249
Energy: 1.2394232078862422
Energy: 1.0399293799103249
Energy: 1.0861596505152666
Energy: 1.3248678542712522
Energy: 1.086159650514661
Energy: 1.3248678542712522
Energy: 1.0861596505152666
Energy: 1.3248678542700407
Energy: 1.2851307043647926
Energy: 1.072018292822474
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Energy: 1.0720182928242916
Energy: 1.2851307043647926
Energy: 1.0720182928218682
Energy: 1.120640210737216
Energy: 1.1896975684615472
Energy: 1.1206402107378217
Energy: 1.1896975671093795
Energy: 1.1206402107341868
Energy: 1.1896975659467475
Energy: 1.2013991265478488
Energy: 1.1805196217494853
Energy: 1.2013991265442137
Energy: 1.1805196217494853
Energy: 1.201399126543002
Energy: 1.1805196217500913
Energy: 1.0442197934481874
Energy: 1.3276360946432564
Energy: 1.0442197934475819
Energy: 1.3276360946438621
Energy: 1.0442197934475819
Energy: 1.3276360946426506
Energy: 1.1913152685242008
Energy: 1.2297421920971316
Energy: 1.1913152685242008
Energy: 1.2297421920971316
Energy: 1.1913152685248067
Energy: 1.2297421920971316
Energy: 1.254438995016462
Energy: 1.177810406870179
Energy: 1.254438995016462
Energy: 1.177810406870179
Energy: 1.2544389950158563
Energy: 1.177810406870179
Energy: 1.2095009595681327
Energy: 1.0710293697320736
Energy: 1.2095009595687387
Energy: 1.071029369733891
Energy: 1.2095009595693444
Energy: 1.071029369733891
Energy: 1.2967538637270029
Energy: 1.131716696807843
Energy: 1.2967538637263973
Energy: 1.131716696807237
Energy: 1.2967538637263973
Energy: 1.131716696807843
Energy: 1.2600989222975312
Energy: 1.09630135400366
Energy: 1.2600989222975312
Energy: 1.09630135400366
Energy: 1.2600989222969254
Energy: 1.0963013540042656
Energy: 1.2095804217363169
Energy: 1.1794539385448124
Energy: 1.2095804217363169
Energy: 1.1794539385448124
Energy: 1.2095804217363169
Energy: 1.1794539385448124
Energy: 1.1147670340937388
Energy: 1.2156175177697812
Energy: 1.1147670340937388
Energy: 1.2156175177310093
Energy: 1.114767034092527
Energy: 1.215617517726163
Energy: 1.2629872088886887
Energy: 1.1523117512741134
Energy: 1.2629872088892942
Energy: 1.1523117512741134
Energy: 1.2629872088886887
Energy: 1.1523117512741134
Energy: 1.0416135390338956
Energy: 1.2239183902678534
Energy: 1.0416135390338956
Energy: 1.2239183902678534
Energy: 1.0416135390345014
Energy: 1.2239183902678534
Energy: 1.200499402654989
Energy: 1.2865136774701615
Energy: 1.200499402654989
Energy: 1.286513677468344
Energy: 1.200499402654989
Energy: 1.2865136774689498
Energy: 1.1194921660545936
Energy: 1.2337343359573907
Energy: 1.1194921660551995
Energy: 1.2337343359579966
Energy: 1.1194921660545936
Energy: 1.2337343359579966
Energy: 1.263972288831668
Energy: 1.1853316007333445
Energy: 1.263972288831062
Energy: 1.1853316007339225
Energy: 1.263972288831668
Energy: 1.1853316007339225
Energy: 1.1288375770368888
Energy: 1.246371047362484
Energy: 1.128837577036283
Energy: 1.2463710473618783
Energy: 1.128837577035677
Energy: 1.246371047362484
Energy: 1.240258547572032
Energy: 1.139635375819122
Energy: 1.240258547572032
Energy: 1.139635375819122
Energy: 1.240258547572032
Energy: 1.139635375819728
Energy: 1.1197796943365363
Energy: 1.1928994881788706
Energy: 1.1197796943359306
Energy: 1.1928994881782649
Energy: 1.1197796943359306
Energy: 1.1928994881782649
Energy: 1.1836583338164823
Energy: 1.202390799293871
Energy: 1.1836583338164823
Energy: 1.2023907992932652
Energy: 1.1836583338158764
Energy: 1.202390799293871
Energy: 1.1979720721105191
Energy: 1.180287442242364
Energy: 1.197972072111125
Energy: 1.180287442242364
Energy: 1.197972072111125
Energy: 1.180287442242364

minimum gb energy = 1.0399293799103249 eV
minimum distance =  2.3441864242566 Angstroms
sigma value = 57


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

Energy: 1.2899711545576757
Energy: 1.1301353068522282
Energy: 1.2155511893757847
Energy: 1.130135306853797
Energy: 1.2899711545576757
Energy: 1.130135306853797
Energy: 1.2345159056223503
Energy: 1.0715331904562186
Energy: 1.2345159056215655
Energy: 1.071533190457003
Energy: 1.2345159056207815
Energy: 1.071533190457003
Energy: 1.2831048118587127
Energy: 1.2787970148823737
Energy: 1.2255743456356563
Energy: 1.2787970148823737
Energy: 1.2831048118579282
Energy: 1.2787970148823737
Energy: 1.485814882731188
Energy: 1.2258707440013652
Energy: 1.4858148827296191
Energy: 1.225870744000581
Energy: 1.4858148827304036
Energy: 1.225870744000581
Energy: 1.2334284081181348
Energy: 1.139349897315463
Energy: 1.2334284081197036
Energy: 1.139349897315463
Energy: 1.2334284081173505
Energy: 1.1393498973146787
Energy: 1.245052101701416
Energy: 1.073713861331136
Energy: 1.245052101701416
Energy: 1.0737138613327049
Energy: 1.245052101701416
Energy: 1.0737138613319206
Energy: 1.219486177277288
Energy: 1.28516018681382
Energy: 1.219486177277288
Energy: 1.285160186812251
Energy: 1.2194861772780727
Energy: 1.2851601868130356
Energy: 1.2166388600946356
Energy: 1.1372889327870013
Energy: 1.216638860093887
Energy: 1.1372889327885702
Energy: 1.2166388600946356
Energy: 1.1372889327877858
Energy: 1.2427588005372945
Energy: 1.1790618756409756
Energy: 1.2427588005372945
Energy: 1.1790618756441131
Energy: 1.2427588005372945
Energy: 1.1790618756433286
Energy: 1.0547850937708982
Energy: 1.139502572210911
Energy: 1.0545771438524747
Energy: 1.1395025722116952
Energy: 1.054785093772467
Energy: 1.1395025722116952
Energy: 1.1765565754642462
Energy: 1.2267009083827018
Energy: 1.1765565754642462
Energy: 1.226700908381133
Energy: 1.1765565754642462
Energy: 1.226700908381133
Energy: 1.2001563394554497
Energy: 1.1935103256696524
Energy: 1.2001563394530963
Energy: 1.1935103256798496
Energy: 1.200156339454665
Energy: 1.1935103256876936
Energy: 1.2066703341791487
Energy: 1.1786247892082973
Energy: 1.2066703341783642
Energy: 1.1786247892067285
Energy: 1.2066703341791487
Energy: 1.178624789207513
Energy: 1.2413751661073513
Energy: 1.0823236283444286
Energy: 1.151847052085515
Energy: 1.0823236283444286
Energy: 1.2413751661073513
Energy: 1.0823236283444286
Energy: 1.2451548512982828
Energy: 1.1318055621353993
Energy: 1.1410963819773903
Energy: 1.1318055621338303
Energy: 1.2451548512974986
Energy: 1.1318055621338303
Energy: 1.2302762674497487
Energy: 1.1781918884559397
Energy: 1.2302762674497487
Energy: 1.1781918884551554
Energy: 1.230276267450533
Energy: 1.1781918884559397
Energy: 1.0547451422433318
Energy: 1.1342796935258452
Energy: 1.0547147733607642
Energy: 1.134279693527414
Energy: 1.0547451422417629
Energy: 1.1342796935266293
Energy: 1.1736344681535813
Energy: 0.9990022045573248
Energy: 1.1736344681535813
Energy: 0.9990022045581094
Energy: 1.1736344681527968
Energy: 0.9990022045581094
Energy: 1.0540642289989732
Energy: 1.1343500987384059
Energy: 1.0540642289989732
Energy: 1.1343500987384059
Energy: 1.0540642290005418
Energy: 1.1343500987384059
Energy: 1.1522797515811085
Energy: 1.1781710432228352
Energy: 1.1522797515818928
Energy: 1.1781710432228352
Energy: 1.1522797515818928
Energy: 1.1781710432228352
Energy: 1.1657310573636332
Energy: 1.1307817513601166
Energy: 1.1657310573636332
Energy: 1.1307817513601166
Energy: 1.1657310573636332
Energy: 1.1307817513601166
Energy: 1.2386254118946904
Energy: 1.1558285806553164
Energy: 1.2386254118946904
Energy: 1.1558285806537474
Energy: 1.238625411895475
Energy: 1.1558285806529627
Energy: 1.306462149091874
Energy: 1.1779070013212107
Energy: 1.3070315763943228
Energy: 1.1779070013204263
Energy: 1.3064621490903054
Energy: 1.1779070013212107
Energy: 1.278846469783526
Energy: 1.2968863276463316
Energy: 1.2793456495685605
Energy: 1.2968863276486848
Energy: 1.278846469783526
Energy: 1.2968863276486848

minimum gb energy = 0.9990022045573248 eV
minimum distance =  2.34835947700404 Angstroms
sigma value = 17


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

Energy: 1.1467583600759863
Energy: 1.0215788540717776
Energy: 1.1467583600759863
Energy: 1.0215788540717776
Energy: 1.1467583600770956
Energy: 1.0215788540717776
Energy: 1.0163337613942895
Energy: 0.9695009824254054
Energy: 1.0163337613920713
Energy: 0.9695009824254054
Energy: 1.0163337613909618
Energy: 0.9695009824254054
Energy: 1.0857344935496551
Energy: 1.1526211655221144
Energy: 1.0857344935496551
Energy: 1.1526211655221144
Energy: 1.0857344935496551
Energy: 1.1526211655221144
Energy: 1.0381760613321853
Energy: 1.0943184769841356
Energy: 1.0381760613299669
Energy: 1.094318476985245
Energy: 1.0381760613321853
Energy: 1.0943184769841356
Energy: 1.1111715792439838
Energy: 1.2288603907126043
Energy: 1.1111715792439838
Energy: 1.2288603907126043
Energy: 1.1111715792439838
Energy: 1.2288603907137137
Energy: 1.0211039381204936
Energy: 1.1145419698968635
Energy: 1.0211039381204936
Energy: 1.1145419698968635
Energy: 1.0211039381204936
Energy: 1.1145419698979728
Energy: 1.0603181574795915
Energy: 0.9725195225782247
Energy: 1.0603181574795915
Energy: 0.9725195225782247
Energy: 1.0603181574795915
Energy: 0.9725195225782247
Energy: 1.0379764895021477
Energy: 1.1215299131094736
Energy: 1.0379764895021477
Energy: 1.1215299131061456
Energy: 1.0379764895021477
Energy: 1.1215299131061456
Energy: 1.0525933145830413
Energy: 1.1451187443385298
Energy: 1.0525933145830413
Energy: 1.1451187443374204
Energy: 1.0525933145830413
Energy: 1.1451187443385298
Energy: 1.0445589101373183
Energy: 0.9775377935836022
Energy: 1.0445589101373183
Energy: 0.9775377935836022
Energy: 1.0445589101373183
Energy: 0.9775377935824928
Energy: 1.0315228327028911
Energy: 1.1139246249748322
Energy: 1.031522832699563
Energy: 1.113924624973723
Energy: 1.0315228327006725
Energy: 1.113924624973723
Energy: 1.0870021106138505
Energy: 1.0908908347643067
Energy: 1.087002110628221
Energy: 1.0908908347643067
Energy: 1.0870021107324954
Energy: 1.0908908347654163
Energy: 0.9141591820824714
Energy: 1.112377961528293
Energy: 0.9141591820824714
Energy: 1.112377961529402
Energy: 0.9141591820824714
Energy: 1.112377961529402
Energy: 1.0435717564292288
Energy: 1.0741006620638194
Energy: 1.0435717564292288
Energy: 1.0741006620638194
Energy: 1.0435717564292288
Energy: 1.0741006620638194
Energy: 1.0201794662133348
Energy: 1.248239341990059
Energy: 1.020179466214444
Energy: 1.248239341990059
Energy: 1.0201794662122254
Energy: 1.248239341990059
Energy: 1.0205586853732456
Energy: 1.3378144281079145
Energy: 1.0205586853732456
Energy: 1.3378144281079145
Energy: 1.0205586853732456
Energy: 1.3378144281090238
Energy: 1.0416882412310422
Energy: 1.076435346346705
Energy: 1.0416882412310422
Energy: 1.0764353463455956
Energy: 1.0416882412310422
Energy: 1.076435346346705

minimum gb energy = 0.9141591820824714 eV
minimum distance =  2.30980520579444 Angstroms
sigma value = 17


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

Energy: 1.0401999631308734
Energy: 0.9236586347766252
Energy: 1.0401999631308734
Energy: 0.9236586347761967
Energy: 1.0401999631313017
Energy: 0.9236586347770535
Energy: 0.9579036764873158
Energy: 0.9813374411925578
Energy: 0.9579036764928848
Energy: 0.9813374411934148
Energy: 0.9579036764710377
Energy: 0.9813374411951281
Energy: 1.0057858202463703
Energy: 0.9771090480996303
Energy: 1.0057858202463703
Energy: 0.9771090481000586
Energy: 1.0057858202463703
Energy: 0.9771090481009155
Energy: 0.9618414795642241
Energy: 0.9895387078832127
Energy: 0.9618414795633673
Energy: 1.0038103108610081
Energy: 0.9618414795642241
Energy: 0.9895387078840696
Energy: 1.2908875511036912
Energy: 1.0314007050875087
Energy: 1.2908875511032631
Energy: 1.0314007050875087
Energy: 1.2908875511036912
Energy: 1.0314007050875087
Energy: 0.9655669909030282
Energy: 0.972442840035347
Energy: 0.9655669909030282
Energy: 0.9724428400366321
Energy: 0.9655669909025998
Energy: 0.9724428400366321
Energy: 0.938230345222912
Energy: 0.9269176641837007
Energy: 0.9382303452224836
Energy: 0.9269176641841292
Energy: 0.9382303452237687
Energy: 0.9269176641841292
Energy: 1.0405873208378518
Energy: 1.150393150302002
Energy: 1.0405873208374234
Energy: 1.1503931503015736
Energy: 1.04058732083828
Energy: 1.1503931503024303
Energy: 1.1128635039907302
Energy: 0.9884155301275854
Energy: 1.1128635039911587
Energy: 0.9884155301314408
Energy: 1.1128635039911587
Energy: 0.9884155301301557
Energy: 0.9362377703793463
Energy: 0.8407786765933055
Energy: 0.9362377703789178
Energy: 0.8407786765924488
Energy: 0.9362377703793463
Energy: 0.8407786765920203
Energy: 0.8567940442215511
Energy: 1.1228009011730293
Energy: 0.8567940442228363
Energy: 1.122800901172601
Energy: 0.856794044222408
Energy: 1.1228009011721727
Energy: 1.0030156616819006
Energy: 1.085765502539007
Energy: 1.0030156616814723
Energy: 1.085765502541149
Energy: 1.0030156616814723
Energy: 1.0857655025402921
Energy: 0.9540604491239224
Energy: 0.9103343008477601
Energy: 0.9540604491226374
Energy: 0.9103343008558993
Energy: 0.9540604491222091
Energy: 0.9103343008499021
Energy: 0.9380469562675762
Energy: 1.0169181216068552
Energy: 0.9380469562667193
Energy: 1.0169181216059981
Energy: 0.9380469562675762
Energy: 1.0169181216059981
Energy: 1.002833655679595
Energy: 1.0131915452514857
Energy: 1.0028336556791666
Energy: 1.0131915452497726
Energy: 1.002833655678738
Energy: 1.0131915452502007
Energy: 0.8568635259655365
Energy: 1.0773723551315948
Energy: 0.8568635259668217
Energy: 1.0773723551320231
Energy: 0.8568635259659648
Energy: 1.0773723551320231
Energy: 0.9521875052601174
Energy: 0.949344774665016
Energy: 0.9521875052605456
Energy: 0.949344774665016
Energy: 0.9521875052605456
Energy: 0.9493447746654445
Energy: 0.9661712829455285
Energy: 1.147396732265778
Energy: 0.9661712829463851
Energy: 1.147396732265778
Energy: 0.9661712829459569
Energy: 1.147396732265778
Energy: 0.9374140517183425
Energy: 1.3073235660994733
Energy: 0.9374140517183425
Energy: 1.307323566099045
Energy: 0.937414051717914
Energy: 1.307323566099045
Energy: 0.951076973891555
Energy: 0.8693806296952376
Energy: 0.9510769738919834
Energy: 0.838186087991903
Energy: 0.951076973891555
Energy: 0.8381860879889043
Energy: 0.9376567736529863
Energy: 1.3072132052122039
Energy: 0.9376567736551282
Energy: 1.3072132052126324
Energy: 0.9376567736551282
Energy: 1.3072132052122039
Energy: 0.9662506644957577
Energy: 1.1470877395627543
Energy: 0.9662506644944726
Energy: 1.1470877395631824
Energy: 0.9662506644944726
Energy: 1.1470877395623258
Energy: 0.9526505107458841
Energy: 0.9494717716694905
Energy: 0.9526505107450276
Energy: 0.9494717716694905
Energy: 0.9526505107454559
Energy: 0.9494717716690622
Energy: 0.8563132227866631
Energy: 1.0505118789473555
Energy: 0.856313222788805
Energy: 1.0505118789494974
Energy: 0.8563132227879482
Energy: 1.0505118789486407
Energy: 1.002017859246129
Energy: 1.0135583075766479
Energy: 1.0020178592452722
Energy: 1.0135583075766479
Energy: 1.0020178592401316
Energy: 1.0135583075770764
Energy: 0.9470186994567722
Energy: 1.0166579645174698
Energy: 0.947018699457629
Energy: 1.0166579645174698
Energy: 0.9470186994567722
Energy: 1.0166579645178984
Energy: 0.9541893850262324
Energy: 0.9100469109427721
Energy: 0.9541893850262324
Energy: 0.9100469109427721
Energy: 0.9541893850262324
Energy: 0.9100469109427721
Energy: 1.0031666571558193
Energy: 1.0862851960313868
Energy: 1.0031666571553912
Energy: 1.08628519603053
Energy: 1.0031666571553912
Energy: 1.086285196031815
Energy: 0.8557161125588438
Energy: 1.1229512434264188
Energy: 0.8557161125584155
Energy: 1.1229512434268474
Energy: 0.8557161125592723
Energy: 1.1229512434251339
Energy: 0.9366314356412879
Energy: 0.8400010398006135
Energy: 0.9366314356408597
Energy: 0.8400010398018987
Energy: 0.9366314356412879
Energy: 0.8400010398044688
Energy: 1.1128565467660552
Energy: 0.9877296850453701
Energy: 1.1128565467664833
Energy: 0.9877296850457985
Energy: 1.1128565467660552
Energy: 0.9877296850457985
Energy: 1.0403904594713533
Energy: 1.149975636111113
Energy: 1.0403904594713533
Energy: 1.14997563611197
Energy: 1.0403904594717817
Energy: 1.1499756361115414
Energy: 0.9383354999719432
Energy: 0.927466519143982
Energy: 0.938335499974085
Energy: 0.927466519143982
Energy: 0.9383354999723715
Energy: 0.9274665191461238
Energy: 0.9655680006104943
Energy: 0.9013638854891097
Energy: 0.9655680006104943
Energy: 0.9013638854895382
Energy: 0.9655680006104943
Energy: 0.9013638854895382
Energy: 1.290672715347828
Energy: 1.032012459449552
Energy: 1.290672715347828
Energy: 1.032012459449552
Energy: 1.2906727153482562
Energy: 1.0320124594508373
Energy: 0.961515797212213
Energy: 1.1131843191577322
Energy: 0.9615157972117848
Energy: 1.1131843191590174
Energy: 0.9615157972117848
Energy: 1.113184319157304
Energy: 1.0059739679640423
Energy: 0.9770145599989666
Energy: 1.005973967963614
Energy: 0.977014559998538
Energy: 1.0059739679640423
Energy: 0.9770145599989666
Energy: 0.9585212367645892
Energy: 0.8857563072074892
Energy: 0.9585212367684446
Energy: 0.8857563072074892
Energy: 0.9585212367663026
Energy: 0.8857563072092028
Energy: 1.0401999631317302
Energy: 0.9236586347774818
Energy: 1.0401999631313017
Energy: 0.923658634778767
Energy: 1.040199963132587
Energy: 0.923658634778767
Energy: 0.9579036764509042
Energy: 0.8938912524570947
Energy: 0.9579036764389098
Energy: 0.8938912524570947
Energy: 0.9579036764479055
Energy: 0.8938912524588082
Energy: 1.0057858202467984
Energy: 0.9771090481013437
Energy: 1.0057858202467984
Energy: 0.9771090481017722
Energy: 1.0057858202463703
Energy: 0.9771090481022006
Energy: 0.9618414795612253
Energy: 0.9503203617800479
Energy: 0.9618414795625105
Energy: 0.9503203617796194
Energy: 0.9618414795633673
Energy: 0.9503203617800479
Energy: 1.2908875511028346
Energy: 1.0314007050870804
Energy: 1.2908875511032631
Energy: 1.0314007050875087
Energy: 1.2908875511032631
Energy: 1.0314007050875087

minimum gb energy = 0.8381860879889043 eV
minimum distance =  2.29706877650806 Angstroms
sigma value = 57


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

Energy: 0.9547028337516645
Energy: 0.8550782062031679
Energy: 0.9547028337516645
Energy: 0.8550782062031679
Energy: 0.9547028337523621
Energy: 0.8550782062031679
Energy: 0.9692969254182126
Energy: 0.8252770888878381
Energy: 0.9692969254189101
Energy: 0.8252770888878381
Energy: 0.9692969254189101
Energy: 0.8252770888885357
Energy: 0.945457206444617
Energy: 0.84119301697191
Energy: 0.9454572064453145
Energy: 0.8411930169726075
Energy: 0.945457206444617
Energy: 0.841193016973305
Energy: 0.8988673771934769
Energy: 0.9015259988712855
Energy: 0.8988673771934769
Energy: 0.901525998871983
Energy: 0.8988673771934769
Energy: 0.9015259988726805
Energy: 1.1609936105782395
Energy: 0.7807328568194817
Energy: 1.1609936105782395
Energy: 0.7807328568194817
Energy: 1.160993610578937
Energy: 0.7807328568194817
Energy: 0.902812489295563
Energy: 0.8405193516729551
Energy: 0.9028124892948655
Energy: 0.8405193516722577
Energy: 0.9028124892962605
Energy: 0.8405193516715601
Energy: 0.9652988899887953
Energy: 1.0140398484034008
Energy: 0.9652988899894928
Energy: 1.0140398484034008
Energy: 0.9652988899887953
Energy: 1.0140398484040982
Energy: 1.0615176787639808
Energy: 1.1008957832356272
Energy: 1.0615176787646783
Energy: 1.1008957832377195
Energy: 1.0615176787646783
Energy: 1.1008957832349298
Energy: 0.9796293827472106
Energy: 0.8427304561307573
Energy: 0.9796293827472106
Energy: 0.8427304561328498
Energy: 0.979629382746513
Energy: 0.8427304561328498
Energy: 0.8604918211362559
Energy: 0.8576602305247363
Energy: 0.8604918211313733
Energy: 0.8576602305247363
Energy: 0.8604918211341634
Energy: 0.8576602305247363
Energy: 1.0630109263288174
Energy: 1.0740510979677085
Energy: 1.0630109263302123
Energy: 1.074051097968406
Energy: 1.0630109263288174
Energy: 1.0740510979691036
Energy: 0.8685983808205652
Energy: 0.8034199784580247
Energy: 0.8685983808205652
Energy: 0.8034199784615123
Energy: 0.8685983808198676
Energy: 0.8034199784587223
Energy: 0.8589158115492564
Energy: 0.9647901523100747
Energy: 0.8589158115492564
Energy: 0.9647901523100747
Energy: 0.8589158115492564
Energy: 0.9647901523093773
Energy: 0.807107958353379
Energy: 1.004581308698476
Energy: 0.8071079583540766
Energy: 1.0045813086970812
Energy: 0.807107958353379
Energy: 1.0045813086977786
Energy: 0.9293372248751425
Energy: 0.9476935796102026
Energy: 0.92933722487584
Energy: 0.9476935796247866
Energy: 0.9293372248751425
Energy: 0.9476935796102026
Energy: 0.8592910487190429
Energy: 0.9995340987888524
Energy: 0.8592910487190429
Energy: 0.9995340987888524
Energy: 0.8592910487190429
Energy: 0.9995340987874574
Energy: 0.8696595735311929
Energy: 0.9663264832913327
Energy: 0.8696595735318905
Energy: 0.9663264832913327
Energy: 0.8696595735311929
Energy: 0.9663264832913327
Energy: 0.9215395963519092
Energy: 0.941734470259513
Energy: 0.9215395963553967
Energy: 0.941734470259513
Energy: 0.9215395963540017
Energy: 0.9417344702588155
Energy: 0.8557869912512762
Energy: 1.0227341464541857
Energy: 0.8557869912512762
Energy: 1.0227341464541857
Energy: 0.8557869912512762
Energy: 1.0227341464541857
Energy: 0.8099499150239686
Energy: 0.904452548930118
Energy: 0.8099499150225736
Energy: 0.904452548931513
Energy: 0.8099499150225736
Energy: 0.9044525489329079
Energy: 0.8935591767414651
Energy: 1.0834196781948129
Energy: 0.8935591767421626
Energy: 1.0834196781955103
Energy: 0.8935591767400701
Energy: 1.0834196781955103
Energy: 0.7997199815165279
Energy: 1.204909548945001
Energy: 0.7997199815158305
Energy: 1.2049095489456985
Energy: 0.799719981517923
Energy: 1.2049095489456985
Energy: 0.8811608324319983
Energy: 0.8707163375572641
Energy: 0.8811608324333933
Energy: 0.8707163375565667
Energy: 0.8811608324326957
Energy: 0.8707163375572641
Energy: 0.8680556492224867
Energy: 1.0264591929531903
Energy: 0.8680556492224867
Energy: 1.0264591929545852
Energy: 0.8680556492231842
Energy: 1.0264591929545852
Energy: 0.8763731995940873
Energy: 1.0816143284656057
Energy: 0.8763731995933898
Energy: 1.0816143284649085
Energy: 0.8763731995954823
Energy: 1.0816143284656057
Energy: 0.856477413533266
Energy: 0.8693212704431731
Energy: 0.8564774135339634
Energy: 0.8693212704424755
Energy: 0.856477413533266
Energy: 0.8693212704431731
Energy: 0.795571701977552
Energy: 1.0226900727546242
Energy: 0.7955717019754595
Energy: 1.0226900727532293
Energy: 0.795571701976157
Energy: 1.0226900727546242

minimum gb energy = 0.7807328568194817 eV
minimum distance =  2.294225533149 Angstroms
sigma value = 43


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

Energy: 1.0559892859522457
Energy: 0.7792482260804273
Energy: 1.05598928595377
Energy: 0.7792482260809355
Energy: 1.055989285953262
Energy: 0.7792482260799191
Energy: 0.8505593116717953
Energy: 0.7636847503436013
Energy: 0.8505593116717953
Energy: 0.7636847503425849
Energy: 0.8505593116712872
Energy: 0.7636847503425849
Energy: 0.8547444207343741
Energy: 0.8550595783677986
Energy: 0.8547444207343741
Energy: 0.855059578366782
Energy: 0.8547444207338657
Energy: 0.8550595783677986
Energy: 0.9987500428398632
Energy: 0.7953101271049591
Energy: 0.9987500428398632
Energy: 0.7953101271054673
Energy: 0.9987500428403713
Energy: 0.7953101271049591
Energy: 0.9847894286828536
Energy: 0.7493093976881806
Energy: 0.984789428683362
Energy: 0.7493093976881806
Energy: 0.9847894286828536
Energy: 0.7493093976876724
Energy: 0.7800881996031719
Energy: 0.7621088008237087
Energy: 0.78008819960368
Energy: 0.7621088008237087
Energy: 0.7800881996031719
Energy: 0.7621088008237087
Energy: 0.960168308308327
Energy: 0.8643354152719741
Energy: 0.9601683083078187
Energy: 0.8643354152719741
Energy: 0.9601683083078187
Energy: 0.8643354152724824
Energy: 1.013645431462649
Energy: 0.8260116371074198
Energy: 1.013645431462649
Energy: 0.8260116371064032
Energy: 1.0136454314631576
Energy: 0.8260116371084361
Energy: 0.7438484020052732
Energy: 0.748289999844605
Energy: 0.7438484020052732
Energy: 0.748289999844605
Energy: 0.7438484020052732
Energy: 0.7482899998440967
Energy: 0.8571864666304742
Energy: 0.8349074114054746
Energy: 0.8571864666304742
Energy: 0.8349074114054746
Energy: 0.8571864666304742
Energy: 0.8349074114054746
Energy: 0.9269279917366757
Energy: 0.9136197894369987
Energy: 0.9269279917376921
Energy: 0.913619789437507
Energy: 0.9269279917376921
Energy: 0.913619789437507
Energy: 0.7174583163693432
Energy: 0.8339040229271895
Energy: 0.7174583163693432
Energy: 0.8339040229266814
Energy: 0.7174583163703597
Energy: 0.8339040229261732
Energy: 0.8561800027615821
Energy: 0.7073793731892358
Energy: 0.8561800027615821
Energy: 0.7073793731892358
Energy: 0.8561800027615821
Energy: 0.7073793731902522
Energy: 0.9219434014900338
Energy: 0.9062542220954644
Energy: 0.9219434014900338
Energy: 0.9062542220949562
Energy: 0.9219434014900338
Energy: 0.9062542220959727
Energy: 0.8281050524875609
Energy: 0.8350424666312254
Energy: 0.8281050524875609
Energy: 0.8350424666307172
Energy: 0.8281050524880692
Energy: 0.8350424666312254
Energy: 0.877397616194635
Energy: 0.7771879691632325
Energy: 0.877397616194635
Energy: 0.7771879691627245
Energy: 0.8773976161941267
Energy: 0.7771879691632325
Energy: 0.9372396796648106
Energy: 0.8147195404225628
Energy: 0.9372396796648106
Energy: 0.8147195404225628
Energy: 0.9372396796648106
Energy: 0.8147195404220547
Energy: 0.7549069325429432
Energy: 0.7111935386502757
Energy: 0.7549069325429432
Energy: 0.7111935386492594
Energy: 0.7549069325434513
Energy: 0.7111935386502757
Energy: 0.7595135903138468
Energy: 0.8201441469035297
Energy: 0.759513590314355
Energy: 0.820144146902005
Energy: 0.7595135903138468
Energy: 0.8201441469030214
Energy: 0.7573643856426355
Energy: 0.97055867671616
Energy: 0.757364385641619
Energy: 0.9705586767176847
Energy: 0.7573643856426355
Energy: 0.9705586767171765
Energy: 0.814862485497836
Energy: 0.7621776623097928
Energy: 0.8148624854988525
Energy: 0.7621776623118257
Energy: 0.8148624854983444
Energy: 0.7621776623123339
Energy: 0.7853274888284137
Energy: 0.8775752980752761
Energy: 0.7853274888273974
Energy: 0.8775752980757844
Energy: 0.7853274888284137
Energy: 0.8775752980757844
Energy: 0.7996825186769971
Energy: 0.8414872271783616
Energy: 0.7996825186780134
Energy: 0.8414872271788697
Energy: 0.7996825186795381
Energy: 0.8414872271788697
Energy: 0.8855928964950016
Energy: 0.8901300669043067
Energy: 0.8855928964934769
Energy: 0.8901300669058312
Energy: 0.8855928964939852
Energy: 0.8901300669043067
Energy: 0.8160249270757507
Energy: 0.8273146062742972
Energy: 0.8160249270752427
Energy: 0.8273146062727726
Energy: 0.8160249270757507
Energy: 0.8273146062671825
Energy: 0.7178340404617853
Energy: 0.7951099112904338
Energy: 0.7178340404597525
Energy: 0.7951099112904338
Energy: 0.7178340404612772
Energy: 0.7951099112899255
Energy: 0.7981722732975984
Energy: 0.9584154872873669
Energy: 0.7981722732970903
Energy: 0.9584154872863505
Energy: 0.7949503872685313
Energy: 0.9584154872868587
Energy: 0.7159079840927457
Energy: 0.8205280681319492
Energy: 0.7159079840917293
Energy: 0.8205280681314409
Energy: 0.7159079840932538
Energy: 0.8205280681319492
Energy: 0.7421343758102046
Energy: 0.7468178315043451
Energy: 0.7421343758091884
Energy: 0.7468178315043451
Energy: 0.74213437580868
Energy: 0.746817831503837
Energy: 0.7357785465461261
Energy: 0.9283040801374653
Energy: 0.7357785465456178
Energy: 0.9283040801354324
Energy: 0.7357785465451097
Energy: 0.9283040801354324
Energy: 0.7363017097088697
Energy: 1.032280772973004
Energy: 0.7363017097078532
Energy: 1.0322807729719874
Energy: 0.7363017097093778
Energy: 1.032280772973004
Energy: 0.7425100288249542
Energy: 0.725929459061255
Energy: 0.7425100288249542
Energy: 0.725929459061255
Energy: 0.7425100288239378
Energy: 0.725929459061255
Energy: 0.7145279090554291
Energy: 0.8268232931050905
Energy: 0.7145279090549209
Energy: 0.826823293103566
Energy: 0.7145279090554291
Energy: 0.826823293106615
Energy: 0.925593619169108
Energy: 0.924697324594047
Energy: 0.9255936191685997
Energy: 0.9246973245935387
Energy: 0.925593619169108
Energy: 0.9246973245935387
Energy: 0.7430125200708829
Energy: 0.8057558973642562
Energy: 0.7430125200703747
Energy: 0.8057558973637481
Energy: 0.7430125200708829
Energy: 0.8057558973642562
Energy: 0.6630612414026742
Energy: 0.8257591606740626
Energy: 0.6630612414036906
Energy: 0.8257591606720298
Energy: 0.6630612414026742
Energy: 0.8257591606740626

minimum gb energy = 0.6630612414026742 eV
minimum distance =  2.29251907360247 Angstroms
sigma value = 81


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

Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.5314273942279031
Energy: 0.046941330041987174
Energy: 0.5314273942260358
Energy: 0.04694133018381191
Energy: 0.5314273942279031
Energy: 0.046941330041987174
Energy: 0.5314396993891444
Energy: 0.046854959179314204
Energy: 0.5314396993891444
Energy: 0.0468549938384023
Energy: 0.5314396993891444
Energy: 0.0468549521000447
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.5314273942260358
Energy: 0.04694133537055722
Energy: 0.5314273942260358
Energy: 0.046941330493645066
Energy: 0.5314273942260358
Energy: 0.04694133192144076
Energy: 0.5314396993891444
Energy: 0.04685490379942858
Energy: 0.5314396993891444
Energy: 0.04685493845291498
Energy: 0.5314396993891444
Energy: 0.04685490942289392
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.04608395527687445
Energy: 0.09949745124812759
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.5314273942279031
Energy: 0.04694133384384067
Energy: 0.5314273942279031
Energy: 0.04694133020808593
Energy: 0.5314273942260358
Energy: 0.04694133103115317
Energy: 0.5314396993891444
Energy: 0.04685494754790355
Energy: 0.5314396993891444
Energy: 0.046854922469029656
Energy: 0.5314396993891444
Energy: 0.04685490245188142
Energy: 0.04608395527687445
Energy: 0.09949745124812759
Energy: 0.04608395527687445
Energy: 0.09949745124999483
Energy: 0.04608395527687445
Energy: 0.09949745124999483

minimum gb energy = 0.04608395527687445 eV
minimum distance =  2.46649664605351 Angstroms
sigma value = 3


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

Energy: 0.9096945329160662
Energy: 0.7346401392186988
Energy: 0.9096945329143901
Energy: 0.7346401392192574
Energy: 0.9096945329160662
Energy: 0.7346401392186988
Energy: 0.7596848841862813
Energy: 0.7545123419753059
Energy: 0.7596848841857227
Energy: 0.7545123419747471
Energy: 0.7596848841868401
Energy: 0.7545123419753059
Energy: 0.7819303414682413
Energy: 0.7528369370327215
Energy: 0.7819303414688001
Energy: 0.7528369370332803
Energy: 0.7819303414688001
Energy: 0.7528369370355154
Energy: 0.8591422280782535
Energy: 0.7687262165160321
Energy: 0.859142228076577
Energy: 0.7687262161239249
Energy: 0.8591422280776946
Energy: 0.7687262183200604
Energy: 0.6416690120976062
Energy: 0.7556780109929542
Energy: 0.6416690120987237
Energy: 0.7556780080227131
Energy: 0.6416690120970473
Energy: 0.7556780093565074
Energy: 0.7858740559587477
Energy: 0.793827028816625
Energy: 0.7858740559581889
Energy: 0.793827028816625
Energy: 0.7858740559587477
Energy: 0.7938270288160663
Energy: 0.8105827774128391
Energy: 0.8375029117484928
Energy: 0.8105827774139567
Energy: 0.8375029117479339
Energy: 0.8105827774139567
Energy: 0.8375029117479339
Energy: 0.6458001517919443
Energy: 0.7680584192123743
Energy: 0.6458001517919443
Energy: 0.768058419212933
Energy: 0.645800151792503
Energy: 0.768058419212933
Energy: 0.7884513281149245
Energy: 0.7982433659077272
Energy: 0.7884513281154832
Energy: 0.7982433659094036
Energy: 0.788451328116042
Energy: 0.7982433659172264
Energy: 0.7373219871234317
Energy: 0.783006710964208
Energy: 0.7373219871251079
Energy: 0.7830067109636492
Energy: 0.7373219871245492
Energy: 0.7830067109636492
Energy: 0.8139160368616939
Energy: 0.7559691300817712
Energy: 0.8139160368622527
Energy: 0.7559691300800949
Energy: 0.8139160368633702
Energy: 0.7559691300817712
Energy: 0.8177999506158817
Energy: 0.832430929488029
Energy: 0.8177999506158817
Energy: 0.8324309294891465
Energy: 0.8177999506164404
Energy: 0.8324309294874701
Energy: 0.7581678599988201
Energy: 0.7588276240426132
Energy: 0.7581678599988201
Energy: 0.7588276240426132
Energy: 0.7581678599949088
Energy: 0.7588276240426132
Energy: 0.8015933843513028
Energy: 0.8172148773188553
Energy: 0.8015933843518616
Energy: 0.8172148773188553
Energy: 0.8015933843513028
Energy: 0.8172148773188553
Energy: 0.7902420954964792
Energy: 0.8012866016734432
Energy: 0.7902420954942438
Energy: 0.8012866016734432
Energy: 0.7902420954959203
Energy: 0.8012866016734432
Energy: 0.761038560133175
Energy: 0.7952320421549364
Energy: 0.7610385601342925
Energy: 0.7952320421549364
Energy: 0.7610385601326162
Energy: 0.7952320421549364
Energy: 0.7438908640138366
Energy: 0.8444413106726603
Energy: 0.7438908640138366
Energy: 0.8444413106737777
Energy: 0.7438908640138366
Energy: 0.844441310673219
Energy: 0.7581903596635422
Energy: 0.773942513255856
Energy: 0.758190359666336
Energy: 0.773942513255856
Energy: 0.7581903596629834
Energy: 0.7739425132564147
Energy: 0.7964768739591659
Energy: 0.8599579001097656
Energy: 0.7964768739602833
Energy: 0.8599579001097656
Energy: 0.7964768739580482
Energy: 0.8599579001103245
Energy: 0.757830528063299
Energy: 0.9003109868545092
Energy: 0.757830528060505
Energy: 0.9003109868539503
Energy: 0.7578305280616227
Energy: 0.9003109868545092
Energy: 0.7934114654508683
Energy: 0.7585095376350793
Energy: 0.793411468377525
Energy: 0.7585095376350793
Energy: 0.793411467940208
Energy: 0.7585095376345206
Energy: 0.7861864831339288
Energy: 0.7431891987885243
Energy: 0.7861864831328113
Energy: 0.7431891987874067
Energy: 0.7861864831356051
Energy: 0.7431891987874067
Energy: 0.7486437698235734
Energy: 0.7831195511582386
Energy: 0.7486440651465692
Energy: 0.783119551159915
Energy: 0.7486418790943951
Energy: 0.7831195511593563
Energy: 0.835362410300272
Energy: 0.736305127503515
Energy: 0.8353624103041835
Energy: 0.7363051275040737
Energy: 0.8353624102997131
Energy: 0.7363051275040737
Energy: 0.7967404657713633
Energy: 0.7754117672828376
Energy: 0.796740465769128
Energy: 0.7754117672822788
Energy: 0.7967404657680105
Energy: 0.77541176728172
Energy: 0.7384247743565497
Energy: 0.7938899555215306
Energy: 0.7384247743565497
Energy: 0.7938899556739744
Energy: 0.7384247743571085
Energy: 0.7938899555611527
Energy: 0.8784753653950815
Energy: 0.6595971339712708
Energy: 0.8784753653950815
Energy: 0.6595971339712708
Energy: 0.8784753653950815
Energy: 0.6595971339712708
Energy: 0.8102023422371712
Energy: 0.7923087701415608
Energy: 0.8102023422377299
Energy: 0.7923087701415608
Energy: 0.8102023422371712
Energy: 0.7923087701421195
Energy: 0.7023314434913449
Energy: 0.7551955109156894
Energy: 0.7023314434919037
Energy: 0.7551955109145718
Energy: 0.7023314434907861
Energy: 0.7551955109112193
Energy: 0.8704419283084462
Energy: 0.7104315967198286
Energy: 0.8704419283084462
Energy: 0.7104315967136821
Energy: 0.8704419283101227
Energy: 0.7104315967170347
Energy: 0.8240801792507527
Energy: 0.7900316466384776
Energy: 0.8240801792518703
Energy: 0.7900316466384776
Energy: 0.8240801792507527
Energy: 0.790031646639595
Energy: 0.7819634669112069
Energy: 0.7431357582478902
Energy: 0.7819634669106481
Energy: 0.7431357582551543
Energy: 0.7819634669112069
Energy: 0.7431357582618596
Energy: 0.8082845236601252
Energy: 0.7467105428815659
Energy: 0.8082845236601252
Energy: 0.7467105428815659
Energy: 0.808284523660684
Energy: 0.7467105428815659

minimum gb energy = 0.6416690120970473 eV
minimum distance =  2.34046777627345 Angstroms
sigma value = 67


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

Energy: 1.066860992285046
Energy: 0.9094412507187134
Energy: 1.0668609922858423
Energy: 0.9094412507195097
Energy: 1.0668609922858423
Energy: 0.9094412507187134
Energy: 0.9067286250874977
Energy: 0.9421937850289533
Energy: 0.9067286250890899
Energy: 0.9421937850289533
Energy: 0.9067286250882939
Energy: 0.9421937850281572
Energy: 0.9818632634154105
Energy: 0.9365076116205276
Energy: 0.9818632634154105
Energy: 0.9365076116237123
Energy: 0.9818632634154105
Energy: 0.9365076116237123
Energy: 1.0065053179438763
Energy: 0.9044798703675945
Energy: 1.0065053179438763
Energy: 0.9044798703667983
Energy: 1.00650531794308
Energy: 0.9044798703667983
Energy: 0.7844562279412038
Energy: 0.8923476041923573
Energy: 0.7844562279435925
Energy: 0.8923476041931534
Energy: 0.7844562279420001
Energy: 0.8923476041931534
Energy: 0.9824120116097975
Energy: 0.9832448188141552
Energy: 0.9824120116097975
Energy: 0.9832448188141552
Energy: 0.9824120116105937
Energy: 0.9832448188149515
Energy: 0.9069936435308282
Energy: 0.9888272022960339
Energy: 0.9069936435316244
Energy: 0.9888272022968301
Energy: 0.9069936435308282
Energy: 0.9888272022968301
Energy: 1.0314047346829742
Energy: 0.8931664457917566
Energy: 1.031404734686159
Energy: 0.8931664457917566
Energy: 1.0314047346853628
Energy: 0.8931664457917566
Energy: 1.0149087086792734
Energy: 1.0182210508961809
Energy: 1.0149087086792734
Energy: 1.0182210508969771
Energy: 1.0149087086800692
Energy: 1.0182210508969771
Energy: 0.9123500210400773
Energy: 0.9627011748953105
Energy: 0.9123500210400773
Energy: 0.9627011748953105
Energy: 0.9123500210392812
Energy: 0.9627011748953105
Energy: 0.91632094847772
Energy: 0.9831534862735287
Energy: 0.91632094847772
Energy: 0.9831534862735287
Energy: 0.9163209484769237
Energy: 0.9831534862735287
Energy: 0.9087114547640645
Energy: 0.9700598680077982
Energy: 0.9087114547632681
Energy: 0.9700598680070021
Energy: 0.9087114547632681
Energy: 0.9700598680070021
Energy: 0.9824850015211378
Energy: 1.0141585285850871
Energy: 0.9824850015203416
Energy: 1.0141585285858832
Energy: 0.9824850015203416
Energy: 1.0141585285858832
Energy: 0.8974248393677959
Energy: 1.021584458915451
Energy: 0.8974248393662034
Energy: 1.021584458914655
Energy: 0.8974248393662034
Energy: 1.021584458915451
Energy: 0.9215565617168378
Energy: 0.9149762539027144
Energy: 0.9215565617176339
Energy: 0.9149762539027144
Energy: 0.9215565617176339
Energy: 0.9149762539035106
Energy: 0.9175579957923965
Energy: 0.9374540600935275
Energy: 0.9175579958003585
Energy: 0.9374540600927314
Energy: 0.9175579957916005
Energy: 0.9374540600935275
Energy: 0.926113583150487
Energy: 1.0122412239236278
Energy: 0.9261135831496908
Energy: 1.0122412239228318
Energy: 0.9261135831488946
Energy: 1.0122412239236278
Energy: 0.9506883923502861
Energy: 0.8918869534899063
Energy: 0.9506883923502861
Energy: 0.8918869534899063
Energy: 0.9506883923502861
Energy: 0.8918869534907026
Energy: 0.9972816523879089
Energy: 0.9900682873832123
Energy: 0.9972816523887053
Energy: 0.9900682873840084
Energy: 0.9972816523871127
Energy: 0.9900682873840084
Energy: 0.9962603622315401
Energy: 0.9436647543100882
Energy: 0.9962603622315401
Energy: 0.9436647543084961
Energy: 0.9962603622315401
Energy: 0.9436647543092921
Energy: 1.0380346200752208
Energy: 0.8999504130116237
Energy: 1.0380346200752208
Energy: 0.8999504130108275
Energy: 1.0380346200752208
Energy: 0.8999504130108275
Energy: 0.999984607984176
Energy: 0.9292718200128587
Energy: 0.9999846079849724
Energy: 0.9292718200128587
Energy: 0.999984607984176
Energy: 0.9292718200128587
Energy: 0.9955121854298205
Energy: 1.0268597039781373
Energy: 0.9580164706688572
Energy: 1.0268597039781373
Energy: 0.9580164706688572
Energy: 1.0268597039781373

minimum gb energy = 0.7844562279412038 eV
minimum distance =  2.33824793491927 Angstroms
sigma value = 33


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

Energy: 1.2158185618357547
Energy: 1.0140131884563734
Energy: 1.1717517758677383
Energy: 1.0140131884563734
Energy: 1.2158185618347443
Energy: 1.0140131884563734
Energy: 1.0383540205177384
Energy: 1.0734988526870322
Energy: 1.0383540205172332
Energy: 1.0734988526895575
Energy: 1.0383540205177384
Energy: 1.0734988526900626
Energy: 1.0981562654566561
Energy: 1.14878063008929
Energy: 1.0981562654591355
Energy: 1.1487806300867642
Energy: 1.0981562654601458
Energy: 1.1487806300867642
Energy: 1.1340500673837914
Energy: 1.0183059485374737
Energy: 1.1340500673842966
Energy: 1.0183059485369685
Energy: 1.1340500673842966
Energy: 1.0183059485364636
Energy: 0.9392572087952313
Energy: 1.023919380167138
Energy: 0.9392572087957365
Energy: 1.0239193801666329
Energy: 0.9392572087977568
Energy: 1.023919380167138
Energy: 1.1634813518677485
Energy: 1.1173840614134858
Energy: 1.1634813518672433
Energy: 1.1908015846376203
Energy: 1.1634813518667382
Energy: 1.1173840614129809
Energy: 0.9970585291358134
Energy: 1.0414413190932899
Energy: 0.9970585291373285
Energy: 1.0414413190917746
Energy: 0.9970585291353083
Energy: 1.0414413190917746
Energy: 1.1324002435825007
Energy: 1.103547122630108
Energy: 1.1324002435819955
Energy: 1.1035471226285927
Energy: 1.1324002435830058
Energy: 1.1035471226285927
Energy: 1.0474482236703444
Energy: 1.0965918136101633
Energy: 1.0466138406917065
Energy: 1.0965918136096584
Energy: 1.0474482236708496
Energy: 1.0965918136101633
Energy: 1.0735883458240412
Energy: 0.9929871233454843
Energy: 1.073588345823031
Energy: 0.9929871233409384
Energy: 1.073588345823031
Energy: 1.0214049002451184
Energy: 1.1316465734049594
Energy: 1.1543158048972788
Energy: 1.1292706265934955
Energy: 1.1543158048962687
Energy: 1.1316465700577423
Energy: 1.1543158048957634
Energy: 0.9963952593003997
Energy: 1.057330991325571
Energy: 0.9963952593003997
Energy: 1.057330991325571
Energy: 0.9963952593014098
Energy: 1.0573309913250661
Energy: 1.1681828549362638
Energy: 1.0732923671688388
Energy: 1.1681828549362638
Energy: 1.0732923671698489
Energy: 1.1681828549352538
Energy: 1.0732923671698489
Energy: 1.0571014310784406
Energy: 1.1481054323340247
Energy: 1.0571014310769256
Energy: 1.1481054323340247
Energy: 1.0571014310764204
Energy: 1.1481054323345299
Energy: 1.0385496410467128
Energy: 1.0672874057896853
Energy: 1.0385496410462078
Energy: 1.0672874057896853
Energy: 1.0385496410457027
Energy: 1.0672874057896853
Energy: 1.134032727698319
Energy: 1.0780133135137127
Energy: 1.1340327276993294
Energy: 1.0780133135137127
Energy: 1.1340327276993294
Energy: 1.0780133135127026
Energy: 1.1250802787853134
Energy: 1.1092639371813868
Energy: 1.1250802787868284
Energy: 1.1092639371798716
Energy: 1.1250802787878387
Energy: 1.1092639371803765
Energy: 1.1270348310842346
Energy: 1.1989346039582125
Energy: 1.1270348310847398
Energy: 1.1989346039577073
Energy: 1.1270348310862548
Energy: 1.1989346039577073
Energy: 1.0026327240360504
Energy: 1.1530099820231592
Energy: 1.0026327240355453
Energy: 1.1530099820266946
Energy: 1.0026327240340303
Energy: 1.1530099820266946
Energy: 1.1751089219647612
Energy: 1.0342930123768508
Energy: 1.175108921964256
Energy: 1.034293012378366
Energy: 1.1751089219647612
Energy: 1.034293012378366
Energy: 1.1350833743588575
Energy: 1.188471957939436
Energy: 1.1347099532835905
Energy: 1.1884719579374154
Energy: 1.1350833743568371
Energy: 1.1884719579374154
Energy: 1.0472321215374372
Energy: 0.9549694827581074
Energy: 1.0472321215374372
Energy: 0.9549694827601278
Energy: 1.0472321215394575
Energy: 0.9549694827606329
Energy: 1.101789461960726
Energy: 1.1485715241013257
Energy: 1.0026000888206987
Energy: 1.1485715241008208
Energy: 1.101789461960726
Energy: 1.1485715241003156
Energy: 1.1438043691436082
Energy: 1.0725598263111045
Energy: 1.1827969492808996
Energy: 1.0725598263105993
Energy: 1.1438043691451236
Energy: 1.0725598263100944
Energy: 1.0362982742623055
Energy: 1.0551661557429883
Energy: 0.9970563110024846
Energy: 1.0551661557434935
Energy: 1.0362982742607902
Energy: 1.0551661557429883
Energy: 1.0724474737411454
Energy: 1.1551168712019764
Energy: 1.0724474737396301
Energy: 1.155116871202987
Energy: 1.0724474737416505
Energy: 1.155116871202987
Energy: 0.9860653187856742
Energy: 1.015441664321357
Energy: 0.9860653187856742
Energy: 1.0154416643248927
Energy: 0.9860653187871895
Energy: 1.0154416643248927
Energy: 1.1249297574810293
Energy: 1.165771044216346
Energy: 1.1249297574825448
Energy: 1.1657710442183664
Energy: 1.1249297574830497
Energy: 1.1265766206003962
Energy: 1.056223405289237
Energy: 1.0227127768162618
Energy: 1.056223405072646
Energy: 1.0227127760402632
Energy: 1.056223405117553
Energy: 1.0227127773069777
Energy: 0.9960623244538954
Energy: 0.9924823836797451
Energy: 0.9960623244528851
Energy: 0.9924823836807554
Energy: 0.9960623244528851
Energy: 0.9924823836782299
Energy: 1.187392386984808
Energy: 1.1513270018768589
Energy: 1.1873923869863234
Energy: 1.151327001877869
Energy: 1.187392386984808
Energy: 1.151327001877869
Energy: 0.998605839778676
Energy: 1.034196097083474
Energy: 0.9986690179289711
Energy: 1.0341960970829691
Energy: 0.9986058397812014
Energy: 1.0341960970839792
Energy: 1.1326615929508093
Energy: 1.2406125629528575
Energy: 1.1326604800037616
Energy: 1.2406125629528575
Energy: 1.1326615929518193
Energy: 1.2406125629528575
Energy: 1.0992263954424268
Energy: 1.069517702946898
Energy: 1.099226395442932
Energy: 1.0695177029453828
Energy: 1.0992263954424268
Energy: 1.069517702946393
Energy: 1.016258451927166
Energy: 1.1494958421186443
Energy: 1.0162584519241358
Energy: 1.1494958421206647
Energy: 1.0162584519246407
Energy: 1.1494958421201593
Energy: 1.1709601650437598
Energy: 1.0165494154367893
Energy: 1.1709601650442647
Energy: 1.016549415436284
Energy: 1.1709601650422445
Energy: 1.016549415436284
Energy: 1.0416577891902639
Energy: 1.0809885447344638
Energy: 1.041657789189759
Energy: 1.0809885447344638
Energy: 1.041657789190769
Energy: 1.080988544735979

minimum gb energy = 0.9392572087952313 eV
minimum distance =  2.28261346167755 Angstroms
sigma value = 41


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

Energy: 1.2852401480234925
Energy: 1.118540179119839
Energy: 1.2852401480234925
Energy: 1.118540179119839
Energy: 1.2852401480234925
Energy: 1.118540179119839
Energy: 1.1260793575527002
Energy: 1.224021047868618
Energy: 1.1260793575540793
Energy: 1.224021047868618
Energy: 1.1260793575527002
Energy: 1.224021047868618
Energy: 1.317439103976544
Energy: 1.2272690703543792
Energy: 1.3208475844713363
Energy: 1.2272690703543792
Energy: 1.3208475844713363
Energy: 1.2272690703543792
Energy: 1.2221945768232036
Energy: 1.3387845449273486
Energy: 1.222194576824583
Energy: 1.3387845449273486
Energy: 1.222194576824583
Energy: 1.3387845449273486
Energy: 1.1000513624158186
Energy: 1.1630182230665658
Energy: 1.1000513624158186
Energy: 1.1630182230651864
Energy: 1.1000513624158186
Energy: 1.1630182230665658
Energy: 1.357660099510589
Energy: 1.264499954092206
Energy: 1.357660099510589
Energy: 1.264499954093585
Energy: 1.357660099510589
Energy: 1.264499954093585
Energy: 1.2911844185245112
Energy: 1.3096321526015664
Energy: 1.2911844185245112
Energy: 1.3096321526001875
Energy: 1.2911844185245112
Energy: 1.3096321526015664
Energy: 1.2164680072706515
Energy: 1.22583802819487
Energy: 1.2164680072706515
Energy: 1.22583802819487
Energy: 1.2164680072706515
Energy: 1.22583802819487
Energy: 1.1250392896117287
Energy: 1.1404303836528689
Energy: 1.1250392896117287
Energy: 1.1404303836556269
Energy: 1.1250392896117287
Energy: 1.140430383654248
Energy: 1.2787066191829304
Energy: 1.1632545834435999
Energy: 1.2787066191843095
Energy: 1.1632545834422208
Energy: 1.2787066191829304
Energy: 1.1632545834408419
Energy: 1.1267002730324946
Energy: 1.2272730901422289
Energy: 1.1267002730324946
Energy: 1.2272730901422289
Energy: 1.1267002730324946
Energy: 1.2272730901422289
Energy: 1.2093158417187353
Energy: 1.2233856968136014
Energy: 1.2093158417201142
Energy: 1.2233856968136014
Energy: 1.2093158417187353
Energy: 1.2233856968136014
Energy: 1.2543885584447396
Energy: 1.2495752782039262
Energy: 1.2543885584447396
Energy: 1.2495752782039262
Energy: 1.2543885584447396
Energy: 1.2495752782011682
Energy: 1.2384453943238452
Energy: 1.1794853103581646
Energy: 1.2384453943252243
Energy: 1.1794853103567855
Energy: 1.2384453943252243
Energy: 1.1794853103581646

minimum gb energy = 1.1000513624158186 eV
minimum distance =  2.29409666562518 Angstroms
sigma value = 11


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

Energy: 1.426101843400179
Energy: 1.3597917968190723
Energy: 1.426101843400785
Energy: 1.3597917968190723
Energy: 1.426101843400179
Energy: 1.3597917968190723
Energy: 1.219127344495176
Energy: 1.349039276613673
Energy: 1.219127344495782
Energy: 1.349039276613673
Energy: 1.219127344495782
Energy: 1.3490392766142787
Energy: 1.3916111362762207
Energy: 1.3267239302303948
Energy: 1.3916111362768264
Energy: 1.3267239302297889
Energy: 1.3344465613418683
Energy: 1.3267239302297889
Energy: 1.3456776793108007
Energy: 1.2190403871462474
Energy: 1.3456776793108007
Energy: 1.2190403871462474
Energy: 1.345677679310195
Energy: 1.2190403871456417
Energy: 1.3576358086373312
Energy: 1.3218752558510192
Energy: 1.3576358086367257
Energy: 1.3218752558516247
Energy: 1.3576358086367257
Energy: 1.3218752558516247
Energy: 1.2914550349300538
Energy: 1.348067923579022
Energy: 1.2914550349300538
Energy: 1.348067923579022
Energy: 1.2914550349300538
Energy: 1.348067923579022
Energy: 1.3492683296707626
Energy: 1.268851225836425
Energy: 1.3492683296707626
Energy: 1.268851225836425
Energy: 1.3492683296707626
Energy: 1.268851225836425
Energy: 1.2826578915993967
Energy: 1.3141318876183639
Energy: 1.2826578916000024
Energy: 1.3141318876183639
Energy: 1.2826578916000024
Energy: 1.3141318876177581
Energy: 1.3058262772859817
Energy: 1.3141086498615073
Energy: 1.3058262772859817
Energy: 1.3141086498615073
Energy: 1.3058262772859817
Energy: 1.3141086498621133
Energy: 1.3225075263170927
Energy: 1.298102677345099
Energy: 1.3225075263170927
Energy: 1.298102677345099
Energy: 1.322507526316487
Energy: 1.298102677344493
Energy: 1.272488472473442
Energy: 1.3515518473425079
Energy: 1.272488472473442
Energy: 1.3515518473425079
Energy: 1.2724884724746537
Energy: 1.3515518473425079
Energy: 1.3379575217844584
Energy: 1.3641218595982487
Energy: 1.3379575217844584
Energy: 1.3641218595988545
Energy: 1.3379575217850643
Energy: 1.3641218595982487
Energy: 1.350860102808061
Energy: 1.2645820796638072
Energy: 1.350860102807455
Energy: 1.2645820796638072
Energy: 1.350860102808061
Energy: 1.2645820796638072
Energy: 1.281220463400148
Energy: 1.339108992067531
Energy: 1.2812204633995425
Energy: 1.339108992066925
Energy: 1.281220463400148
Energy: 1.339108992067531
Energy: 1.2656692530730709
Energy: 1.2991935207790304
Energy: 1.2656692530730709
Energy: 1.2991935207790304
Energy: 1.2656692530730709
Energy: 1.2991935207790304
Energy: 1.3545632726784564
Energy: 1.2670471280184157
Energy: 1.3545632726784564
Energy: 1.2670471280184157
Energy: 1.3545632726784564
Energy: 1.2670471280190214
Energy: 1.2349278664887495
Energy: 1.3526636019683014
Energy: 1.2349278664893555
Energy: 1.3526636019683014
Energy: 1.2349278664893555
Energy: 1.3526636019683014
Energy: 1.348714565576694
Energy: 1.370257463708809
Energy: 1.3487145655736648
Energy: 1.3702574637082032
Energy: 1.3487145655779054
Energy: 1.3702574637082032
Energy: 1.2918465430811708
Energy: 1.1949626408452563
Energy: 1.2918465430811708
Energy: 1.1949626408446505
Energy: 1.2918465430817767
Energy: 1.1949626408446505
Energy: 1.2820234021325583
Energy: 1.3342413830958049
Energy: 1.282023402274841
Energy: 1.3342413830958049
Energy: 1.2820234022142873
Energy: 1.3342413830958049
Energy: 1.2361843872710423
Energy: 1.2640944437998456
Energy: 1.2361843872710423
Energy: 1.2640944437992396
Energy: 1.2361843872710423
Energy: 1.2640944437998456
Energy: 1.3786660805848547
Energy: 1.3655730605897622
Energy: 1.378666080584249
Energy: 1.3655730605897622
Energy: 1.3786660805848547
Energy: 1.3655730605897622
Energy: 1.2624818153195896
Energy: 1.3336558125096794
Energy: 1.2624818153201953
Energy: 1.3336558125090736
Energy: 1.2624818153201953
Energy: 1.3336558125096794
Energy: 1.3655536578998957
Energy: 1.347036572374325
Energy: 1.3655536578998957
Energy: 1.347036572374325
Energy: 1.3655536579005014
Energy: 1.347036572374325
Energy: 1.3206682561177394
Energy: 1.2948853010815047
Energy: 1.3206682561177394
Energy: 1.2948853010815047
Energy: 1.3206682561183452
Energy: 1.2948853010821106
Energy: 1.24622493534232
Energy: 1.344788949940059
Energy: 1.24622493534232
Energy: 1.344788949940059
Energy: 1.24622493534232
Energy: 1.344788949940059
Energy: 1.295852789571031
Energy: 1.358919701805041
Energy: 1.295852789571637
Energy: 1.3589197018056467
Energy: 1.295852789571031
Energy: 1.3589197018056467
Energy: 1.356079679487524
Energy: 1.2608429123245097
Energy: 1.356079679487524
Energy: 1.2608429123245097
Energy: 1.356079679487524
Energy: 1.260842912323904
Energy: 1.2828804171371493
Energy: 1.3281363565319573
Energy: 1.2828804171371493
Energy: 1.3281363565265052
Energy: 1.2828804171371493
Energy: 1.32813635653014
Energy: 1.2720277790679524
Energy: 1.2117283451759082
Energy: 1.2720277790685581
Energy: 1.2117283451759082
Energy: 1.2720277790685581
Energy: 1.211728345176514
Energy: 1.3241796094296312
Energy: 1.3602874300553431
Energy: 1.3241796094302372
Energy: 1.3602874300553431
Energy: 1.3241796094296312
Energy: 1.3602874300553431

minimum gb energy = 1.1949626408446505 eV
minimum distance =  2.2614350818872 Angstroms
sigma value = 57


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

Energy: 1.237621510973858
Energy: 1.139665873302032
Energy: 1.237621510973858
Energy: 1.139665873302032
Energy: 1.237621510973858
Energy: 1.139665873302032
Energy: 1.2979864217485566
Energy: 1.3512853635364286
Energy: 1.2979864217485566
Energy: 1.3512853635375066
Energy: 1.2979864217474788
Energy: 1.3512853635364286
Energy: 1.3311275826660989
Energy: 1.2618824496254266
Energy: 1.3311275826660989
Energy: 1.2618824496254266
Energy: 1.3311275826660989
Energy: 1.2618824496254266
Energy: 1.2235797484665656
Energy: 1.2963914981544746
Energy: 1.2235797484665656
Energy: 1.2963914981544746
Energy: 1.2235797484665656
Energy: 1.2963914981544746
Energy: 1.331028458340177
Energy: 1.2618809432660305
Energy: 1.331028458335914
Energy: 1.2618809432660305
Energy: 1.331028458339099
Energy: 1.2618809432660305
Energy: 1.298178318266783
Energy: 1.3170611978349953
Energy: 1.298178318266783
Energy: 1.3170611978349953
Energy: 1.298178318266783
Energy: 1.3170611978349953
Energy: 1.237621510973858
Energy: 1.1396658733009541
Energy: 1.23762151097278
Energy: 1.1396658733009541
Energy: 1.237621510973858
Energy: 1.1396658733009541
Energy: 1.2979864217496349
Energy: 1.3512853635353506
Energy: 1.2979864217496349
Energy: 1.3512853635353506
Energy: 1.2979864217496349
Energy: 1.3512853635364286
Energy: 1.3311275826660989
Energy: 1.2618824496243486
Energy: 1.3311275826660989
Energy: 1.2618824496243486
Energy: 1.3311275826650208
Energy: 1.2618824496243486
Energy: 1.2235797484676436
Energy: 1.2963914981555524
Energy: 1.2235797484676436
Energy: 1.2963914981555524
Energy: 1.2235797484676436
Energy: 1.2963914981555524
Energy: 1.33102845833807
Energy: 1.2618809432660305
Energy: 1.331028458335914
Energy: 1.2618809432660305
Energy: 1.331028458336992
Energy: 1.2618809432660305
Energy: 1.298178318266783
Energy: 1.3170611978339173
Energy: 1.298178318266783
Energy: 1.3170611978349953
Energy: 1.298178318266783
Energy: 1.3170611978349953
Energy: 1.237621510973858
Energy: 1.139665873302032
Energy: 1.237621510973858
Energy: 1.139665873302032
Energy: 1.237621510973858
Energy: 1.139665873302032
Energy: 1.2979864217485566
Energy: 1.3512853635364286
Energy: 1.2979864217474788
Energy: 1.3512853635364286
Energy: 1.2979864217474788
Energy: 1.3512853635364286
Energy: 1.3311275826660989
Energy: 1.2618824496254266
Energy: 1.3311275826660989
Energy: 1.2618824496254266
Energy: 1.3311275826660989
Energy: 1.2618824496254266
Energy: 1.2235797484665656
Energy: 1.2963914981544746
Energy: 1.2235797484665656
Energy: 1.2963914981544746
Energy: 1.2235797484665656
Energy: 1.2963914981544746
Energy: 1.331028458340177
Energy: 1.2618809432660305
Energy: 1.331028458341255
Energy: 1.2618809432660305
Energy: 1.331028458340177
Energy: 1.2618809432660305

minimum gb energy = 1.1396658733009541 eV
minimum distance =  2.32866965669821 Angstroms
sigma value = 9


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

Energy: 1.3453477857507987
Energy: 1.3694000298361706
Energy: 1.3453477857516791
Energy: 1.3694000298352904
Energy: 1.3453477857516791
Energy: 1.3694000298361706
Energy: 1.2790916904650185
Energy: 1.3630568810471413
Energy: 1.2790916904658984
Energy: 1.3630568810471413
Energy: 1.2790916904658984
Energy: 1.3630568810471413
Energy: 1.2827660272320933
Energy: 1.287011224671795
Energy: 1.2827660272320933
Energy: 1.2870112246726753
Energy: 1.2827660272320933
Energy: 1.287011224671795
Energy: 1.2756570702640546
Energy: 1.4541559062790528
Energy: 1.2756570702640546
Energy: 1.4541559062790528
Energy: 1.2756570702640546
Energy: 1.4541559062781726
Energy: 1.2727185693617316
Energy: 1.3121421961988577
Energy: 1.272718569363492
Energy: 1.3121421962006181
Energy: 1.2727185693626115
Energy: 1.3121421961997382
Energy: 1.2943587900108795
Energy: 1.308410199838271
Energy: 1.2943587900108795
Energy: 1.3084101998373905
Energy: 1.2943587900108795
Energy: 1.308410199838271
Energy: 1.2846315310548648
Energy: 1.292795852489069
Energy: 1.2846315310548648
Energy: 1.292795852489069
Energy: 1.2846315310548648
Energy: 1.2927958524899494
Energy: 1.2863534605279165
Energy: 1.3165999841747487
Energy: 1.2863534605279165
Energy: 1.3165999841738685
Energy: 1.2863534605279165
Energy: 1.3165999841738685
Energy: 1.4414018102603532
Energy: 1.2858896366475545
Energy: 1.4414018102603532
Energy: 1.2858896366484347
Energy: 1.4414018102603532
Energy: 1.2858896366484347
Energy: 1.2860229309000064
Energy: 1.2726399772900563
Energy: 1.2860229309000064
Energy: 1.2726399772900563
Energy: 1.2860229309000064
Energy: 1.272639977289176
Energy: 1.2751069493290974
Energy: 1.2772348305536045
Energy: 1.2751069493290974
Energy: 1.2772348305527244
Energy: 1.2751069493290974
Energy: 1.2772348305527244
Energy: 1.331673490588993
Energy: 1.3095319404471422
Energy: 1.331673490588993
Energy: 1.3095319404471422
Energy: 1.331673490588993
Energy: 1.3095319404471422
Energy: 1.2791538006995267
Energy: 1.3164848548975872
Energy: 1.2791538006995267
Energy: 1.3164848548975872
Energy: 1.2791538007004069
Energy: 1.3164848548984673
Energy: 1.3054865460306078
Energy: 1.2829267961513457
Energy: 1.3054865460306078
Energy: 1.2829267961504653
Energy: 1.3054865460314877
Energy: 1.2829267961504653
Energy: 1.2948286152876136
Energy: 1.296720829103871
Energy: 1.2948286152867334
Energy: 1.296720829103871
Energy: 1.3599957926255368
Energy: 1.2967208291029906
Energy: 1.3413029577111664
Energy: 1.3371379602108449
Energy: 1.3413029577111664
Energy: 1.3371379602108449
Energy: 1.341302957709406
Energy: 1.3371379602108449
Energy: 1.3375282499953358
Energy: 1.2783913793973873
Energy: 1.3375282499944554
Energy: 1.2783913793973873
Energy: 1.3375282499944554
Energy: 1.2783913793982677
Energy: 1.4219300197696836
Energy: 1.3019238374292026
Energy: 1.4219300197688034
Energy: 1.3019238374292026
Energy: 1.4219300197688034
Energy: 1.3019238374292026
Energy: 1.272762935629277
Energy: 1.2840259536290637
Energy: 1.272762935629277
Energy: 1.2840259536290637
Energy: 1.2727629356283965
Energy: 1.2840259536281835
Energy: 1.3480794136759302
Energy: 1.3085898249392034
Energy: 1.3480794136750498
Energy: 1.3085898249392034
Energy: 1.3480794136759302
Energy: 1.3085898249392034
Energy: 1.3334528491886903
Energy: 1.3242831744016481
Energy: 1.3334528491886903
Energy: 1.3242831744016481
Energy: 1.3334528491886903
Energy: 1.3242831744016481

minimum gb energy = 1.272639977289176 eV
minimum distance =  2.27798735473313 Angstroms
sigma value = 27


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

Energy: 1.330116020572857
Energy: 1.303774478925739
Energy: 1.330116020572857
Energy: 1.303774478925739
Energy: 1.330116020573599
Energy: 1.303774478925739
Energy: 1.2658544981836806
Energy: 1.2205801582151208
Energy: 1.2658544981836806
Energy: 1.2205801582158626
Energy: 1.2658544981836806
Energy: 1.2205801582158626
Energy: 1.2202334361956026
Energy: 1.2947212298054855
Energy: 1.2202334361970864
Energy: 1.2947212298062276
Energy: 1.2202334361970864
Energy: 1.2947212298062276
Energy: 1.2555663806351542
Energy: 1.2715138159626673
Energy: 1.2555663806358963
Energy: 1.2715138159634092
Energy: 1.2555663806351542
Energy: 1.2715138159634092
Energy: 1.2231762888454776
Energy: 1.1727402145979298
Energy: 1.2231762888454776
Energy: 1.1727402145986718
Energy: 1.2231762888454776
Energy: 1.1727402145986718
Energy: 1.1616995740293852
Energy: 1.2584789312161935
Energy: 1.161699574030127
Energy: 1.2584789312161935
Energy: 1.161699574030127
Energy: 1.2584789312154512
Energy: 1.2545537438708385
Energy: 1.2390092334058733
Energy: 1.2545537438700964
Energy: 1.2390092334058733
Energy: 1.2545537438708385
Energy: 1.2390092334058733
Energy: 1.2749976002371706
Energy: 1.2837258938067442
Energy: 1.2749976002371706
Energy: 1.2837258938067442
Energy: 1.2749976002371706
Energy: 1.2837258938067442
Energy: 1.2301739359036696
Energy: 1.258468459990561
Energy: 1.2301739359036696
Energy: 1.258468459990561
Energy: 1.2301739359036696
Energy: 1.258468459991303
Energy: 1.2551821295942736
Energy: 1.2325318101565794
Energy: 1.2551821295942736
Energy: 1.2325318101565794
Energy: 1.2551821295950154
Energy: 1.2325318101565794
Energy: 1.2550292990370089
Energy: 1.3057994472440242
Energy: 1.2550292990384928
Energy: 1.3057994472440242
Energy: 1.255029299035525
Energy: 1.3057994472440242
Energy: 1.2377548938099951
Energy: 1.2858191744336496
Energy: 1.2377548938099951
Energy: 1.2858191744336496
Energy: 1.2377548938099951
Energy: 1.2858191744336496
Energy: 1.2867298823793554
Energy: 1.2731639223517035
Energy: 1.2867298823793554
Energy: 1.2731639223517035
Energy: 1.2867298823793554
Energy: 1.2731639223517035
Energy: 1.2552688024039886
Energy: 1.229140165073808
Energy: 1.2552688024039886
Energy: 1.229140165073808
Energy: 1.2552688024039886
Energy: 1.229140165073808
Energy: 1.1617957073869631
Energy: 1.2583035721671723
Energy: 1.1617957073869631
Energy: 1.2583035721671723
Energy: 1.1617957073877048
Energy: 1.2583035721671723
Energy: 1.2229451583426487
Energy: 1.2399122448226325
Energy: 1.2229451583419406
Energy: 1.2399122448189226
Energy: 1.2229451583419406
Energy: 1.2399122448189226
Energy: 1.267645553274416
Energy: 1.2219864630202344
Energy: 1.267645553274416
Energy: 1.2219864630202344
Energy: 1.267645553273674
Energy: 1.2219864630209762
Energy: 1.2715803956105458
Energy: 1.3208722812355345
Energy: 1.2715803956098037
Energy: 1.3208722812355345
Energy: 1.2715803956098037
Energy: 1.3208722812347926
Energy: 1.158252019937519
Energy: 1.2209495254579954
Energy: 1.1582520199382609
Energy: 1.2209495254587375
Energy: 1.158252019937519
Energy: 1.2209495254587375
Energy: 1.330116020572115
Energy: 1.303774478924997
Energy: 1.330116020572115
Energy: 1.303774478924997
Energy: 1.330116020572857
Energy: 1.303774478924997
Energy: 1.2658544981829385
Energy: 1.2205801582166047
Energy: 1.2658544981829385
Energy: 1.2205801582166047
Energy: 1.2658544981829385
Energy: 1.2205801582166047
Energy: 1.2202334361985703
Energy: 1.2947212298062276
Energy: 1.2202334361985703
Energy: 1.2947212298062276
Energy: 1.2202334361970864
Energy: 1.2947212298062276
Energy: 1.2555663806358963
Energy: 1.271513815959699
Energy: 1.2555663806358963
Energy: 1.2715138159611834
Energy: 1.2555663806366386
Energy: 1.271513815959699
Energy: 1.2231762888447355
Energy: 1.1727402146001558
Energy: 1.2231762888447355
Energy: 1.1727402146001558
Energy: 1.2231762888447355
Energy: 1.1727402146001558
Energy: 1.161699574030127
Energy: 1.2584789312154512
Energy: 1.1616995740293852
Energy: 1.2584789312161935
Energy: 1.161699574030127
Energy: 1.2584789312154512

minimum gb energy = 1.158252019937519 eV
minimum distance =  2.31775100542064 Angstroms
sigma value = 19


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

Energy: 1.2748583365505997
Energy: 1.395125910917523
Energy: 1.2748583365505997
Energy: 1.395125910917523
Energy: 1.2748583365505997
Energy: 1.395125910917523
Energy: 1.2835315148279123
Energy: 1.2917010718023305
Energy: 1.283531514827272
Energy: 1.29170107180169
Energy: 1.283531514827272
Energy: 1.29170107180169
Energy: 1.4568190660426275
Energy: 1.2242240007572098
Energy: 1.3406661260505677
Energy: 1.2242240007565692
Energy: 1.3406661260499273
Energy: 1.2242240007572098
Energy: 1.2208238229736943
Energy: 1.283045702301467
Energy: 1.2208238229736943
Energy: 1.283045702301467
Energy: 1.2208238229736943
Energy: 1.283045702301467
Energy: 1.2594521135432766
Energy: 1.2429959821032341
Energy: 1.2594521135432766
Energy: 1.2429959821032341
Energy: 1.2594521135432766
Energy: 1.2429959821032341
Energy: 1.293640234609895
Energy: 1.2321040177580642
Energy: 1.293640234609895
Energy: 1.2321040177587048
Energy: 1.293640234609895
Energy: 1.2321040177580642
Energy: 1.2163600781996415
Energy: 1.420893579491729
Energy: 1.2163600782002821
Energy: 1.420893579491729
Energy: 1.2163600782002821
Energy: 1.4208935794923694
Energy: 1.2513160252125568
Energy: 1.4189318716098198
Energy: 1.2513160252119162
Energy: 1.4189318716098198
Energy: 1.2513160252125568
Energy: 1.4189318716098198
Energy: 1.2879975071542191
Energy: 1.2001699130571566
Energy: 1.2879975071542191
Energy: 1.2001699130571566
Energy: 1.2879975071542191
Energy: 1.2001699130571566
Energy: 1.2848441327352194
Energy: 1.2902633293920869
Energy: 1.284844132734579
Energy: 1.2902633293920869
Energy: 1.284844132734579
Energy: 1.2902633293920869
Energy: 1.203649189516756
Energy: 1.4247716425005796
Energy: 1.203649189516756
Energy: 1.4247716425005796
Energy: 1.203649189516756
Energy: 1.4247716425005796
Energy: 1.2779544812994301
Energy: 1.2244692666461876
Energy: 1.2779544812994301
Energy: 1.2244692666461876
Energy: 1.2779544812994301
Energy: 1.2244692666461876
Energy: 1.2603732267569996
Energy: 1.2543723362835837
Energy: 1.2603732267569996
Energy: 1.2543723362835837
Energy: 1.26037322675764
Energy: 1.2543723362835837
Energy: 1.2276653854928834
Energy: 1.2780860675863408
Energy: 1.2276653854928834
Energy: 1.2780860675863408
Energy: 1.2276653854928834
Energy: 1.2780860675863408
Energy: 1.2907346362572996
Energy: 1.225051878969889
Energy: 1.2907346362572996
Energy: 1.2250518789705294
Energy: 1.2907346362572996
Energy: 1.225051878969889
Energy: 1.412440734692589
Energy: 1.2002806390294303
Energy: 1.4124407346919485
Energy: 1.2002806390294303
Energy: 1.4124407346919485
Energy: 1.2002806390294303
Energy: 1.2347982758809875
Energy: 1.2715209754782701
Energy: 1.2347982758816278
Energy: 1.2715209754776298
Energy: 1.2347982758809875
Energy: 1.2715209754782701
Energy: 1.2665986023721736
Energy: 1.3034692371259797
Energy: 1.2665986023721736
Energy: 1.3034692371259797
Energy: 1.2665986023728142
Energy: 1.3034692371259797
Energy: 1.4145337544420504
Energy: 1.229920457763385
Energy: 1.4145337544420504
Energy: 1.229920457763385
Energy: 1.3347160207429154
Energy: 1.229920457763385
Energy: 1.2468887874535333
Energy: 1.2478747854939873
Energy: 1.2468887874535333
Energy: 1.2478747854939873
Energy: 1.2468887874535333
Energy: 1.2478747854939873
Energy: 1.1933108485000794
Energy: 1.4154808307002595
Energy: 1.1933108485000794
Energy: 1.4154808307009001
Energy: 1.1933108485000794
Energy: 1.4154808307009001
Energy: 1.2919289347957383
Energy: 1.2243692206985368
Energy: 1.291928934795098
Energy: 1.2243692206991772
Energy: 1.2919289347957383
Energy: 1.2243692206991772
Energy: 1.330123919362984
Energy: 1.2850820229246107
Energy: 1.330123919362984
Energy: 1.2850820229239703
Energy: 1.3301239193623433
Energy: 1.2850820229246107
Energy: 1.2680336277797686
Energy: 1.395260445991338
Energy: 1.2680336277797686
Energy: 1.3952604459919784
Energy: 1.2680336277797686
Energy: 1.3952604459919784
Energy: 1.2308807135830333
Energy: 1.2244698505748035
Energy: 1.230880713583674
Energy: 1.2244698505748035
Energy: 1.2308807135830333
Energy: 1.2244698505748035
Energy: 1.2915215653920664
Energy: 1.2325112021261384
Energy: 1.2915215653920664
Energy: 1.2325112021261384
Energy: 1.2915215653927068
Energy: 1.232511202126779
Energy: 1.1974313173901452
Energy: 1.2556458061293352
Energy: 1.1974313173901452
Energy: 1.2556458061299758
Energy: 1.1974313173901452
Energy: 1.2556458061293352
Energy: 1.2617522104718768
Energy: 1.2502868740382471
Energy: 1.2617522104725174
Energy: 1.2502868740395279
Energy: 1.2617522104725174
Energy: 1.2502868740388875
Energy: 1.2593555853472014
Energy: 1.2301234628419013
Energy: 1.2593555853472014
Energy: 1.230123462843182
Energy: 1.2593555853472014
Energy: 1.2301234628419013

minimum gb energy = 1.1933108485000794 eV
minimum distance =  2.27577325586003 Angstroms
sigma value = 101


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

Energy: 1.204034404449355
Energy: 1.308356734382244
Energy: 1.204034404449355
Energy: 1.308356734382244
Energy: 1.204034404449355
Energy: 1.3083567343828066
Energy: 1.4064180394302284
Energy: 1.1742242932311628
Energy: 1.4064180394302284
Energy: 1.1742242932317257
Energy: 1.406418039430791
Energy: 1.1742242932328517
Energy: 1.1648177535600817
Energy: 1.156889723511119
Energy: 1.1648177535600817
Energy: 1.156889723511119
Energy: 1.1648177535595186
Energy: 1.156889723511119
Energy: 1.1396951801479438
Energy: 1.4047122840285495
Energy: 1.1396951801479438
Energy: 1.4047122840279866
Energy: 1.1396951801479438
Energy: 1.4047122840285495
Energy: 1.1916007088433196
Energy: 1.2396350259553597
Energy: 1.1916007088427565
Energy: 1.2396350259559228
Energy: 1.1916007088427565
Energy: 1.2396350259547966
Energy: 1.2683046475967077
Energy: 1.1567129941654586
Energy: 1.268304647596196
Energy: 1.1567129941648955
Energy: 1.2683046475967077
Energy: 1.1567129941648955
Energy: 1.1742901193825144
Energy: 1.1876505515116513
Energy: 1.1742901193825144
Energy: 1.1876505471870062
Energy: 1.1742901193808253
Energy: 1.1876505467520186
Energy: 1.1400812291376357
Energy: 1.3876068894386349
Energy: 1.140081229138199
Energy: 1.3876068894386349
Energy: 1.1400812291376357
Energy: 1.3876068894386349
Energy: 1.267853978900475
Energy: 1.1578120813283
Energy: 1.267853978900475
Energy: 1.1578120813283
Energy: 1.2678539788999121
Energy: 1.1578120813283
Energy: 1.191082798703428
Energy: 1.1833968355190911
Energy: 1.191082798703428
Energy: 1.1833968355168392
Energy: 1.191082798703428
Energy: 1.183396835516276
Energy: 1.1372779335715617
Energy: 1.3135151366380586
Energy: 1.1372779335721246
Energy: 1.3135151366380586
Energy: 1.1372779335715617
Energy: 1.3135151366374958
Energy: 1.4078886569095241
Energy: 1.1740021674338488
Energy: 1.4078886569100872
Energy: 1.1740021674344117
Energy: 1.4078886569117763
Energy: 1.1740021674349748
Energy: 1.2402695670299275
Energy: 1.1565518746073915
Energy: 1.2402695670299275
Energy: 1.1565518746073915
Energy: 1.2402695670299275
Energy: 1.1565518746073915
Energy: 1.2034686574428148
Energy: 1.4630591755555928
Energy: 1.203468657442252
Energy: 1.3793219334133977
Energy: 1.2034686574428148
Energy: 1.379321933414524
Energy: 1.267598552914066
Energy: 1.175801768588926
Energy: 1.267598552914066
Energy: 1.175801768590052
Energy: 1.267598552914066
Energy: 1.175801768588926
Energy: 1.2708573426732004
Energy: 1.1758231216316033
Energy: 1.2708573426737635
Energy: 1.1758231216310915
Energy: 1.2708573426726375
Energy: 1.1758231216316033
Energy: 1.13255480191545
Energy: 1.4071096427837733
Energy: 1.1325548019148872
Energy: 1.4071096427843361
Energy: 1.1325548019160132
Energy: 1.4071096427843361
Energy: 1.1326976365682506
Energy: 1.28984636619357
Energy: 1.1326976365688135
Energy: 1.2898463661952588
Energy: 1.1326976365682506
Energy: 1.289846366194696
Energy: 1.2665787653841662
Energy: 1.157571280823683
Energy: 1.2665787653836034
Energy: 1.157571280823683
Energy: 1.2665787653836034
Energy: 1.157571280823683
Energy: 1.216438224939166
Energy: 1.2278871217999239
Energy: 1.216438224939166
Energy: 1.2278871217971088
Energy: 1.216438224939166
Energy: 1.2278871217993608
Energy: 1.158526036814277
Energy: 1.3212936598091598
Energy: 1.158526036813151
Energy: 1.321293659809723
Energy: 1.158526036813714
Energy: 1.321293659809723
Energy: 1.50907881702948
Energy: 1.1560860570820515
Energy: 1.50907881702948
Energy: 1.1560860570820515
Energy: 1.5090788170289169
Energy: 1.1560860570820515
Energy: 1.2460451513043584
Energy: 1.1505439383622462
Energy: 1.2460451513043584
Energy: 1.1505439383628093
Energy: 1.2460451513037956
Energy: 1.1505439383628093
Energy: 1.1398479580450485
Energy: 1.2540906850855957
Energy: 1.1398479580450485
Energy: 1.2540906850855957
Energy: 1.1398479580444856
Energy: 1.2540906850855957
Energy: 1.2830437826040888
Energy: 1.1763035125912422
Energy: 1.2830437826040888
Energy: 1.1763035125912422
Energy: 1.2830437826029628
Energy: 1.1763035125906791
Energy: 1.23872649625331
Energy: 1.1792662720671445
Energy: 1.23872649625331
Energy: 1.1792662720671445
Energy: 1.2387264962538729
Energy: 1.1792662720671445
Energy: 1.2036143292090886
Energy: 1.3535260825988522
Energy: 1.2036143292085257
Energy: 1.3535260825988522
Energy: 1.2036143292090886
Energy: 1.353526082599415
Energy: 1.2043747100239977
Energy: 1.2615101090752368
Energy: 1.2043747100239977
Energy: 1.2615101090752368
Energy: 1.2043747100239977
Energy: 1.2615101090752368
Energy: 1.254319320002872
Energy: 1.1737693766777118
Energy: 1.2543193200034348
Energy: 1.1737693766777118
Energy: 1.2543193200034348
Energy: 1.1737693766771489
Energy: 1.1331094846615697
Energy: 1.1828361802524292
Energy: 1.1331094846615697
Energy: 1.1828361802462362
Energy: 1.1331094846621326
Energy: 1.182836180247925
Energy: 1.1328091588745315
Energy: 1.1950726080346945
Energy: 1.1328091588745315
Energy: 1.1950726080341316
Energy: 1.1328091588739682
Energy: 1.1950726080341316
Energy: 1.368770065048498
Energy: 1.156263918117943
Energy: 1.368770065048498
Energy: 1.1562639181185062
Energy: 1.368770065048498
Energy: 1.1562639181185062
Energy: 1.2719583039652782
Energy: 1.150185728790898
Energy: 1.2719583039647153
Energy: 1.150185728790898
Energy: 1.2719583039658413
Energy: 1.150185728790898

minimum gb energy = 1.1325548019148872 eV
minimum distance =  2.30850052164188 Angstroms
sigma value = 33


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

Energy: 0.02053626559574785
Energy: 0.9538654676793409
Energy: 0.02053626559574785
Energy: 0.9538654676793409
Energy: 0.02053626559574785
Energy: 0.9538654676793409
Energy: 0.021305662119318038
Energy: 0.4282186826190402
Energy: 0.021305662119318038
Energy: 0.4282186826190402
Energy: 0.021305662119318038
Energy: 0.42821868261857243
Energy: 0.9546771839570386
Energy: 0.42845957787037026
Energy: 0.954677183956103
Energy: 0.42845957787037026
Energy: 0.9546771839570386
Energy: 0.42845957787037026
Energy: 0.021305662118434463
Energy: 0.4282186826190402
Energy: 0.021305662118850262
Energy: 0.42821868261950796
Energy: 0.021305662118850262
Energy: 0.4282186826190402

minimum gb energy = 0.02053626559574785 eV
minimum distance =  2.48058605290114 Angstroms
sigma value = 1