Model name: model_name=MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_001
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=3.5213917419314393
cohesive_energy=4.450350014970536
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.46424379369004e-19, 3.2431099207764596e-19, 3.8238669070687797e-19, 4.2934809002605197e-19, 4.68817711404642e-19, 5.02724575509984e-19, 5.322430778147999e-19, 5.58159887046384e-19, 5.810293563201e-19, 6.01261642854252e-19, 6.1917237544573795e-19, 6.35011493649462e-19, 6.48982473897942e-19, 6.612487382078459e-19, 6.719496759463319e-19, 6.81202246007682e-19, 6.89110589873106e-19, 6.95759622904206e-19, 7.012278517560479e-19, 7.055809656706259e-19, 7.088798473600319e-19, 7.11180573006456e-19, 7.1252800355565e-19, 7.1296860213e-19, 7.12492755669702e-19, 7.109514617477939e-19, 7.081444482850259e-19, 7.038361953161999e-19, 6.977431175770979e-19, 6.895223492680439e-19, 6.787573244641979e-19, 6.64941755349216e-19, 6.474539973891059e-19, 6.2552981232945e-19, 5.982159050730179e-19, 5.6432346055738195e-19, 5.223480349232159e-19, 4.70376629269524e-19, 4.0594830028648193e-19, 3.2586510341262596e-19, 2.25913314100536e-19, 1.0047233650047659e-19, -5.806480382812079e-20, -2.60190281008332e-19, -5.206417168080059e-19, -8.605915550101259e-19, -1.3112662182113519e-18, -1.9200965434846197e-18, -2.76173595109116e-18, -3.95894641908132e-18, -5.724208612656179e-18, -8.450680656032999e-18, -1.2930478677061378e-17, -2.09550284137494e-17]
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: 0.01808958673139689
Energy: 0.018926218613925263
Energy: 0.01894716513928454
Energy: 0.018368363680730616
Energy: 0.7793767647150357
Energy: 0.018655555152929316
Energy: 0.018926218613594756
Energy: 0.13803848033605612
Energy: 0.13804913127070853
Energy: 0.1381222288395889
Energy: 0.13808006882732346
Energy: 0.1392752557458808
Energy: 0.01894716513928454
Energy: 0.13804913127070853
Energy: 0.13928063163631466
Energy: 0.018888186179475994
Energy: 0.13806084137008082
Energy: 0.13881156926512037
Energy: 0.018368363681061116
Energy: 0.1381222288395889
Energy: 0.018888186179145488
Energy: 0.018398304950699943
Energy: 0.13808002119586393
Energy: 0.018566951559547334
Energy: 0.7793767647124283
Energy: 0.13808006882732346
Energy: 0.1380608413694565
Energy: 0.13808002119681875
Energy: 0.1379432647728584
Energy: 0.13812910419645205
Energy: 0.018655555152929316
Energy: 0.1392752557455503
Energy: 0.13881156926482655
Energy: 0.018566951559216834
Energy: 0.13812910419579105
Energy: 0.018476492603152928

minimum gb energy = 0.01808958673139689 eV
minimum distance =  2.48754419986841 Angstroms
sigma value = 1


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

Energy: 1.9427123075129404
Energy: 1.2537328279065156
Energy: 1.268043501442042
Energy: 1.155009084581665
Energy: 1.3620357682459325
Energy: 1.307537621846769
Energy: 1.921552305699149
Energy: 1.3200716840218505
Energy: 1.2775173203338168
Energy: 1.246504106039831
Energy: 1.3054959020121895
Energy: 1.266801055012337
Energy: 2.0094528160738245
Energy: 1.3192443284639903
Energy: 1.3089974611610655
Energy: 1.2712975378714544
Energy: 1.3006976104440493
Energy: 1.3090044469427495
Energy: 2.03638951306515
Energy: 1.299279826405768
Energy: 1.2388072255834701
Energy: 1.2307055425510771
Energy: 1.3001234600751947
Energy: 1.230685601977757
Energy: 1.832271775463147
Energy: 1.264489021712544
Energy: 1.26430999993967
Energy: 1.2652374972788576
Energy: 1.2546130003144664
Energy: 1.2711770769154451
Energy: 1.8177736719043158
Energy: 1.25648282120106
Energy: 1.2612334060728
Energy: 1.2648197775999548
Energy: 1.2542884450873921
Energy: 1.2607377247122642
Energy: 1.8195290367251618
Energy: 1.2616878982327924
Energy: 1.2476901027167628
Energy: 1.245322568629248
Energy: 1.2869754722168045
Energy: 1.2656297357221382
Energy: 1.7951145897187069
Energy: 1.2708068967744979
Energy: 1.2621244379232297
Energy: 1.2337255226112984
Energy: 1.27102208995221
Energy: 1.2666757045426014
Energy: 1.4518179542169631
Energy: 1.2736525689171354
Energy: 1.2529878463135495
Energy: 1.2531042072288991
Energy: 1.2602608353037517
Energy: 1.2566201266475772
Energy: 1.4514698976643319
Energy: 1.2798149697612469
Energy: 1.2768270614707953
Energy: 1.252527184131868
Energy: 1.2798315732248868
Energy: 1.2748978796436607
Energy: 1.505144933775678
Energy: 1.2397922323655846
Energy: 1.2300050644766678
Energy: 1.3355145773443788
Energy: 1.247899812141766
Energy: 1.292748618641333
Energy: 1.3059238195542495
Energy: 1.3098479717720466
Energy: 1.3096620032120583
Energy: 1.298978222742845
Energy: 1.2638448722427968
Energy: 1.3115474104628608
Energy: 1.304938278720818
Energy: 1.2635084131972063
Energy: 1.2624727822148194
Energy: 1.305373294834509
Energy: 1.2682054992518357
Energy: 1.2934831961763957
Energy: 1.4544013258876627
Energy: 1.2674949112004776
Energy: 1.242942636726952
Energy: 1.3055233357646117
Energy: 1.267519315783571
Energy: 1.2979937697464456
Energy: 1.3513493302397819
Energy: 1.2592110664465355
Energy: 1.2628473352481233
Energy: 1.288641728464743
Energy: 1.2598826695257643
Energy: 1.2729106102351089
Energy: 1.3454061545794687
Energy: 1.3107565997919095
Energy: 1.3048723646989746
Energy: 1.2845195696499856
Energy: 1.2809533304931215
Energy: 1.3053768867454736
Energy: 1.6176974804858169
Energy: 1.2587662677469194
Energy: 1.2582475067197607
Energy: 1.3049269455227397
Energy: 1.2576695516630136
Energy: 1.2498274016036053
Energy: 1.6138143353263055
Energy: 1.2744137971243934
Energy: 1.2565257524515678
Energy: 1.2589497940059053
Energy: 1.2751531826657097
Energy: 1.2555162287584898
Energy: 1.6186608931236215
Energy: 1.2599703273445477
Energy: 1.262538699951861
Energy: 1.2453701382063596
Energy: 1.259797841561504
Energy: 1.2612939107950227
Energy: 1.7064804366522321
Energy: 1.2529538287044852
Energy: 1.2661844843378716
Energy: 1.2554706012897083
Energy: 1.2511496395631712
Energy: 1.2612970662648773
Energy: 1.920152615746439
Energy: 1.263194594387844
Energy: 1.2822584640207029
Energy: 1.2477139882174548
Energy: 1.2454446622020368
Energy: 1.2469694504823252
Energy: 1.9257019352014082
Energy: 1.2988347611733073
Energy: 1.3052462021073121
Energy: 1.266692395106002
Energy: 1.2834658759243847
Energy: 1.3054285871983238
Energy: 1.9224402048044922
Energy: 1.3205123824649925
Energy: 1.2768634531061012
Energy: 1.2443121030846647
Energy: 1.2980285082449932
Energy: 1.267014636991654

minimum gb energy = 1.155009084581665 eV
minimum distance =  2.28878706456245 Angstroms
sigma value = 33


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

Energy: 2.7884683539363384
Energy: 1.437272465537325
Energy: 1.4467523544459349
Energy: 1.2761061158414888
Energy: 1.3572304625289269
Energy: 1.3689205751946163
Energy: 1.8084632223095833
Energy: 1.340005733465584
Energy: 1.3815890666150261
Energy: 1.3588687740220367
Energy: 1.3409544187464044
Energy: 1.3819761628264915
Energy: 2.060192284520403
Energy: 1.3608789000572246
Energy: 1.3624625724133257
Energy: 1.3878528756682895
Energy: 1.3514628173935908
Energy: 1.3357493445942172
Energy: 2.0217133865682664
Energy: 1.4192125991597935
Energy: 1.3986011990750844
Energy: 1.2974063076603222
Energy: 1.4558588887292163
Energy: 1.3045644715733518
Energy: 1.8926302455585648
Energy: 1.4289786029996914
Energy: 1.4318085662562174
Energy: 1.3352456103155352
Energy: 1.3919453313573418
Energy: 1.4363824612297635
Energy: 1.9290868442968947
Energy: 1.3800514178766594
Energy: 1.3959412840185073
Energy: 1.3456790397824945
Energy: 1.3838093655301174
Energy: 1.3812686318014367
Energy: 1.9290143357658356
Energy: 1.38311580414704
Energy: 1.380393460492901
Energy: 1.3644553865983826
Energy: 1.3825956998029405
Energy: 1.3810147089388418
Energy: 1.7310114598435347
Energy: 1.3415188927076047
Energy: 1.3343908764198302
Energy: 1.4420690475825095
Energy: 1.3408310674749928
Energy: 1.3454897364524234
Energy: 1.5559638517627936
Energy: 1.3573069024688336
Energy: 1.360279265020728
Energy: 1.3737550638768785
Energy: 1.3569298064438386
Energy: 1.3676397264563973
Energy: 1.5256390674942697
Energy: 1.3899304108994268
Energy: 1.3899363447542916
Energy: 1.3671029641610557
Energy: 1.3881621354665645
Energy: 1.3516507932140776
Energy: 1.533485740303209
Energy: 1.3073122171871925
Energy: 1.365326387622826
Energy: 1.5160712961779725
Energy: 1.3071409302469998
Energy: 1.3396388926605314
Energy: 1.3970324131210854
Energy: 1.3892650418482348
Energy: 1.3896377532139377
Energy: 1.3615728662381958
Energy: 1.3933101526384712
Energy: 1.3900647826971733
Energy: 1.407994952636908
Energy: 1.3644135252691356
Energy: 1.3599431291668216
Energy: 1.3855857905327094
Energy: 1.3646484219100639
Energy: 1.3977223837689643
Energy: 1.6323917038202065
Energy: 1.3417173796534565
Energy: 1.341489059784178
Energy: 1.3926508942166964
Energy: 1.3193647533551034
Energy: 1.397620880897506
Energy: 1.5522237759201307
Energy: 1.3601866430470646
Energy: 1.4032536812067777
Energy: 1.4254114589679252
Energy: 1.384482523263089
Energy: 1.408182668977619
Energy: 1.5391335229292165
Energy: 1.4068818315555927
Energy: 1.4403114131912158
Energy: 1.3785419293352625
Energy: 1.3728057700422764
Energy: 1.438443906334411
Energy: 1.732221163717617
Energy: 1.3567105428839406
Energy: 1.4205648054747775
Energy: 1.4622794042357201
Energy: 1.356970635494424
Energy: 1.42017901663688
Energy: 1.7555029494419618
Energy: 1.3949278113428814
Energy: 1.4063465828240167
Energy: 1.3427601598412426
Energy: 1.4395536271249019
Energy: 1.3433857059068837
Energy: 1.7566871483205226
Energy: 1.3996782498108804
Energy: 1.4058601951818563
Energy: 1.331420747636397
Energy: 1.400481765269118
Energy: 1.3690792489300057
Energy: 1.874313137576586
Energy: 1.3999193367794225
Energy: 1.401517433602894
Energy: 1.4245693270666064
Energy: 1.398474324530327
Energy: 1.4056757507189301
Energy: 1.9671271814432316
Energy: 1.416684263899735
Energy: 1.2912492310340415
Energy: 1.2746347446080213
Energy: 1.402784303025122
Energy: 1.2923837297823817
Energy: 1.9785369545005262
Energy: 1.401035321842359
Energy: 1.4258452573253535
Energy: 1.3384823382072557
Energy: 1.4017455577769284
Energy: 1.4338178589645965
Energy: 1.8673189203684608
Energy: 1.4102947245163306
Energy: 1.4342430583967887
Energy: 1.3801884810878642
Energy: 1.4102176039024228
Energy: 1.405429418388608
Energy: 2.2635684343052778
Energy: 1.5106887965620825
Energy: 1.5107735006752345
Energy: 1.3464151168398846
Energy: 1.5346081769225777
Energy: 1.3359672318118707
Energy: 1.8643296428027865
Energy: 1.4272244711718176
Energy: 1.434224360599798
Energy: 1.442842407157636
Energy: 1.4271013892297297
Energy: 1.4448194318216556
Energy: 1.9315423346527572
Energy: 1.3768013108417896
Energy: 1.3991722086770744
Energy: 1.4199653860736863
Energy: 1.3793834956207058
Energy: 1.3948560626556503
Energy: 1.9295339885896095
Energy: 1.3735422862834776
Energy: 1.3787800511352055
Energy: 1.36460187177286
Energy: 1.3623191524895137
Energy: 1.3398208742150195
Energy: 1.7276839544447964
Energy: 1.3343570745725575
Energy: 1.3349830916436218
Energy: 1.3884994326128204
Energy: 1.3305824958871566
Energy: 1.3747420151200784
Energy: 1.5513990523085324
Energy: 1.3333413010444246
Energy: 1.3431236639232897
Energy: 1.3723444430349618
Energy: 1.3337207612016597
Energy: 1.3715600103875651
Energy: 1.5264415544456595
Energy: 1.3509734757938237
Energy: 1.3583211839641478
Energy: 1.3654577896804472
Energy: 1.3519430868662448
Energy: 1.3558334999379038
Energy: 1.6587648752134494
Energy: 1.3071923325752288
Energy: 1.3075958912941654
Energy: 1.3514736029455423
Energy: 1.3039783113232952
Energy: 1.3068571648178997
Energy: 1.3971878269119333
Energy: 1.3682525663328244
Energy: 1.3893710756209687
Energy: 1.3597435069675365
Energy: 1.3906021231496044
Energy: 1.3892991983094982
Energy: 1.4080532332833
Energy: 1.3666248605575957
Energy: 1.366935278725155
Energy: 1.378490850102595
Energy: 1.3496723883986879
Energy: 1.3949051446068648
Energy: 1.443389271453814
Energy: 1.3038343875179703
Energy: 1.3458660125863582
Energy: 1.3929268926632576
Energy: 1.3446145387824948
Energy: 1.3576826077735806
Energy: 1.5636313013244056
Energy: 1.3441177036607028
Energy: 1.3700591090325358
Energy: 1.3935988508464323
Energy: 1.3433927530987348
Energy: 1.4061511180776316
Energy: 1.5376675653495322
Energy: 1.3897721896238606
Energy: 1.4289121213481397
Energy: 1.4253895440553668
Energy: 1.421124094133525
Energy: 1.4452839580700954
Energy: 1.5343838488620505
Energy: 1.3488577558342891
Energy: 1.3158579406847415
Energy: 1.3242163800097222
Energy: 1.2564964084675294
Energy: 1.43332758409216
Energy: 1.757627714711043
Energy: 1.444865608050649
Energy: 1.362428595205354
Energy: 1.358131017295499
Energy: 1.4440536549076386
Energy: 1.4469242647612912
Energy: 1.7557209067618353
Energy: 1.3529472887754268
Energy: 1.3155633397025186
Energy: 1.3333965332480628
Energy: 1.3332094948746716
Energy: 1.3225814825830222
Energy: 1.9262434656992373
Energy: 1.34546869518618
Energy: 1.3433232126930312
Energy: 1.335712976500655
Energy: 1.3465777670550063
Energy: 1.3543934593963158
Energy: 1.95525722480558
Energy: 1.3564080103886218
Energy: 1.3259169169203076
Energy: 1.2747958702525088
Energy: 1.3565928440609687
Energy: 1.3747824494108094

minimum gb energy = 1.2564964084675294 eV
minimum distance =  2.21329032470034 Angstroms
sigma value = 51


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

Energy: 2.230121648081438
Energy: 1.4610941266533177
Energy: 1.3561747833764692
Energy: 1.3211310158043692
Energy: 1.315684366340817
Energy: 1.2817189845800743
Energy: 1.8829598009327548
Energy: 1.3152920564841775
Energy: 1.3217473214607862
Energy: 1.2899460838257812
Energy: 1.3152418429863126
Energy: 1.378448887186509
Energy: 1.8593292241056765
Energy: 1.3117998248521536
Energy: 1.3488009467300055
Energy: 1.3657432567435979
Energy: 1.3126788744492248
Energy: 1.3228036691222964
Energy: 1.8594736794763165
Energy: 1.3279236236161553
Energy: 1.327920159096325
Energy: 1.3052021629820791
Energy: 1.3136413706594139
Energy: 1.304209296167035
Energy: 1.7000171591299753
Energy: 1.3290314386726587
Energy: 1.3381245580769419
Energy: 1.2789504361385249
Energy: 1.3287136952607592
Energy: 1.334723673904001
Energy: 1.5615236340209744
Energy: 1.3139055532387685
Energy: 1.3104638228148686
Energy: 1.3440161794902388
Energy: 1.3118101844617955
Energy: 1.3172201806805792
Energy: 1.5616991536941607
Energy: 1.305823455008784
Energy: 1.3165282936210874
Energy: 1.3438817761111208
Energy: 1.3920678559753987
Energy: 1.3168591591226602
Energy: 1.6809237582553982
Energy: 1.214978500598963
Energy: 1.214397154051567
Energy: 1.3130461824547943
Energy: 1.215298023372564
Energy: 1.2146892530297744
Energy: 1.3142684488692282
Energy: 1.3753606545225197
Energy: 1.3266355818003566
Energy: 1.3143682452986436
Energy: 1.3750585359956624
Energy: 1.2819543420493333
Energy: 1.3158771454230638
Energy: 1.281988843977979
Energy: 1.3485332458779098
Energy: 1.3159060834165552
Energy: 1.2827174333917877
Energy: 1.348296064665499
Energy: 1.3155881342279814
Energy: 1.280944915581234
Energy: 1.2807909592275268
Energy: 1.3156520415072697
Energy: 1.2813249820439085
Energy: 1.4674123140646325
Energy: 1.3721192294323774
Energy: 1.2807589499749956
Energy: 1.3484872278372115
Energy: 1.3147250740770313
Energy: 1.330044218595373
Energy: 1.3480094216901373
Energy: 1.3693886993170363
Energy: 1.287434810318461
Energy: 1.2889498122226384
Energy: 1.3116852350672323
Energy: 1.3563073694196963
Energy: 1.295066101548572
Energy: 1.3717182409102555
Energy: 1.2713007688984
Energy: 1.305618945733448
Energy: 1.3133472775687856
Energy: 1.271159122820869
Energy: 1.270347965310411
Energy: 1.6751830997932569
Energy: 1.391817581258552
Energy: 1.3495660885504224
Energy: 1.3335443617032656
Energy: 1.4389842375680009
Energy: 1.3433684883262007
Energy: 1.6752968108331925
Energy: 1.3091343384106326
Energy: 1.3143488784234825
Energy: 1.370660925653264
Energy: 1.3091466738419484
Energy: 1.3718340062846914
Energy: 1.9467602016431034
Energy: 1.3104758142751347
Energy: 1.3096005551371188
Energy: 1.344947004455614
Energy: 1.3113448670986334
Energy: 1.3748963593734476
Energy: 2.0384971049640033
Energy: 1.325830502725596
Energy: 1.3332308286343444
Energy: 1.2124651268680957
Energy: 1.325656424784508
Energy: 1.3436346682865163

minimum gb energy = 1.2124651268680957 eV
minimum distance =  2.29538452351942 Angstroms
sigma value = 19


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

Energy: 1.8361214418714007
Energy: 1.214044795955671
Energy: 1.399230491066335
Energy: 1.4010486764195174
Energy: 1.1596309238251683
Energy: 1.4013183505534845
Energy: 1.8766380167046748
Energy: 1.1813702976923204
Energy: 1.1811025658171785
Energy: 1.2924130976439048
Energy: 1.1812095874762922
Energy: 1.1811255357744557
Energy: 1.8990764973492225
Energy: 1.1813070525881064
Energy: 1.181319128634141
Energy: 1.4036680150856156
Energy: 1.1812337745053216
Energy: 1.3026404272394738
Energy: 1.4946869058575043
Energy: 1.1809817127630655
Energy: 1.1810524472193276
Energy: 1.2006370346728383
Energy: 1.180868778496054
Energy: 1.1813820456832846
Energy: 1.4769953156249092
Energy: 1.3030846281694324
Energy: 1.30246880249916
Energy: 1.2947079485359845
Energy: 1.3022683448187966
Energy: 1.3025924919274392
Energy: 1.4784783615198416
Energy: 1.1492847553698935
Energy: 1.2216025231324017
Energy: 1.2897341733575125
Energy: 1.1491581227786094
Energy: 1.2070496823669352
Energy: 1.4775153778092995
Energy: 1.2949772770018617
Energy: 1.2943512556735337
Energy: 1.2899862216256741
Energy: 1.2935294907912125
Energy: 1.222974041729576
Energy: 1.3332141416409993
Energy: 1.1108600163313032
Energy: 1.10726949154714
Energy: 1.3324020379346657
Energy: 1.1095151579382796
Energy: 1.1066566893356249
Energy: 1.181015456258601
Energy: 1.2671784540721829
Energy: 1.279976188641806
Energy: 1.1811631617952685
Energy: 1.1067282344840443
Energy: 1.279956851809867
Energy: 1.1810027096342801
Energy: 1.4033592915639048
Energy: 1.3025713109269346
Energy: 1.1812097946995999
Energy: 1.4034695892477052
Energy: 1.181224293305422
Energy: 1.1808249877316126
Energy: 1.2006980382626002
Energy: 1.2008805376563036
Energy: 1.1807944112731028
Energy: 1.2025549295074591
Energy: 1.1812049053427771
Energy: 1.5814604905326364
Energy: 1.4032475769067807
Energy: 1.302364030234406
Energy: 1.3017660794674406
Energy: 1.403433321058406
Energy: 1.3024942608972878
Energy: 1.1488854060498708
Energy: 1.2072429278042673
Energy: 1.2235407518210402
Energy: 1.1493561952785893
Energy: 1.289557895157556
Energy: 1.2230579160152544
Energy: 1.5817210921997806
Energy: 1.2881120000824322
Energy: 1.2894561796535522
Energy: 1.3021018327504763
Energy: 1.2899024610060958
Energy: 1.390052019216173
Energy: 1.7908202232720043
Energy: 1.3023424038350715
Energy: 1.3022249747204964
Energy: 1.1070973545205283
Energy: 1.302097268015987
Energy: 1.2798535285193477
Energy: 1.7907132033820796
Energy: 1.1816687969970459
Energy: 1.1494982824096702
Energy: 1.1088293069014419
Energy: 1.182096549462793
Energy: 1.1068137530205466
Energy: 1.4772648586743318
Energy: 1.1812144623793286
Energy: 1.181077453075946
Energy: 1.4042427211180857
Energy: 1.1811305718115925
Energy: 1.3033782611734162
Energy: 1.4735086457644357
Energy: 1.18122937526577
Energy: 1.1813431165709407
Energy: 1.202184740798408
Energy: 1.1808935522157828
Energy: 1.1812434338406563
Energy: 1.4718992820475227
Energy: 1.302486840889456
Energy: 1.3026315866944695
Energy: 1.2018357452473543
Energy: 1.1813087832714937
Energy: 1.3026679398306247
Energy: 1.4776045325358702
Energy: 1.1492680714100925
Energy: 1.2218196353011397
Energy: 1.2073101376136417
Energy: 1.149184960171409
Energy: 1.2217802103598514
Energy: 1.4752770889808327
Energy: 1.303937061742756
Energy: 1.3950055151065859
Energy: 1.2897443481016577
Energy: 1.3022743943397193
Energy: 1.294795091972819
Energy: 1.4775083263348225
Energy: 1.4034727803317544
Energy: 1.4030184427655774
Energy: 1.3016564805073947
Energy: 1.4036836473212926
Energy: 1.302174298307857
Energy: 1.1598065067738537
Energy: 1.1065165672073878
Energy: 1.1965244046333159
Energy: 1.1596817827682293
Energy: 1.1068439222372846
Energy: 1.4006175090771706
Energy: 1.1811600851892057
Energy: 1.2911393387904042
Energy: 1.3023243050646405
Energy: 1.1813872511795542
Energy: 1.2677832903792168
Energy: 1.1809873775935251
Energy: 1.1811458315882792
Energy: 1.4030954800279403
Energy: 1.3026532920610532
Energy: 1.181138878866688
Energy: 1.4036583635804916
Energy: 1.1811876608764387
Energy: 1.3333050690920105
Energy: 1.201484850910157
Energy: 1.2014254627885388
Energy: 1.1808349182808822
Energy: 1.201630890196079
Energy: 1.1810846730696387
Energy: 1.580144437876006
Energy: 1.4035042649298717
Energy: 1.3024148067949226
Energy: 1.3029549545281383
Energy: 1.2950691662290663
Energy: 1.3024217896164458
Energy: 1.1490955846691027
Energy: 1.2887191269937694
Energy: 1.2076732320848038
Energy: 1.149142513117874
Energy: 1.2896191508731265
Energy: 1.2211595756750961
Energy: 1.5813825100569958
Energy: 1.2897877348947717
Energy: 1.2070543619305971
Energy: 1.2940528877050885
Energy: 1.290079837617415
Energy: 1.294480118418766
Energy: 1.790498019472749
Energy: 1.3017232505960286
Energy: 1.1325216353970926
Energy: 1.1105653998520717
Energy: 1.1815219723757784
Energy: 1.1072803505637407

minimum gb energy = 1.1065165672073878 eV
minimum distance =  2.378586638025 Angstroms
sigma value = 27


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

Energy: 1.5305690690535625
Energy: 1.4226957794799349
Energy: 1.4231676230734605
Energy: 1.298195887139469
Energy: 1.2303061543125728
Energy: 1.408576530417059
Energy: 1.270589500927868
Energy: 1.2198403852733897
Energy: 1.219613453388647
Energy: 1.1731740538287774
Energy: 1.2198798997832185
Energy: 1.2303653097920217
Energy: 1.3362682848487435
Energy: 1.2194791754174683
Energy: 1.219589653695799
Energy: 1.1488265953167696
Energy: 1.220669427076326
Energy: 1.2199347777865062
Energy: 1.3389322688311764
Energy: 1.2198102396377455
Energy: 1.2200622370508727
Energy: 1.158889369725289
Energy: 1.219950769519977
Energy: 1.0660997651615982
Energy: 1.4408970793351212
Energy: 1.0442584978526466
Energy: 1.0678945968512874
Energy: 1.2555313253442584
Energy: 1.0451061834210267
Energy: 1.0677196571002996
Energy: 1.2223729987948766
Energy: 1.293118646254404
Energy: 1.0444718738891074
Energy: 1.2219432450398617
Energy: 1.2868810390283183
Energy: 1.0444478117957796
Energy: 1.221131399628134
Energy: 1.1060984508742397
Energy: 1.1092847063039226
Energy: 1.2204008278190528
Energy: 1.1732086905534957
Energy: 1.2193997926576818
Energy: 1.2883858059532074
Energy: 1.0620829132690106
Energy: 1.0616566277931028
Energy: 1.2209027014655884
Energy: 1.2168777009734164
Energy: 1.062408700089503
Energy: 1.3364673987429665
Energy: 1.0621814338609046
Energy: 1.106306164728907
Energy: 1.2268237999235652
Energy: 1.0646802805772417
Energy: 1.10553749625739
Energy: 1.1334105303346247
Energy: 1.1482174847891846
Energy: 1.1867091956122096
Energy: 1.2250726991044227
Energy: 1.147712650677218
Energy: 1.1476307524966698
Energy: 1.3366311430183357
Energy: 1.225683982201613
Energy: 1.2258013488368866
Energy: 1.2256713221421318
Energy: 1.2257946429748765
Energy: 1.1474484983337723
Energy: 1.270589513788652
Energy: 1.2271524287824551
Energy: 1.2268083437109305
Energy: 1.1728387992403395
Energy: 1.226966710264444
Energy: 1.2278958644501214

minimum gb energy = 1.0442584978526466 eV
minimum distance =  2.28705456030296 Angstroms
sigma value = 9


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

Energy: 2.3913829804685873
Energy: 1.2531293899499538
Energy: 1.1906361899130824
Energy: 1.1098004157129944
Energy: 1.066789486264059
Energy: 1.4038323598356206
Energy: 1.4671999636649284
Energy: 1.0680249900827594
Energy: 1.0672436904533513
Energy: 1.112743094676104
Energy: 1.0680296391939197
Energy: 1.038389637897698
Energy: 1.1304422101227665
Energy: 1.0706692552707142
Energy: 1.0707050144989623
Energy: 1.0585078678431123
Energy: 1.0774094999770705
Energy: 1.0794925144797871
Energy: 1.1309198318154179
Energy: 1.1269049404123765
Energy: 1.0001831539057215
Energy: 1.0563084184484826
Energy: 1.165361129410712
Energy: 1.11871971904158
Energy: 1.478035047502196
Energy: 1.0342658374518194
Energy: 1.0401079589190112
Energy: 1.1055724241310543
Energy: 1.0338918168357356
Energy: 1.0922889803323992
Energy: 1.1055437776119483
Energy: 1.0095685475851128
Energy: 1.0407026388621148
Energy: 1.105759177597221
Energy: 1.013014877329686
Energy: 1.0998168868293015
Energy: 1.0959330414822668
Energy: 1.0242231904836088
Energy: 1.1311737600714105
Energy: 1.0970366227074262
Energy: 1.0362898308602204
Energy: 1.0977146335455539
Energy: 1.1174688478925665
Energy: 1.057930404638249
Energy: 1.0935466761032633
Energy: 1.117665645220366
Energy: 1.0562146412801698
Energy: 1.1141854658113803
Energy: 1.5183900963563484
Energy: 1.06304036310823
Energy: 1.069945306476922
Energy: 1.0828146479873084
Energy: 1.0676558860114074
Energy: 1.1761195395303574
Energy: 1.013921874996347
Energy: 1.1146534264735712
Energy: 1.0680989461178796
Energy: 1.013134488712712
Energy: 1.1463483371503185
Energy: 1.1187891743425225
Energy: 1.0138741390277077
Energy: 1.1009245905016292
Energy: 1.1013812753329366
Energy: 1.0113682539942546
Energy: 1.1004240371906746
Energy: 1.093474786375932
Energy: 1.5080249483387969
Energy: 1.096681690543985
Energy: 1.0970296688575027
Energy: 1.0250047659280348
Energy: 1.0962444439772256
Energy: 1.115713291703906
Energy: 1.0979026973741945
Energy: 1.5948119478126583
Energy: 1.1462423183362052
Energy: 1.06163951033743
Energy: 1.5958782873810111
Energy: 1.2456824225720637
Energy: 1.507467690482326
Energy: 1.1076637063447996
Energy: 1.1631289813750216
Energy: 1.0253909130709298
Energy: 1.1101650185306524
Energy: 1.0898136790158666
Energy: 1.0700842250351765
Energy: 1.1182880048415833
Energy: 1.1210522506976341
Energy: 1.070052157080321
Energy: 1.1188568239263872
Energy: 1.131830432946361
Energy: 1.0739805444157713
Energy: 1.0229142576254675
Energy: 1.052311799587179
Energy: 1.0698487013676363
Energy: 1.0591297017899135
Energy: 1.068599905945879
Energy: 1.0674088977530356
Energy: 1.0222022389082108
Energy: 1.0229387980024187
Energy: 1.067421058995061
Energy: 1.0224767551164045
Energy: 1.0496951019211596
Energy: 1.2489213021824712
Energy: 1.0452839755856496
Energy: 1.1119999584691889
Energy: 1.069204722918708
Energy: 1.0962225241414787
Energy: 1.1060241783015423
Energy: 1.1335837669496192
Energy: 1.0633468879383237
Energy: 1.0553470904877962
Energy: 1.0679183410481028
Energy: 1.0711613256587875
Energy: 1.0546615923034
Energy: 1.1290945789636657
Energy: 1.062228268535433
Energy: 1.0363792558744978
Energy: 1.0588294837982901
Energy: 1.0593089747279234
Energy: 0.9940191611167145
Energy: 1.1296060834461095
Energy: 1.0745892292660917
Energy: 1.0747524059542546
Energy: 1.0598986752443555
Energy: 1.0752814824424848
Energy: 1.0593674332142258
Energy: 1.4197953828264154
Energy: 1.1336704377684772
Energy: 1.1068965571193516
Energy: 1.036431015085807
Energy: 1.0674323224869364
Energy: 1.1099103522289397
Energy: 1.1829471559361286
Energy: 1.0676002853010842
Energy: 1.0680916772705689
Energy: 1.038726368844113
Energy: 1.0673854680433197
Energy: 1.0026446189452942
Energy: 1.1319415702849773
Energy: 1.0687728064295883
Energy: 1.0707664593509634
Energy: 1.0586517016720363
Energy: 1.068741642767457
Energy: 1.077307451102306
Energy: 1.5208374477339155
Energy: 1.0951057561331754
Energy: 1.0716772120152096
Energy: 1.0721793105476312
Energy: 1.2374503783677915
Energy: 1.1414022136410167
Energy: 1.3729666979012143
Energy: 1.0243182920865905
Energy: 1.0233862403805518
Energy: 1.0589493981390468
Energy: 1.024446737572905
Energy: 1.1079432032105725
Energy: 1.0667879436746501
Energy: 1.0091667203730958
Energy: 1.0977516611305174
Energy: 1.0675826405995161
Energy: 1.0092013287855108
Energy: 1.245625088099013
Energy: 1.1073737454422967
Energy: 1.0247172422897461
Energy: 1.0241298232617089
Energy: 1.0955782718083156
Energy: 1.024571138358204
Energy: 1.096510554283834
Energy: 1.1135858435364936
Energy: 1.0239349578162058
Energy: 1.0959483380181247
Energy: 1.1136843615822878
Energy: 1.0248908978702134
Energy: 1.1119324084482034
Energy: 1.462098737511254
Energy: 1.0586651439589052
Energy: 1.0289388143043283
Energy: 1.4633028654714295
Energy: 1.0562308857424005
Energy: 1.1231274538942895
Energy: 1.0140598671470442
Energy: 1.1135982551668113
Energy: 1.158166475363095
Energy: 1.0095979299776672
Energy: 1.0779088303723503
Energy: 1.1238234640031366
Energy: 1.7654532088935924
Energy: 1.1094544733759737
Energy: 1.1158826565047424
Energy: 1.013159684373648
Energy: 1.1141247213725625
Energy: 1.0831312603510892
Energy: 1.5051317998021307
Energy: 1.0963774837795257
Energy: 1.0961392600896909
Energy: 1.0369562551185463
Energy: 1.0983457893214397
Energy: 1.1323296241944678
Energy: 1.2247884411078658
Energy: 1.1060949949348728
Energy: 1.1015541079931344
Energy: 1.095279473642545
Energy: 1.1061062066319738
Energy: 1.0948999986024743
Energy: 1.1006113001954736
Energy: 1.1062724039402905
Energy: 1.153452611888843
Energy: 1.0269969876528
Energy: 1.0975957717847336
Energy: 1.0256807223554172
Energy: 1.2272732051879691
Energy: 1.0942868351680242
Energy: 1.116662460495885
Energy: 1.20610324490261
Energy: 1.0961185602742425
Energy: 1.1171554291072798
Energy: 1.0730903452306617
Energy: 1.058295062079518
Energy: 1.0484630844801972
Energy: 1.0747923645695632
Energy: 1.0584325978005382
Energy: 1.0682044301647766
Energy: 1.0675294722806705
Energy: 1.0639790166432816
Energy: 1.050602856415041
Energy: 1.0675180714500652
Energy: 1.0542762242789867
Energy: 1.068673202179624
Energy: 1.2329107068266603
Energy: 1.1630751772671466
Energy: 1.2351050076372576
Energy: 1.2803236117256065
Energy: 1.1603135540766707
Energy: 1.2414964319023933
Energy: 1.1295498493096592
Energy: 1.055917072427156
Energy: 1.0201118209471964
Energy: 1.0669983573440869
Energy: 1.0542648534406707
Energy: 1.0496351537585968
Energy: 1.1298566800702947
Energy: 1.0268136475714174
Energy: 1.0288582119114498
Energy: 1.0679461150363045
Energy: 1.059835936400306
Energy: 1.0607872933829314
Energy: 1.1318520512092611
Energy: 1.0616841833641903
Energy: 1.0601513978978236
Energy: 1.0678456549661866
Energy: 1.06096345650477
Energy: 1.0589209030958877
Energy: 1.4220092781042846
Energy: 1.0679456087490953
Energy: 1.0681807111419583
Energy: 1.0340069157284797
Energy: 1.067608556959402
Energy: 1.0036191907882108

minimum gb energy = 0.9940191611167145 eV
minimum distance =  2.31136420697325 Angstroms
sigma value = 57


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

Energy: 0.5416098033603104
Energy: 1.0691935210543724
Energy: 0.6661375137219749
Energy: 0.5457207657527098
Energy: 1.7424389755020737
Energy: 0.5423502792530354
Energy: 0.5424193921116484
Energy: 0.5610682258992642
Energy: 0.5621074835823101
Energy: 0.5963738884201775
Energy: 0.5609087549597467
Energy: 0.5918074264291046
Energy: 0.6594605884935342
Energy: 0.5983614333557362
Energy: 0.5984693681924681
Energy: 0.5974199820979124
Energy: 0.5981210181183422
Energy: 0.6158988876594838
Energy: 0.6594148150684911
Energy: 0.5984145565802547
Energy: 0.5981989611976675
Energy: 0.5973222317328971
Energy: 0.660055226159606
Energy: 0.6167245556004083
Energy: 0.6565450374912297
Energy: 0.5441850665660353
Energy: 0.5858502588035599
Energy: 0.5972478693439011
Energy: 0.5424646940042187
Energy: 0.5618197997339477
Energy: 0.5979743527347582
Energy: 0.5426937766115685
Energy: 0.5433386818924856
Energy: 0.5612379562570662
Energy: 0.542187665170495
Energy: 0.585298545136275
Energy: 0.5940827745346636
Energy: 0.5612900096698076
Energy: 0.5623276861399458
Energy: 0.5953270759260315
Energy: 0.5614557372383969
Energy: 0.6052353311643596
Energy: 0.5980595769001446
Energy: 0.5976681810357256
Energy: 0.6650670693011101
Energy: 0.598068800575569
Energy: 0.6577637717678816
Energy: 0.5981762848484837
Energy: 0.6561333446527022
Energy: 0.6271701050707206
Energy: 0.5627847563659103
Energy: 0.5978471692089973
Energy: 0.5973645756608971
Energy: 0.5987140000193766
Energy: 0.5421283865069556
Energy: 0.6569708667994162
Energy: 0.588486021875682
Energy: 0.5422192718620569
Energy: 0.5985532691303181
Energy: 0.5451123430954496
Energy: 0.542217950294076
Energy: 0.5611773200341297
Energy: 0.562001918909282
Energy: 0.5422842595137041
Energy: 0.5606930092418413
Energy: 0.5881594567399928
Energy: 0.6593289934244136
Energy: 0.5976497485333158
Energy: 0.617578583338363
Energy: 0.5969710041513023
Energy: 0.5973231817799244
Energy: 0.5625729657683705
Energy: 0.6585854050887356
Energy: 0.6592462603376679
Energy: 0.6658362216943188
Energy: 0.6648672287486277
Energy: 0.6592390144775754
Energy: 0.6654527149647234
Energy: 0.6576058196817434
Energy: 0.5975161521557755
Energy: 0.5987368569277963
Energy: 0.597361685515766
Energy: 0.598332441384762
Energy: 0.5621163209974258
Energy: 0.5608262489080255
Energy: 0.5425499790409768
Energy: 0.5424955466573423
Energy: 0.5608875445339088
Energy: 0.5423638764409802
Energy: 0.5448845289360917
Energy: 0.5975318960778832
Energy: 0.6253950096505948
Energy: 0.5920406072335154
Energy: 0.5971866723134824
Energy: 0.5428642825033271
Energy: 0.5624141886513531
Energy: 0.5979588640564406
Energy: 0.6178920335396328
Energy: 0.5649773058122007
Energy: 0.5978816023791027
Energy: 0.5977581405828926
Energy: 0.5987943877074
Energy: 0.6590786101519996
Energy: 0.6286380307214056
Energy: 0.5993160262560101
Energy: 0.6590311514694795
Energy: 0.5987036304139397
Energy: 0.598389388088873
Energy: 0.5422328529733385
Energy: 0.5612966189031784
Energy: 0.5628100072018162
Energy: 0.5423096906808901
Energy: 0.6566355540670031
Energy: 0.5631942071656644

minimum gb energy = 0.5416098033603104 eV
minimum distance =  2.37194911702548 Angstroms
sigma value = 11


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

Energy: 1.8604115458624573
Energy: 1.5482100242387935
Energy: 1.1946755518600067
Energy: 1.4167674151693337
Energy: 2.1381598426145896
Energy: 1.4647472026153654
Energy: 1.11958908199818
Energy: 0.9444682503697948
Energy: 0.9118227902963643
Energy: 0.9618405467805768
Energy: 0.8792685656356922
Energy: 0.9459115438499376
Energy: 0.8809776503690759
Energy: 0.90637175747493
Energy: 0.9069581189875235
Energy: 0.8823498265774282
Energy: 0.913844711826607
Energy: 0.9075053588587109
Energy: 0.8802970677858898
Energy: 0.9496324835199619
Energy: 0.9400597682539377
Energy: 0.8818065548541463
Energy: 0.8816008552555462
Energy: 0.9054677675409003
Energy: 0.8775293182631073
Energy: 1.0360952559804488
Energy: 1.0215248017457257
Energy: 0.8772521054578281
Energy: 1.0905232330046533
Energy: 0.9506880850186151
Energy: 1.184389593416225
Energy: 1.0492536758595474
Energy: 1.048410108675881
Energy: 1.0276777957425898
Energy: 1.0582880595938085
Energy: 1.1092585579619254
Energy: 0.9396607322834396
Energy: 0.9614287321264031
Energy: 0.9477300692757746
Energy: 0.8791412856433859
Energy: 0.9677494302568718
Energy: 0.9467347606256244
Energy: 0.901033344152331
Energy: 0.9631154211880619
Energy: 0.96183581734071
Energy: 0.9676878842448721
Energy: 0.9615330580562755
Energy: 0.9576214692560425
Energy: 1.1849892079245925
Energy: 0.9591868045719097
Energy: 0.9479295924482412
Energy: 0.9851736859933979
Energy: 0.9655231463801281
Energy: 0.9921658686762955
Energy: 1.660665674575702
Energy: 1.1105956566612145
Energy: 1.1101436887114378
Energy: 0.9706024313553218
Energy: 1.1108754742040126
Energy: 1.0522226075798435
Energy: 1.5915805932086031
Energy: 0.966326347880069
Energy: 1.0092490200282058
Energy: 1.0903652668080934
Energy: 0.9674226793935553
Energy: 1.019492330147598
Energy: 1.2759749221566208
Energy: 0.8566802826913573
Energy: 0.9952527604185227
Energy: 1.2302016780936098
Energy: 0.8543977294426286
Energy: 0.9994707101469816
Energy: 1.1097654710637876
Energy: 0.8519424574852522
Energy: 0.9815028941112635
Energy: 1.1088737374603728
Energy: 0.8556841833449448
Energy: 1.0390910474447075
Energy: 1.091347565529304
Energy: 1.034075957582624
Energy: 1.0259873147343934
Energy: 1.0928176652590373
Energy: 1.0266794840900686
Energy: 1.0266749063904854
Energy: 1.088867923809589
Energy: 1.1011065439675947
Energy: 1.2114002756466593
Energy: 1.088654780743316
Energy: 1.205690296779373
Energy: 1.112647029215027
Energy: 1.5006615556861898
Energy: 1.0250609276305034
Energy: 1.0290295230702118
Energy: 1.0922064060598042
Energy: 1.0992734136439661
Energy: 1.0291567372801809
Energy: 1.3317085557470532
Energy: 1.3039332634517689
Energy: 1.0782983523625471
Energy: 1.048057680379435
Energy: 1.5517432646435418
Energy: 1.0067461726937912
Energy: 1.6028736602061475
Energy: 1.0760395356141166
Energy: 1.0337382058307636
Energy: 1.0784370620756834
Energy: 1.0900173280124725
Energy: 1.030258455042101
Energy: 1.5277321804993214
Energy: 1.0479334390271953
Energy: 1.0551545314257142
Energy: 0.9656677800632809
Energy: 1.1031323386276115
Energy: 1.023433167479704
Energy: 1.1403230769900627
Energy: 1.1328156268382275
Energy: 1.0229113903735212
Energy: 0.8815501183866861
Energy: 1.3115697796968715
Energy: 1.028839477162191
Energy: 1.5013670112837298
Energy: 1.024092113770439
Energy: 1.0232768511524952
Energy: 0.967772321790898
Energy: 1.0824577657299077
Energy: 1.0191270674769988
Energy: 1.3830616289605775
Energy: 1.05152307977698
Energy: 1.2779334894586798
Energy: 0.9687526026850193
Energy: 1.197881430684747
Energy: 1.2684303376920731
Energy: 0.9676435257331693
Energy: 1.023254425606311
Energy: 1.023401910790588
Energy: 0.9663977171249063
Energy: 1.0521982532317713
Energy: 1.0170864058583717
Energy: 0.9575923049819933
Energy: 0.9092705200543747
Energy: 0.9059993396178592
Energy: 0.9588449465981179
Energy: 0.9086201096809622
Energy: 0.9536880071079469
Energy: 0.9677250664329599
Energy: 0.9089802216910301
Energy: 0.9573306056922187
Energy: 0.966363948854651
Energy: 0.8810441013550958
Energy: 0.9058277553408406
Energy: 1.4629917465172915
Energy: 0.9337629858627378
Energy: 0.9960579590105679
Energy: 1.1035053420651593
Energy: 0.877678370333258
Energy: 0.9980141542203356

minimum gb energy = 0.8519424574852522 eV
minimum distance =  2.25967820168235 Angstroms
sigma value = 41


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

Energy: 1.7575694912299478
Energy: 0.9758317054535209
Energy: 0.9759394510457444
Energy: 1.2451087430131378
Energy: 0.9511860205133406
Energy: 1.2451151964048346
Energy: 1.3145428087988356
Energy: 0.9954381647306773
Energy: 1.0452146098126256
Energy: 1.0483889960584267
Energy: 0.9508084943370438
Energy: 1.0463341195593217
Energy: 0.9524950373583085
Energy: 0.9913522335752751
Energy: 0.9915230588572663
Energy: 0.9518222997083479
Energy: 0.9913859056304407
Energy: 0.9933700150617174
Energy: 0.9519253164632521
Energy: 0.9839209580426566
Energy: 0.9836993413142343
Energy: 0.9520340802170948
Energy: 0.9573483150397004
Energy: 0.9586436213091427
Energy: 0.9506389930330221
Energy: 1.1442220479787444
Energy: 1.1422151351733785
Energy: 0.9506581246727298
Energy: 1.080675277409965
Energy: 1.0458763982155774
Energy: 1.5541086838251816
Energy: 1.0465431717027893
Energy: 1.074679649188567
Energy: 1.147363217375253
Energy: 1.0446781761366368
Energy: 1.0731425687185923
Energy: 1.3612913303011673
Energy: 1.0456736793952366
Energy: 1.045355315714267
Energy: 0.9511730173162576
Energy: 1.0927242790374465
Energy: 1.0450835108592096
Energy: 1.2086405120963237
Energy: 1.0721818934607588
Energy: 1.0716338463354367
Energy: 1.0516488362426915
Energy: 1.0721208619873344
Energy: 0.9396051605408222
Energy: 1.3616318308635191
Energy: 1.044835721490747
Energy: 1.0444398682040148
Energy: 1.0632456552426848
Energy: 1.0473403203215839
Energy: 1.0921052619878877
Energy: 1.378032042381332
Energy: 1.0732229077189317
Energy: 1.0727711653171095
Energy: 0.9915704100745358
Energy: 1.073470294685829
Energy: 1.1983158747544471
Energy: 1.3790889554928507
Energy: 1.0726633155644696
Energy: 1.1437739643759535
Energy: 0.9528570328573347
Energy: 1.072979588416496
Energy: 1.1433766385664184
Energy: 1.6891604350354894
Energy: 0.9122126189285599
Energy: 1.019970181157764
Energy: 1.2883131866263664
Energy: 0.9123821844794968
Energy: 1.1427695764329124
Energy: 1.0726460425301128
Energy: 0.9483528498161629
Energy: 1.0785596075528345
Energy: 1.0726415917047147
Energy: 0.9132454132016513
Energy: 1.2207260722144806
Energy: 1.0468062932032671
Energy: 1.0948459232690806
Energy: 1.0956845380954163
Energy: 1.0456780106375425
Energy: 1.0756690075877442
Energy: 1.0992111497941037
Energy: 1.0896392862349948
Energy: 1.177988730287987
Energy: 1.1782446411108254
Energy: 1.0904240197717874
Energy: 1.146368111273852
Energy: 1.08973033686444
Energy: 1.2744235668508284
Energy: 0.9881923494655267
Energy: 1.0448399433196274
Energy: 1.0748138675487098
Energy: 0.9513429596791788
Energy: 1.0459784837742743
Energy: 1.7188635538834371
Energy: 0.9776532638023469
Energy: 0.9140853192101023
Energy: 1.2216402083616664
Energy: 0.9541568439322569
Energy: 1.220996877985869
Energy: 1.6206209460548122
Energy: 0.9958832949622232
Energy: 1.046700523705535
Energy: 1.1769345874268724
Energy: 0.950643250326529
Energy: 1.1335188221585777
Energy: 0.9519438495008332
Energy: 0.9921067335701945
Energy: 0.9581599349506277
Energy: 0.9519208940152626
Energy: 0.9916455744311209
Energy: 0.9876600772087867
Energy: 0.9514327467420757
Energy: 0.9587914039984918
Energy: 0.9929785189981998
Energy: 0.9911491729306908
Energy: 0.9915493095407802
Energy: 0.9911457748526361
Energy: 0.9507455223602767
Energy: 1.0463096629643742
Energy: 1.0461960364953504
Energy: 0.9505857058196112
Energy: 1.0476186539667176
Energy: 1.0452723371290404
Energy: 1.5118968999219093
Energy: 1.0769913143785255
Energy: 1.1381835225557282
Energy: 1.512222550722268
Energy: 1.076109290328615
Energy: 1.1166248826918381
Energy: 1.3618001789298348
Energy: 1.0452285033854363
Energy: 1.0449774689809548
Energy: 0.9515263411452064
Energy: 1.0468820061904507
Energy: 1.0455948615919957
Energy: 0.9886402423226686
Energy: 1.0912823830505116
Energy: 1.1308644478212815
Energy: 1.0516214311597618
Energy: 1.0902016029241515
Energy: 1.0516224705846715
Energy: 1.3616688121622917
Energy: 1.046235015236236
Energy: 1.0453048093787884
Energy: 0.9869719988194898
Energy: 1.0666510010593138
Energy: 1.0451000889722073
Energy: 1.3788409110215132
Energy: 1.073001435236515
Energy: 1.1443861857856161
Energy: 0.9528804427321655
Energy: 1.0729051330737274
Energy: 1.1432599709991516
Energy: 1.3779368551115383
Energy: 1.0731431045022117
Energy: 1.0727458395371563
Energy: 0.9536266176048525
Energy: 1.0727693209772249
Energy: 1.0922449237199476
Energy: 1.69404474507286
Energy: 1.0779043153441668
Energy: 1.1456371235255374
Energy: 1.0703764236477147
Energy: 0.9492447666010233
Energy: 1.1447338761231132
Energy: 1.0731522708126802
Energy: 1.2212538551144474
Energy: 1.2207278675136988
Energy: 1.0727511490523325
Energy: 1.0182485712758294
Energy: 1.2845600276187068
Energy: 1.0452541750600668
Energy: 1.1479678642475193
Energy: 1.1434589480954638
Energy: 1.0456451176789165
Energy: 1.1443885238817733
Energy: 1.144058359911327
Energy: 1.0710652656687865
Energy: 1.1497248098034867
Energy: 1.0720617346850263
Energy: 1.071242994389744
Energy: 0.9914949227744083
Energy: 1.073080771530283
Energy: 1.2713407730823443
Energy: 1.0381053278846941
Energy: 0.9956820256470164
Energy: 1.1060882796364453
Energy: 0.9518645648685856
Energy: 1.0451702829667864
Energy: 1.763742163715897
Energy: 0.9776710779692718
Energy: 1.02623822495943
Energy: 0.9142330495511128
Energy: 0.9502276293805323
Energy: 1.1343747282264491

minimum gb energy = 0.9122126189285599 eV
minimum distance =  2.27952774196133 Angstroms
sigma value = 33


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

Energy: 1.3715076737648084
Energy: 1.0217705854938646
Energy: 1.0220726885512386
Energy: 1.374211841167813
Energy: 1.028176995417078
Energy: 1.0217301823807585
Energy: 1.0812414162113628
Energy: 1.1276477102155402
Energy: 1.1246492784425246
Energy: 1.1198358983088643
Energy: 1.0303980595021152
Energy: 1.1258017022213127
Energy: 1.0328562211834529
Energy: 1.0581483961597486
Energy: 1.0587365772763222
Energy: 1.0586884067547078
Energy: 1.0589580779016048
Energy: 1.058611790989248
Energy: 1.0335469049809567
Energy: 1.096318746253112
Energy: 1.013314733692179
Energy: 1.0338158044221715
Energy: 1.0084682334459718
Energy: 1.013721980334257
Energy: 1.0281268517217563
Energy: 1.0148556583520714
Energy: 1.124398111756182
Energy: 1.0281367384471902
Energy: 1.0832020849068962
Energy: 1.1246639381761863
Energy: 1.485169398290991
Energy: 1.0158946162404456
Energy: 1.0157888507357105
Energy: 1.0279530450347332
Energy: 1.0158212530330357
Energy: 1.0162463523811107
Energy: 1.0825209662776383
Energy: 1.1250813594364324
Energy: 1.128432716746132
Energy: 1.034356756962738
Energy: 1.1587213542168069
Energy: 1.1285602957964846
Energy: 1.371617429188975
Energy: 0.9787362642142676
Energy: 1.0145864058198468
Energy: 1.1117804827543976
Energy: 0.9786686056092302
Energy: 1.0174937616866075
Energy: 1.0834415998980018
Energy: 1.121821305580052
Energy: 1.125149790737672
Energy: 1.1909146772581716
Energy: 0.9771845802815006
Energy: 1.1270870792522416
Energy: 1.5159216034076328
Energy: 0.9816951349920904
Energy: 0.9792600679274454
Energy: 1.0597931054782526
Energy: 0.9814076750740368
Energy: 0.9780363359495636
Energy: 1.1649214783748003
Energy: 0.9789539212550673
Energy: 1.130297709849713
Energy: 1.031856898152703
Energy: 1.014268574306331
Energy: 1.1298500389998882
Energy: 1.4833720764323204
Energy: 0.9773852337998602
Energy: 1.265995632473426
Energy: 1.0297937446136294
Energy: 0.9804384216116413
Energy: 1.255890010264277
Energy: 1.0294106173128972
Energy: 0.9773360752107095
Energy: 1.1839345083700776
Energy: 1.0295959576585294
Energy: 0.9763711968857111
Energy: 0.9788369328249076
Energy: 1.033919355464553
Energy: 1.0603661766522299
Energy: 1.0098865337215925
Energy: 1.0353381006528903
Energy: 1.0087928212659831
Energy: 1.0093391609393583
Energy: 0.9786912837896178
Energy: 1.0586758804122633
Energy: 1.0082137050264366
Energy: 1.0604933050807581
Energy: 1.0578647766347515
Energy: 1.0081742214753804
Energy: 1.0304122729510192
Energy: 1.0648559377933338
Energy: 1.0606798281488394
Energy: 1.0959753180569527
Energy: 1.0334491165982802
Energy: 1.0596404600823277
Energy: 1.514008967533419
Energy: 1.0639295692839164
Energy: 0.9793904513008458
Energy: 1.049100367890244
Energy: 1.0655250138862764
Energy: 0.9782283385019832
Energy: 1.5146570286414993
Energy: 1.176825576024818
Energy: 1.124369016905783
Energy: 1.036534942189302
Energy: 1.0299344130459294
Energy: 1.1252879605929842
Energy: 1.4327958141171002
Energy: 1.0483345438258638
Energy: 0.977475483082269
Energy: 0.9784303026982526
Energy: 1.1163337833557514
Energy: 1.189236436890822
Energy: 0.9789843982764285
Energy: 0.9777261122384125
Energy: 0.9785344376616569
Energy: 0.9787413857119218
Energy: 1.1121257225286114
Energy: 1.1238248543540652
Energy: 0.9761249906489231
Energy: 1.1928712525291174
Energy: 1.1893078053388952
Energy: 0.9766086839120002
Energy: 1.1235897285664653
Energy: 1.1874185610930759
Energy: 1.0175648022428052
Energy: 1.0146948320588443
Energy: 1.015276622121091
Energy: 1.0179135981656597
Energy: 1.0146283597113028
Energy: 1.23556626128209
Energy: 1.0294925862880089
Energy: 1.1250147582886996
Energy: 1.1290075853934365
Energy: 0.9764099230473536
Energy: 1.172848420944537
Energy: 1.127842712941162
Energy: 1.3713571349287166
Energy: 1.0656058857150403
Energy: 0.9760814552815568
Energy: 0.9758279829448446
Energy: 1.0661869673482045
Energy: 0.9765599859589773
Energy: 1.166417228355889
Energy: 1.1248453809146521
Energy: 1.1248711362390482
Energy: 1.1221857727067508
Energy: 1.029682326367419
Energy: 1.1254677113802816
Energy: 1.0330833648317932
Energy: 1.0101399880764173
Energy: 1.009458941067552
Energy: 1.033271871628977
Energy: 1.05929139061172
Energy: 1.04928857904102
Energy: 1.0332432736287116
Energy: 1.0140289501241468
Energy: 1.049513472836914
Energy: 1.0322796986260523
Energy: 1.0087496218739325
Energy: 1.0581601752221934
Energy: 1.0297665777049616
Energy: 1.1219587516111298
Energy: 1.123903440457844
Energy: 1.0299382700753197
Energy: 1.0134975662412906
Energy: 1.1266295771727042
Energy: 1.5269301864546774
Energy: 1.0161380497602919
Energy: 1.0159733915580633
Energy: 1.0664636271897814
Energy: 1.0152612627624775
Energy: 1.0150596334249558
Energy: 1.0826069493189916
Energy: 1.1226066346534707
Energy: 1.1264361758005708
Energy: 1.1743996192727495
Energy: 1.1206754668653272
Energy: 1.1276185929148979
Energy: 1.371525615699963
Energy: 1.0157804092521114
Energy: 1.0432312595544937
Energy: 1.1119673252608788
Energy: 1.0154297261374343
Energy: 1.0142198820402348
Energy: 1.085139144231097
Energy: 1.12432660387069
Energy: 1.1268496633979237
Energy: 1.1755896411064772
Energy: 0.9772315019820297
Energy: 1.1285451563748978
Energy: 1.5142599007244837
Energy: 0.9791927062477556
Energy: 0.9779524764070102
Energy: 1.0317272871200405
Energy: 0.981434881480018
Energy: 1.124248651730594
Energy: 1.5137927158481537
Energy: 1.0140485212951336
Energy: 1.1287876481665635
Energy: 1.0313163350638026
Energy: 0.9795308476245492
Energy: 1.1246658987609142
Energy: 1.4834786452924873
Energy: 1.1234725299505013
Energy: 1.2618504203447922
Energy: 1.029089716563306
Energy: 0.9815178289007231
Energy: 1.1254492284911433
Energy: 1.0279981890141814
Energy: 0.9745223836525698
Energy: 0.9773267215068489
Energy: 1.0295004253675881
Energy: 0.978653702232832
Energy: 0.9765311886862086
Energy: 1.0312988487668124
Energy: 1.0580802953483182
Energy: 1.058635312642075
Energy: 1.0328482951137397
Energy: 1.0602998793685057
Energy: 1.008432686448397
Energy: 1.010820634436848
Energy: 1.058583079797351
Energy: 1.0078930586449575
Energy: 1.0105863769111616
Energy: 1.0573650560196979
Energy: 1.0087031035181122
Energy: 1.0315986826252774
Energy: 1.0327246203081606
Energy: 1.0603293457383576
Energy: 1.0452780889989999
Energy: 1.0359642189553266
Energy: 1.0607181966565071
Energy: 1.54301257806297
Energy: 1.0282293706659695
Energy: 1.0279231748093722
Energy: 1.0742602385967368
Energy: 1.0277611001640115
Energy: 0.9800687562705184
Energy: 1.5145866576300888
Energy: 1.1789624522573674
Energy: 1.1245113330395404
Energy: 1.038099444499642
Energy: 1.0284548857193467
Energy: 1.1235245775773453
Energy: 1.4323709986409647
Energy: 1.0482122961232452
Energy: 0.9767047582557637
Energy: 0.9774757701282634
Energy: 1.0808362118159147
Energy: 1.127233118482213
Energy: 0.9774087092547417
Energy: 1.0489611954742561
Energy: 0.9789557956554137
Energy: 0.9775340685930377
Energy: 1.1107417196410272
Energy: 0.979190134358689
Energy: 0.9769826568708876
Energy: 1.190852953451254
Energy: 1.1881344268736107
Energy: 0.9769851438312548
Energy: 1.1902888896743855
Energy: 1.185375750682052
Energy: 1.015547117864927
Energy: 1.0139683963812858
Energy: 0.9791823274021173
Energy: 1.015491128771915
Energy: 1.0145042211590676
Energy: 1.0154657444702404
Energy: 1.030277810073781
Energy: 1.128003760988217
Energy: 1.1314759052457546
Energy: 1.0119242981898688
Energy: 1.1747287934331843
Energy: 1.1290743518920243
Energy: 1.945878935687227
Energy: 1.0167939139536701
Energy: 0.9783453673998771
Energy: 0.9779178926742177
Energy: 1.348902089819419
Energy: 0.9794515510553051

minimum gb energy = 0.9745223836525698 eV
minimum distance =  2.34918187813871 Angstroms
sigma value = 67


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

Energy: 1.6209264394793046
Energy: 1.0193534989090138
Energy: 1.0145016424786277
Energy: 1.0144536752991398
Energy: 1.0803841404345533
Energy: 1.014367356226446
Energy: 1.1603800031591842
Energy: 1.033066905778656
Energy: 1.03384162216577
Energy: 1.0331822308535024
Energy: 1.0332545388277246
Energy: 1.0331558819061268
Energy: 1.0915035324652809
Energy: 0.9842679526495096
Energy: 1.0279902377140826
Energy: 1.0278837545827284
Energy: 0.9841387140918666
Energy: 1.0280657914569251
Energy: 1.0836919497821154
Energy: 1.0373283497735788
Energy: 1.0365781945022434
Energy: 1.083970330301181
Energy: 1.0328438726608673
Energy: 1.036245155630593
Energy: 1.0735665703314536
Energy: 1.0442638797702897
Energy: 1.0458115480275123
Energy: 1.0739927784317067
Energy: 1.039734975565403
Energy: 1.0450333910624199
Energy: 1.0747677325361271
Energy: 1.0248168677011156
Energy: 1.0428649160238201
Energy: 1.0746946127076369
Energy: 1.0247152554499213
Energy: 1.0756691718279574
Energy: 1.1620846566437706
Energy: 1.0321560131214718
Energy: 1.0307465150687454
Energy: 1.1315862790116593
Energy: 1.0390620830839397
Energy: 1.030778456778113

minimum gb energy = 0.9841387140918666 eV
minimum distance =  2.35511209422214 Angstroms
sigma value = 3


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

Energy: 2.098498302685604
Energy: 1.3103759127818582
Energy: 1.1542440953009667
Energy: 1.13319664293179
Energy: 1.297964993064591
Energy: 1.2188570637779155
Energy: 1.1258898779511628
Energy: 1.12526550650709
Energy: 1.1259873144477566
Energy: 1.0769861504161182
Energy: 1.2699062027321646
Energy: 1.081397148217183
Energy: 1.1648362449227236
Energy: 1.1087103796345068
Energy: 1.110013543340466
Energy: 1.0783660923366818
Energy: 1.1072874801343482
Energy: 1.106456637849542
Energy: 1.157212603728334
Energy: 1.0766926070140255
Energy: 1.1374640070169648
Energy: 1.1459304243272828
Energy: 1.10673125099198
Energy: 1.0756366650303433
Energy: 1.1523001599097984
Energy: 1.1481790327590504
Energy: 1.1426241641183104
Energy: 1.1471290264048846
Energy: 1.1899535987688834
Energy: 1.1460347198845497
Energy: 1.1462209116705608
Energy: 1.1799679086946364
Energy: 1.1764878506113028
Energy: 1.1406662829724747
Energy: 1.202456009088607
Energy: 1.163322258366778
Energy: 1.1628815951108946
Energy: 1.171345151161908
Energy: 1.2058098376070674
Energy: 1.1616618584733573
Energy: 1.2587584593242815
Energy: 1.2292871186397236
Energy: 1.9485192788845667
Energy: 1.5944397383060132
Energy: 1.4337830861899012
Energy: 1.1075691696468148
Energy: 1.6695376159870607
Energy: 1.2424918200422963
Energy: 1.1898374807098793
Energy: 1.1466102737807582
Energy: 1.2313279297195205
Energy: 1.2427215346766944
Energy: 1.2352236427275978
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Energy: 1.4958281954459889
Energy: 1.1201851635275262
Energy: 1.1201030922964796
Energy: 1.4852637558562787
Energy: 1.1216422069575698
Energy: 1.2093752380611305
Energy: 1.315266360979923
Energy: 1.1663187137712407
Energy: 1.1102904155817803
Energy: 1.2686058827387252
Energy: 1.255391167061082
Energy: 1.212424943784834
Energy: 1.312018019545581
Energy: 1.1547706477710533
Energy: 1.1509121714354458
Energy: 1.310420326674856
Energy: 1.2100426445482244
Energy: 1.1529882452504945
Energy: 1.1891269525372026
Energy: 1.1530527263503019
Energy: 1.1533077057863832
Energy: 1.2383943489559197
Energy: 1.1532557897710027
Energy: 1.1532848499407582
Energy: 1.3758174097479199
Energy: 1.14721028536455
Energy: 1.1377298353123142
Energy: 1.2232756029580611
Energy: 1.1436983899795663
Energy: 1.1380801625544739
Energy: 1.2768671773795184
Energy: 1.3079897873509951
Energy: 1.248227489342032
Energy: 1.1064190088324455
Energy: 1.154872446114039
Energy: 1.1542561423808393
Energy: 1.5652110129745196
Energy: 1.1528835854256494
Energy: 1.1828403199640782
Energy: 1.4566104749009694
Energy: 1.150800516696604
Energy: 1.1764865146896266
Energy: 1.4007708169185993
Energy: 1.150904154970188
Energy: 1.1522520136921715
Energy: 1.4009135882552717
Energy: 1.1513440190942468
Energy: 1.2918081808841892
Energy: 1.5461617058083215
Energy: 1.181427650599029
Energy: 1.2030802347779779
Energy: 1.5119047016034233
Energy: 1.18570936786194
Energy: 1.1925099295955395
Energy: 1.5748344255305071
Energy: 1.1490103199974355
Energy: 1.1485490853617613
Energy: 1.133979289539343
Energy: 1.2447629781982357
Energy: 1.1173259659050303
Energy: 1.3651302466487638
Energy: 1.1832496674511028
Energy: 1.149446117625196
Energy: 1.1176108870437826
Energy: 1.1758918605242261
Energy: 1.1179890763968685
Energy: 1.2113809040911627
Energy: 1.1907561755012024
Energy: 1.2034145882091387
Energy: 1.2710014282766893
Energy: 1.1892853861445434
Energy: 1.200714431588599
Energy: 1.1776314895190625
Energy: 1.1869021287809862
Energy: 1.187101831963177
Energy: 1.241575089554936
Energy: 1.1830060848763682
Energy: 1.182014191041214
Energy: 1.1785219010490775
Energy: 1.1893169529965348
Energy: 1.1814688331287075
Energy: 1.1801251723557766
Energy: 1.2459159333957412
Energy: 1.2233212193994407
Energy: 1.2101565922159294
Energy: 1.1075011956377951
Energy: 1.112357715058591
Energy: 1.2156845332927013
Energy: 1.1069631781755556
Energy: 1.2035527234736383
Energy: 1.1765513063467747
Energy: 1.1800154320655822
Energy: 1.1613183402034237
Energy: 1.2664533927477706
Energy: 1.2613670306922637
Energy: 1.1606164141957873
Energy: 1.6539133644963266
Energy: 1.3659747347897706
Energy: 1.232596288835069
Energy: 1.074864089629106
Energy: 1.5097695256771642
Energy: 1.1445642373668208
Energy: 1.6511298779582557
Energy: 1.3658611701926988
Energy: 1.234867149921517
Energy: 1.074956108066204
Energy: 1.4457055316394358
Energy: 1.2015436921950957
Energy: 1.178558495384757
Energy: 1.1802521699246142
Energy: 1.1616281138796154
Energy: 1.2755076194575823
Energy: 1.3713371520130768
Energy: 1.1612319280964216
Energy: 1.1637209416047618
Energy: 1.1096241221723147
Energy: 1.1145696620028143
Energy: 1.163124819634314
Energy: 1.1089952849491373
Energy: 1.1632689273736134
Energy: 1.1405105244390261
Energy: 1.1614981794659571
Energy: 1.1594752318490433
Energy: 1.142713914563343
Energy: 1.190841371187709
Energy: 1.1587837932075593
Energy: 1.1419051010367176
Energy: 1.1613329648383541
Energy: 1.1609191511311625
Energy: 1.1591625481238705
Energy: 1.1776016970348946
Energy: 1.1622209906265113
Energy: 1.1704870204797835
Energy: 1.203584184272671
Energy: 1.2058899007401773
Energy: 1.2162969970455784
Energy: 1.3490835481886212
Energy: 1.1873669012810626
Energy: 1.5998422981750564
Energy: 1.297840117603462
Energy: 1.2694157432536852
Energy: 1.1082579438708011
Energy: 1.2740071582126267
Energy: 1.1515153708826908
Energy: 1.5773802076116696
Energy: 1.2206389430313336
Energy: 1.2243138979886758
Energy: 1.1325050576011206
Energy: 1.2966910781547882
Energy: 1.1500958774961558
Energy: 1.287132079471666
Energy: 1.110768694668721
Energy: 1.1106198774933644
Energy: 1.2983063036493059
Energy: 1.1780495823090296
Energy: 1.1455020051758098
Energy: 1.293443606549477
Energy: 1.1199414630415503
Energy: 1.1193267194419163
Energy: 1.2906829030292637
Energy: 1.12053128816565
Energy: 1.1994789737695906
Energy: 1.3154675546464851
Energy: 1.1787375671996816
Energy: 1.1798035382881418
Energy: 1.3166911729762645
Energy: 1.224074710254939
Energy: 1.2623672085367155
Energy: 1.1911744733410696
Energy: 1.1599680566153456
Energy: 1.15649990972285
Energy: 1.1061716429946957
Energy: 1.1603024656122602
Energy: 1.1601520361221307
Energy: 1.2902559915465521
Energy: 1.140568415775351
Energy: 1.139840994261792
Energy: 1.2920330991017952
Energy: 1.1451718405056877
Energy: 1.138072931021263
Energy: 1.2766714753261836
Energy: 1.1521527857534986
Energy: 1.1534471172866327
Energy: 1.1062717925838246
Energy: 1.1511690562864922
Energy: 1.1566742964929984
Energy: 1.564128730416805
Energy: 1.1566037630654853
Energy: 1.149041482754107
Energy: 1.3874863280260248
Energy: 1.3737459287210076
Energy: 1.1487832437561627
Energy: 1.5686649492080227
Energy: 1.2016574485342078
Energy: 1.2010834322788895
Energy: 1.5215058827128023
Energy: 1.1150917437323025
Energy: 1.2280850066923796
Energy: 1.4153925754998615
Energy: 1.1518518465414227
Energy: 1.1516159844045912
Energy: 1.4667005992531035
Energy: 1.1760922970631618
Energy: 1.290361678078178
Energy: 1.5115272105692008
Energy: 1.1491590541005106
Energy: 1.1423706297865392
Energy: 1.2434425556093966
Energy: 1.1427871844766007
Energy: 1.1417197948033864
Energy: 1.8199775875221507
Energy: 1.2034016653856523
Energy: 1.1929257194683056
Energy: 1.1567811945216215
Energy: 1.2107710777087288
Energy: 1.1940649795099962
Energy: 1.2045993316314965
Energy: 1.1743336077868882
Energy: 1.1840658315168713
Energy: 1.1613745358834606
Energy: 1.1746481015802086
Energy: 1.1781755641685265
Energy: 1.2002054923598229
Energy: 1.198968284442646
Energy: 1.193665219143181
Energy: 1.2029640566525042
Energy: 1.1937702887304353
Energy: 1.1926429706199144
Energy: 1.18705278038698
Energy: 1.200415804727796
Energy: 1.1683481497361647
Energy: 1.1825112718453743
Energy: 1.2248230585974942
Energy: 1.1741205860520383
Energy: 1.2034817012240833
Energy: 1.107533980313573
Energy: 1.1379818761054425
Energy: 1.1798881243807924
Energy: 1.1074113786014306
Energy: 1.1376919734551287
Energy: 1.4372084010800132
Energy: 1.1083376538826877
Energy: 1.107896126820141
Energy: 1.3182048905504742
Energy: 1.108107419301651
Energy: 1.1384721702505196
Energy: 1.1256227224017032
Energy: 1.1747598253760485
Energy: 1.1450855301807303
Energy: 1.1106637568488924
Energy: 1.2997347541435431
Energy: 1.136445219699437

minimum gb energy = 1.074864089629106 eV
minimum distance =  2.28296699580633 Angstroms
sigma value = 81


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

Energy: 2.243522983529253
Energy: 1.2058914129020097
Energy: 1.0641881188662388
Energy: 1.063793950712575
Energy: 1.158016201615037
Energy: 1.1866467490071093
Energy: 1.1466264273233553
Energy: 1.0460072585045224
Energy: 1.0453402315809543
Energy: 1.049495313099913
Energy: 1.1243275340883445
Energy: 1.046021634478181
Energy: 1.27865163642147
Energy: 1.1768508658538102
Energy: 1.1752755578542726
Energy: 1.148300140470179
Energy: 1.1233450427052356
Energy: 1.05962703149218
Energy: 1.2500973691566934
Energy: 1.1767576084744866
Energy: 1.285550887804024
Energy: 1.1992239357244026
Energy: 1.1649677248977657
Energy: 1.148027494049779
Energy: 1.210487619116272
Energy: 1.2352854922075824
Energy: 1.240374177661339
Energy: 1.1990460145401365
Energy: 1.2405288000191887
Energy: 1.2417296843370378
Energy: 1.209919510361838
Energy: 1.227007022398303
Energy: 1.229764736747582
Energy: 1.2191028302404399
Energy: 1.2353672578380064
Energy: 1.226664535939962
Energy: 1.185072699919268
Energy: 1.2902318699234852
Energy: 1.1661525627433211
Energy: 1.1708463549831603
Energy: 1.2919374429357036
Energy: 1.2358770288443786
Energy: 1.6983954380574735
Energy: 1.6255428826231328
Energy: 1.4045548770973282
Energy: 1.087238880893215
Energy: 1.4173146625031174
Energy: 1.0861583404404918
Energy: 1.2026569738705004
Energy: 1.2406197130755834
Energy: 1.2022892967446357
Energy: 1.156446578095096
Energy: 1.2613327639723309
Energy: 1.114509961013561
Energy: 1.2515517315397127
Energy: 1.0678349343736333
Energy: 1.0676567855669925
Energy: 1.2164741166619366
Energy: 1.0047563280784637
Energy: 1.00481205169208
Energy: 1.1872119666972711
Energy: 1.0709782251814666
Energy: 1.0694582060091238
Energy: 1.202464576313692
Energy: 1.0051266622115795
Energy: 1.150533942106879
Energy: 1.1286732655295582
Energy: 1.2969094782861015
Energy: 1.1927061841473763
Energy: 1.151574920494448
Energy: 1.2068967564585593
Energy: 1.280847713374142
Energy: 1.1289088390489395
Energy: 1.215133617239776
Energy: 1.3065774661447431
Energy: 1.1759882026643087
Energy: 1.2088145947587394
Energy: 1.1220035482206765
Energy: 1.2230038323093542
Energy: 1.2258301783610972
Energy: 1.2257044502962156
Energy: 1.2300704793537651
Energy: 1.2092414261644242
Energy: 1.2331866297939285
Energy: 1.2092670413871895
Energy: 1.2501547300308373
Energy: 1.2502246559356671
Energy: 1.2152179938988092
Energy: 1.2511296061166528
Energy: 1.2163339302391654
Energy: 1.2103868324815368
Energy: 1.2129421486180478
Energy: 1.2103691178713114
Energy: 1.212994824723555
Energy: 1.213920043179478
Energy: 1.2154415050370495
Energy: 1.4601420229932864
Energy: 1.1387779585852988
Energy: 1.138677960441051
Energy: 1.460533070491295
Energy: 1.0861152787116928
Energy: 1.1885374191305527
Energy: 1.538851651508754
Energy: 1.2701172206294882
Energy: 1.2232665943917151
Energy: 1.4032142224531456
Energy: 1.220773772365719
Energy: 1.2856424019029675
Energy: 1.0073714807787435
Energy: 1.2585454605603397
Energy: 1.0048977170808469
Energy: 1.0055719039164173
Energy: 1.3299763767717887
Energy: 1.0045960329726307
Energy: 1.0066529646706728
Energy: 1.2587106458782258
Energy: 1.0044670417108417
Energy: 1.00502507188351
Energy: 1.295344848843403
Energy: 1.0047048189158556
Energy: 1.2162935953161473
Energy: 1.269467822890099
Energy: 1.2697024648729216
Energy: 1.2762575382414942
Energy: 1.2209617890158924
Energy: 1.3747686012469562
Energy: 1.2077049809973022
Energy: 1.1524582052978682
Energy: 1.1515040783485548
Energy: 1.2088204023422775
Energy: 1.08843531400126
Energy: 1.2178040720267156
Energy: 1.2056868780737524
Energy: 1.2931110561901282
Energy: 1.216639503036137
Energy: 1.2068590421308412
Energy: 1.209518482314509
Energy: 1.2165904967725134
Energy: 1.2071872946119055
Energy: 1.2172147139390948
Energy: 1.2173256300350728
Energy: 1.2154358946651305
Energy: 1.2149120913412217
Energy: 1.2153852320347485
Energy: 1.2749370204946662
Energy: 1.2362051313406686
Energy: 1.2358371892898319
Energy: 1.2284378099864652
Energy: 1.249850770801158
Energy: 1.2282466443057323
Energy: 1.5557968685103725
Energy: 1.336661211209553
Energy: 1.3373731037672245
Energy: 1.2414810702366201
Energy: 1.5561504723210442
Energy: 1.1766587130869304
Energy: 1.379314910158578
Energy: 1.3197199045216383
Energy: 1.278112983493592
Energy: 1.2555915779214801
Energy: 1.5604230080003014
Energy: 1.2188854571049745
Energy: 1.2193928888163548
Energy: 1.0052766872602248
Energy: 1.1496096658083745
Energy: 1.2249968532196263
Energy: 1.1080810590736392
Energy: 1.1515663484016967
Energy: 1.208547526475471
Energy: 1.0048099505929677
Energy: 1.0048515386637082
Energy: 1.2239659431643188
Energy: 1.0676900675451348
Energy: 1.0674526049047448
Energy: 1.2042525568456948
Energy: 1.2415019927130635
Energy: 1.1869967348397896
Energy: 1.1741598658309245
Energy: 1.2030339771676628
Energy: 1.1133914566686491
Energy: 1.1301143179278492
Energy: 1.3917294004114247
Energy: 1.3656088748586168
Energy: 1.0856922114856804
Energy: 1.470420481762695
Energy: 1.2163119602083208
Energy: 1.1880380464200069
Energy: 1.1956413833645423
Energy: 1.2002486181205463
Energy: 1.1674760173884453
Energy: 1.2074416199560907
Energy: 1.2965814216206992
Energy: 1.2132629786649998
Energy: 1.227676893923919
Energy: 1.2295089270649375
Energy: 1.2593634919398833
Energy: 1.22523052327372
Energy: 1.2272096353004462
Energy: 1.2132214786787572
Energy: 1.240911493697237
Energy: 1.2446326145013265
Energy: 1.2285440042915299
Energy: 1.2422880242714744
Energy: 1.241413355547053
Energy: 1.4635735283687068
Energy: 1.0821477153197674
Energy: 1.2334635252202384
Energy: 1.4499598024629694
Energy: 1.086427612566959
Energy: 1.0816131437102325
Energy: 1.5431987823245494
Energy: 1.1744415769976462
Energy: 1.1756584517047097
Energy: 1.4663529339098946
Energy: 1.1738235704169366
Energy: 1.4552544458286152
Energy: 1.2998664379981166
Energy: 1.0457266014671658
Energy: 1.0448505162294612
Energy: 1.0510548118066794
Energy: 1.1249892057594408
Energy: 1.0451762411798573
Energy: 1.5873785320133096
Energy: 1.1070209493640482
Energy: 1.0641059973726952
Energy: 1.0052881375618894
Energy: 1.1058859238883474
Energy: 1.1872454960742886

minimum gb energy = 1.0044670417108417 eV
minimum distance =  2.32715853151894 Angstroms
sigma value = 43


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

Energy: 2.211034221440421
Energy: 1.413435845560304
Energy: 1.2703695735590348
Energy: 1.1428962074261642
Energy: 1.4988154601981811
Energy: 1.143289215414294
Energy: 1.1081427115813738
Energy: 1.1649201438246102
Energy: 1.1380909389818008
Energy: 1.1005699518007854
Energy: 1.0853986760046215
Energy: 1.1612186925122947
Energy: 1.1149628479650462
Energy: 1.1039467573162804
Energy: 1.105633979127401
Energy: 1.3023553190821764
Energy: 1.085350157370536
Energy: 1.1011428798952507
Energy: 1.0985358519990815
Energy: 1.1063229205516552
Energy: 1.1013503886117633
Energy: 1.0984558056814901
Energy: 1.1218988993914307
Energy: 1.1006315611563904
Energy: 1.079257014914033
Energy: 1.1024740291940236
Energy: 1.104841752885212
Energy: 1.079274329119124
Energy: 1.1491060018375074
Energy: 1.1504447047528557
Energy: 1.0807502937344355
Energy: 1.1489572537281991
Energy: 1.1488135829447683
Energy: 1.166252116240673
Energy: 1.080252076171385
Energy: 1.1469771518892757
Energy: 1.142940513039718
Energy: 1.0790569430697003
Energy: 1.0790155293724208
Energy: 1.2052041746176823
Energy: 1.0792610043793684
Energy: 1.0792473732535632
Energy: 1.3067263795511652
Energy: 1.098717283326925
Energy: 1.1005082500993741
Energy: 1.1010736573781532
Energy: 1.0986215988066719
Energy: 1.395404494180808
Energy: 1.1929327278961488
Energy: 1.1287600219933207
Energy: 1.0799973619122474
Energy: 1.1714977162547158
Energy: 1.131039728973068
Energy: 1.1102678379088122
Energy: 1.4926760487212913
Energy: 1.1633019893365442
Energy: 1.1634988774499482
Energy: 1.313735079193737
Energy: 1.241005053675966
Energy: 1.1619281011012448
Energy: 1.0668107406759904
Energy: 1.0992304447960457
Energy: 1.098598487772791
Energy: 1.160758953374227
Energy: 1.2153987539443591
Energy: 1.155136776617363
Energy: 1.2621628101634426
Energy: 1.130366160421905
Energy: 1.1296863146673162
Energy: 1.1684048660176585
Energy: 1.28261892475964
Energy: 1.130129823716091
Energy: 1.3105741013914969
Energy: 1.10216409433204
Energy: 1.091509789640011
Energy: 1.151578964577853
Energy: 1.1799885015644027
Energy: 1.0918371430936729
Energy: 1.080396860857862
Energy: 1.0793384204898795
Energy: 1.2229453941038062
Energy: 1.1711676151265378
Energy: 1.097915861470184
Energy: 1.1580137794242624
Energy: 1.066824289026248
Energy: 1.1964599994119427
Energy: 1.117745681015241
Energy: 1.1420150789771575
Energy: 1.2120497622706752
Energy: 1.1966524963433232
Energy: 1.0675274442544753
Energy: 1.0615062764862067
Energy: 1.0668922790872568
Energy: 1.0669127445247504
Energy: 1.2006106365518512
Energy: 1.06667267139371
Energy: 1.0663061740910116
Energy: 1.14040998973533
Energy: 1.1401461147381
Energy: 1.0665079893380738
Energy: 1.146058859631026
Energy: 1.1405152853616303
Energy: 1.0663462445889773
Energy: 1.1550784756379755
Energy: 1.0992444279691058
Energy: 1.1894463934736066
Energy: 1.099442184365927
Energy: 1.098865404766418
Energy: 1.1936199325767296
Energy: 1.0999635669687475
Energy: 1.1001508644883573
Energy: 1.1288951243401075
Energy: 1.1230813232441657
Energy: 1.099935488512537
Energy: 1.1927779012227113
Energy: 1.0996504592409524
Energy: 1.1026919706683942
Energy: 1.234669834928692
Energy: 1.2320101490600304
Energy: 1.1252207303612254
Energy: 1.0807348553070566
Energy: 1.1878089989140839
Energy: 1.1968783925688764
Energy: 1.1868250102880817
Energy: 1.1782100907574231
Energy: 1.099272867697103
Energy: 1.3114706832575884
Energy: 1.0899243910282748
Energy: 1.2941591159720425
Energy: 1.3143178181949013
Energy: 1.1262431143091238
Energy: 1.2867794478489643
Energy: 1.3121012793949351
Energy: 1.0993356740374343
Energy: 1.0804071838476834
Energy: 1.186758448190172
Energy: 1.0996103241797914
Energy: 1.1552812704932653
Energy: 1.299337294794016
Energy: 1.2359098705791345
Energy: 1.1051300145263905
Energy: 1.0929730044071941
Energy: 1.1224895226056888
Energy: 1.105021432154888
Energy: 1.3059779239145521
Energy: 1.085993566410253
Energy: 1.0867134564339718
Energy: 1.24718800398281
Energy: 1.0856223919941457
Energy: 1.1406958503477391
Energy: 1.1954254109645468
Energy: 1.0749333612857455
Energy: 1.1965891104317965
Energy: 1.1449029078778756
Energy: 1.0747825155235429
Energy: 1.19657561036614
Energy: 1.195870885936874
Energy: 1.0744324493348516
Energy: 1.0741636121750704
Energy: 1.0980331189832535
Energy: 1.1746887375747546
Energy: 1.0753378011519867
Energy: 1.183184604992765
Energy: 1.1626948060552609
Energy: 1.1102899661250822
Energy: 1.0997701924190824
Energy: 1.1942846715425635
Energy: 1.0792252103575384
Energy: 1.150457757981729
Energy: 1.0975506320835464
Energy: 1.1239169039268113
Energy: 1.1505884184824169
Energy: 1.1223389860930548
Energy: 1.3428139529436975
Energy: 1.1224413745845037
Energy: 1.1652390270779946
Energy: 1.2337112231727054
Energy: 1.0997270726181516
Energy: 1.0860413539267433
Energy: 1.0978505783436086
Energy: 1.0666679164211985
Energy: 1.4978361107045495
Energy: 1.4040211080863307
Energy: 1.2479708898575417
Energy: 1.4105538691117099
Energy: 1.2330363208586268

minimum gb energy = 1.0615062764862067 eV
minimum distance =  2.24508458501722 Angstroms
sigma value = 57


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

Energy: 1.8381122542812693
Energy: 1.3407437914285194
Energy: 1.2659214025195624
Energy: 1.2372915405945353
Energy: 1.7496083068663764
Energy: 1.415728142439396
Energy: 1.1045625791199862
Energy: 1.143919331715115
Energy: 1.1437668033550805
Energy: 1.184880111737408
Energy: 1.1793828656840448
Energy: 1.2168679681054526
Energy: 1.570202043532673
Energy: 1.120311245922809
Energy: 1.111199599791454
Energy: 1.4926066121199717
Energy: 1.1162497695156735
Energy: 1.1000028118849678
Energy: 1.140806141245169
Energy: 1.1079399908087748
Energy: 1.106815286827702
Energy: 1.1423078013651617
Energy: 1.1070138543054007
Energy: 1.135852949357986
Energy: 1.1401430230000846
Energy: 1.1826873784837229
Energy: 1.1715618222849573
Energy: 1.175419796523858
Energy: 1.1812618507581167
Energy: 1.1454150373655434
Energy: 1.0834752803321692
Energy: 1.1309520824810284
Energy: 1.1444480190283735
Energy: 1.1846770249214673
Energy: 1.1365915992684636
Energy: 1.1440819355732643
Energy: 1.1859334065788252
Energy: 1.1366834352566777
Energy: 1.135380788431772
Energy: 1.0550585232385477
Energy: 1.1983327132257573
Energy: 1.1493202525326502
Energy: 1.1287228980656456
Energy: 1.1955629053036605
Energy: 1.1955714314461763
Energy: 1.2108336204888992
Energy: 1.1955116479954175
Energy: 1.2567382643621376
Energy: 1.1866537782893554
Energy: 1.2570718741928342
Energy: 1.2583256318090748
Energy: 1.049325341008838
Energy: 1.2555932348812595
Energy: 1.1848636455845705
Energy: 1.4764330814563003
Energy: 1.2189207895222776
Energy: 1.207092254704107
Energy: 1.4768960977084624
Energy: 1.2193315205559732
Energy: 1.20671067822373
Energy: 1.044516250473942
Energy: 1.1441953063046433
Energy: 1.0365937919846524
Energy: 1.0431909575965739
Energy: 1.1267107157972296
Energy: 1.0364279428651113
Energy: 1.0380841647658139
Energy: 1.251437359306044
Energy: 1.2512881478039386
Energy: 1.0933319030204764
Energy: 1.2515776718111506
Energy: 1.2512169043785424
Energy: 1.0403957899067833
Energy: 1.2516041357195637
Energy: 1.2517138555426628
Energy: 1.2520809149793124
Energy: 1.3553243861981161
Energy: 1.2517098506068716
Energy: 1.0439910373690027
Energy: 1.1573563588773215
Energy: 1.1936946524795313
Energy: 1.0418344004136086
Energy: 1.157439381159321
Energy: 1.0362103427533806
Energy: 1.2517463359444785
Energy: 1.1043829284240014
Energy: 1.1443410415092083
Energy: 1.3876133926093033
Energy: 1.1090827720448446
Energy: 1.1440575108710282
Energy: 1.1564963682392206
Energy: 1.163483444483599
Energy: 1.042135000043362
Energy: 1.0442052790322833
Energy: 1.223950840535499
Energy: 1.0416810745052045
Energy: 1.1800596398705432
Energy: 1.2129307667978686
Energy: 1.2125675166801217
Energy: 1.0420854184276216
Energy: 1.33069886007707
Energy: 1.211811581286814
Energy: 1.1799897632639824
Energy: 1.1367003531354574
Energy: 1.1649477752298576
Energy: 1.041740995213016
Energy: 1.1377436253936801
Energy: 1.1651470939311586
Energy: 1.1907384303217126
Energy: 1.1992518827758036
Energy: 1.2291121231667852
Energy: 1.0452805189045529
Energy: 1.1989776338047389
Energy: 1.2292706815382275
Energy: 1.19972808707428
Energy: 1.2113816615731103
Energy: 1.2104410245320465
Energy: 1.2050892470705854
Energy: 1.4174350490648262
Energy: 1.2069561006741147
Energy: 1.1564062756378475
Energy: 1.2328903208073185
Energy: 1.2155041255518289
Energy: 1.1570605775170155
Energy: 1.2014401233551775
Energy: 1.1355432138175972
Energy: 1.4472477476159056
Energy: 1.2070459930424178
Energy: 1.3269477439549457
Energy: 1.4463919327906476
Energy: 1.20715688255314
Energy: 1.2965654030581337
Energy: 1.1995092662487594
Energy: 1.2702418997059537
Energy: 1.270898655353192
Energy: 1.208465695095595
Energy: 1.235227145528792
Energy: 1.2168597074551584
Energy: 1.1019703046787463
Energy: 1.60070877220144
Energy: 1.4560360383766124
Energy: 1.184642023421448
Energy: 1.600381029719339
Energy: 1.2170957075973938

minimum gb energy = 1.0362103427533806 eV
minimum distance =  2.30791235970231 Angstroms
sigma value = 17


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

Energy: 1.9588180455629696
Energy: 1.308665584004459
Energy: 1.3032474274367305
Energy: 1.0734281128687881
Energy: 1.5543551441373211
Energy: 1.0741042327464336
Energy: 1.015855805608269
Energy: 1.1600699111315853
Energy: 1.1599525251541318
Energy: 1.1511867389325017
Energy: 1.160685960432073
Energy: 1.0595873865177294
Energy: 1.4585802265779468
Energy: 1.0092849832424808
Energy: 1.0149415770773107
Energy: 1.1367260749616563
Energy: 1.0163229331335681
Energy: 1.0142718197194425
Energy: 1.140442267703832
Energy: 1.0159423033699555
Energy: 1.016233298007156
Energy: 1.138777983535373
Energy: 1.029308089303331
Energy: 1.13651203524375
Energy: 1.0027927836616903
Energy: 1.0810225104901132
Energy: 1.0601660472425574
Energy: 1.0036235754037415
Energy: 1.0880436704581704
Energy: 1.0521293187426084
Energy: 1.0160978143345107
Energy: 1.0460411844083062
Energy: 1.045004224215847
Energy: 1.063835095691885
Energy: 0.9869212435443819
Energy: 1.0636416440414083
Energy: 1.003062245372572
Energy: 0.9870032760392393
Energy: 0.9871167248623366
Energy: 1.0038641059424767
Energy: 0.9882521383595408
Energy: 1.0355126611765915
Energy: 0.9870054435168049
Energy: 1.072873315576046
Energy: 1.0723909150374706
Energy: 1.0717604612461726
Energy: 1.07188720661903
Energy: 1.084058851814754
Energy: 0.9907473160103499
Energy: 1.0724919208483847
Energy: 1.0788785531585947
Energy: 0.9877617134217318
Energy: 1.0584610607010854
Energy: 0.9869989467510785
Energy: 0.9873541761539533
Energy: 1.046162176997417
Energy: 1.0463434711432318
Energy: 0.9872710251107779
Energy: 1.0453014394522464
Energy: 1.0463364211947423
Energy: 1.2070976329008656
Energy: 1.0579802528493372
Energy: 1.0520032133423867
Energy: 1.0610749037284681
Energy: 1.136435356898682
Energy: 1.062440240646785
Energy: 1.154625400523641
Energy: 1.1358216530108063
Energy: 1.1358714542523098
Energy: 1.135075093274589
Energy: 1.1372244650530692
Energy: 1.1362178737575368
Energy: 1.1346285538476546
Energy: 1.1336527720041671
Energy: 1.1338792895088512
Energy: 1.0496811492272204
Energy: 1.2776096561823265
Energy: 1.1347416240817403
Energy: 0.987789163154557
Energy: 1.1595989763103833
Energy: 1.160968763240437
Energy: 1.0252568382433505
Energy: 1.1601661597045243
Energy: 1.2281554769923972
Energy: 1.1543005926757564
Energy: 1.1331760015167434
Energy: 1.277585672905343
Energy: 1.5194011004174328
Energy: 1.134301154376653
Energy: 1.1892312891769468
Energy: 1.3079558098410953
Energy: 1.1522451903376467
Energy: 1.0833105759428205
Energy: 1.1612163249438003
Energy: 1.152121933459834
Energy: 1.1379187292653765
Energy: 1.121759325243135
Energy: 1.1367660618663997
Energy: 1.2542427147528938
Energy: 1.1777376274882192
Energy: 1.1367497138299063
Energy: 1.2541853319138987

minimum gb energy = 0.9869212435443819 eV
minimum distance =  2.29704279052174 Angstroms
sigma value = 17


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

Energy: 2.0923967943912887
Energy: 1.2442349328566014
Energy: 1.038607657254748
Energy: 1.0354914282587804
Energy: 1.5799174091705703
Energy: 1.0357404897547304
Energy: 0.9908652280010495
Energy: 1.0988461586787992
Energy: 0.9959857553332375
Energy: 1.1086739941485568
Energy: 1.1007865870759383
Energy: 1.0273641761386207
Energy: 1.3552771026213073
Energy: 1.0567090459799002
Energy: 0.9918228322355215
Energy: 1.098315162586539
Energy: 1.0243317149125133
Energy: 0.9912746338517842
Energy: 1.1000496258120303
Energy: 0.9913194020269558
Energy: 0.9915140491947169
Energy: 1.1012791001890578
Energy: 0.9481745740708133
Energy: 0.9910352493345613
Energy: 0.9624131088303794
Energy: 0.9954574333769938
Energy: 0.996734577549725
Energy: 0.9632865705266526
Energy: 0.9940756704200229
Energy: 0.9966166910664814
Energy: 0.9914958551113408
Energy: 0.9476381215622243
Energy: 1.0220980214787727
Energy: 0.985699441493046
Energy: 0.9474412192552447
Energy: 0.9854133036886172
Energy: 1.0031096036525804
Energy: 0.9475104846278627
Energy: 0.9467420017630348
Energy: 0.9532371550961437
Energy: 0.9502939016999649
Energy: 0.9767053784974798
Energy: 1.2473340925585865
Energy: 0.9606433325602384
Energy: 1.0262621561936278
Energy: 1.0456302271781788
Energy: 0.9609535236425805
Energy: 1.0341824067251104
Energy: 0.8881030702594434
Energy: 0.9725104190040734
Energy: 0.8867285627552823
Energy: 0.8897923221641931
Energy: 0.8867650723526158
Energy: 0.8872982918962856
Energy: 0.8871160074447354
Energy: 0.9665438777578943
Energy: 0.9658758011143537
Energy: 0.8871855958407248
Energy: 0.9684223123221752
Energy: 0.9706187561357743
Energy: 0.8869726357256135
Energy: 0.8862524993958237
Energy: 0.9768353153209426
Energy: 0.9701370647539216
Energy: 0.8870511327994692
Energy: 0.9752601728951548
Energy: 0.8899896627247834
Energy: 0.8875606617869416
Energy: 0.8874862416067575
Energy: 0.8913371251936629
Energy: 0.887428060874077
Energy: 0.9399015359103183
Energy: 0.9462583708117882
Energy: 1.031875926449519
Energy: 1.0318069104772916
Energy: 1.083676076438721
Energy: 1.034217807479333
Energy: 0.9771979082447322
Energy: 0.9480622955899668
Energy: 0.9941778543556381
Energy: 0.9769903594629007
Energy: 0.9478126712454485
Energy: 0.9624765661118434
Energy: 0.9469118782731402
Energy: 0.9485655625958215
Energy: 1.0155433379936314
Energy: 1.0106173224873691
Energy: 0.9484779966028766
Energy: 1.0094681294647196
Energy: 0.9936592004516325
Energy: 1.2779398925765668
Energy: 1.0974782303014394
Energy: 0.9909277576009716
Energy: 0.9943460504734212
Energy: 1.0976438654196206
Energy: 0.9978258728087133
Energy: 0.8887536033071233
Energy: 1.0986495101939941
Energy: 1.0987238302262157
Energy: 0.8900934701351989
Energy: 1.0988557240759251
Energy: 1.027667431751005
Energy: 0.965988624984192
Energy: 1.0992816604417766
Energy: 1.0988611658545098
Energy: 0.9667889463166287
Energy: 1.0988579469403055
Energy: 0.9944080675705774
Energy: 1.2457941601760953
Energy: 1.0973128569003994
Energy: 1.0283891658934905
Energy: 1.0990486648666773
Energy: 1.0065379576080573
Energy: 0.9972621620984081
Energy: 1.5395670387284757
Energy: 1.0289433957773155
Energy: 0.9928164714792109
Energy: 1.5078130635935811
Energy: 1.0286616397925439
Energy: 1.1036598318123108
Energy: 1.3639890571278637
Energy: 1.097857926354894
Energy: 1.0303781171276913
Energy: 1.1000918759281453
Energy: 1.1031373294718363
Energy: 1.0984136787669234
Energy: 0.9006255237247405
Energy: 1.1065664150608538
Energy: 1.2022267979477819
Energy: 0.9914499593691866
Energy: 1.1055633959067726
Energy: 0.991119542042776
Energy: 1.070137349830495
Energy: 1.0992825595550193
Energy: 1.0992699909569643
Energy: 1.0710027308724237
Energy: 1.1012402673817074
Energy: 1.2018951877142126
Energy: 1.3621455833647833
Energy: 1.0107018856397112
Energy: 1.0988806574035843
Energy: 1.0999365404391848
Energy: 1.070301346163029
Energy: 1.098166652224236
Energy: 1.0998844944293933
Energy: 1.0592120653171142
Energy: 0.9912307338665927
Energy: 1.0991151648749955
Energy: 1.058908856995382
Energy: 0.9928124373012891
Energy: 1.1676239753488487
Energy: 0.9917017761604082
Energy: 0.9924759972046181
Energy: 1.169097977139885
Energy: 0.9979259493429989
Energy: 1.0246456942709403
Energy: 0.9920214388500054
Energy: 0.9948512268099499
Energy: 0.9940906283513399
Energy: 0.9857141647007455
Energy: 1.0488443163682597
Energy: 0.9850456865916981
Energy: 0.9491195589893496
Energy: 0.9472489774653587
Energy: 0.9473588166686369
Energy: 0.992249561326543
Energy: 0.9491126940873786
Energy: 0.9472721368364377
Energy: 1.2951829101708565
Energy: 0.9838365772458577
Energy: 0.9855473156166091
Energy: 0.9882608936229388
Energy: 0.9465509672348494
Energy: 0.9865563525156005
Energy: 0.8877944095866529
Energy: 0.9608985919147635
Energy: 0.976520367134552
Energy: 0.8878477990994349
Energy: 0.9609388902405746
Energy: 0.9805378187773185
Energy: 0.8881159569015916
Energy: 0.9719125734783373
Energy: 0.977454079648343
Energy: 0.8876542936541619
Energy: 0.9633930094720483
Energy: 0.9402087767480725
Energy: 0.8890057457194923
Energy: 0.9719556491365454
Energy: 0.9788434774464259
Energy: 1.0165258578667993
Energy: 0.9643752997550465
Energy: 0.9719406615766123
Energy: 0.9839004183960085
Energy: 0.8871914644281135
Energy: 0.8876709443780183
Energy: 0.9814629259086924
Energy: 0.8882485612641363
Energy: 0.8875132862955261
Energy: 0.9465111183858509
Energy: 0.9844433839771451
Energy: 0.9868211107730179
Energy: 0.9754075188964952
Energy: 0.8871642567463316
Energy: 0.985408985081692
Energy: 0.9469337854379193
Energy: 0.982662453086459
Energy: 0.9832343989429037
Energy: 0.946714506887657
Energy: 0.9826946533798315
Energy: 0.9852986304366119
Energy: 0.9477588192643669
Energy: 1.009814243434499
Energy: 0.9914806222734104
Energy: 0.9479737029281897
Energy: 1.0096416796377392
Energy: 0.9476378671008395
Energy: 1.3121969742851154
Energy: 0.9824271955334845
Energy: 0.9934612791299211
Energy: 0.9972361855216381
Energy: 0.9657419234202901
Energy: 0.9946730151054353
Energy: 1.0543206904681421
Energy: 1.0997251252730385
Energy: 1.0982892634939647
Energy: 0.9389536652395135
Energy: 1.1021905402030905
Energy: 0.9974198728095625
Energy: 0.9614501284616369
Energy: 1.099604411360322
Energy: 0.993611358835769
Energy: 0.9937710454260743
Energy: 1.2134400414652742
Energy: 0.9935375836014247
Energy: 1.120663080495104
Energy: 1.0986733355072937
Energy: 1.0980194043338842
Energy: 0.9653883338716305
Energy: 1.0992691520250786
Energy: 1.0245579554672095
Energy: 1.2544017318525487
Energy: 1.0281844745582474
Energy: 1.098523256227612
Energy: 1.1047191040132973
Energy: 1.0287546162963987
Energy: 1.0987982291205125
Energy: 1.355501948238643
Energy: 1.0809422772409119
Energy: 1.0979868311659509
Energy: 1.1019808523774532
Energy: 1.1090100155961486
Energy: 1.098408238654752
Energy: 1.0693445122149114
Energy: 1.099561905228048
Energy: 1.099317350213447
Energy: 1.0705673108109426
Energy: 1.1047683873357903
Energy: 1.202365879237249

minimum gb energy = 0.8862524993958237 eV
minimum distance =  2.2868715985659 Angstroms
sigma value = 57


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

Energy: 1.9253381876936482
Energy: 1.173569995369082
Energy: 0.9950683498029304
Energy: 1.0158018695938487
Energy: 1.4844098244884794
Energy: 1.0884678614403422
Energy: 1.2040729889814645
Energy: 1.0594632434503937
Energy: 0.9453472678469949
Energy: 1.0602875486006673
Energy: 1.0523492721857859
Energy: 0.9491429362717121
Energy: 1.2631354838361823
Energy: 0.9899253940893404
Energy: 0.9900982078575697
Energy: 1.1448292195279282
Energy: 0.9899122341576226
Energy: 0.9566503450063599
Energy: 1.051930735870319
Energy: 0.9899570765512365
Energy: 0.9569093298665132
Energy: 1.052722416097836
Energy: 0.9856956224202125
Energy: 0.9563875459022119
Energy: 0.9052308818876029
Energy: 0.943288206958207
Energy: 0.9475423451145785
Energy: 0.9057670707632365
Energy: 0.9481086308871178
Energy: 0.9445133148218617
Energy: 0.8540851115409883
Energy: 0.9123610198918549
Energy: 0.9911109892085433
Energy: 0.9620485090182723
Energy: 0.9118315443700423
Energy: 0.990562603373608
Energy: 1.2173272532639912
Energy: 0.918123016899134
Energy: 0.911954871842618
Energy: 1.0585488482882919
Energy: 0.9186414202074007
Energy: 0.9909954828510195
Energy: 1.1573613489634478
Energy: 0.8881241096027797
Energy: 0.9088981903696245
Energy: 1.0042516072313552
Energy: 0.8890111145207934
Energy: 0.9274561538188673
Energy: 0.844990275787346
Energy: 0.9125755006944235
Energy: 0.8414409610508071
Energy: 0.8468072563751677
Energy: 0.8990130619614022
Energy: 0.8415403359546394
Energy: 0.8419249664027713
Energy: 0.9160260452280785
Energy: 0.9144473460671301
Energy: 0.84226380976026
Energy: 0.9026710276760121
Energy: 0.9051736591652242
Energy: 0.8164222318049268
Energy: 0.8101605033781554
Energy: 0.8997927142326472
Energy: 0.8812159114912073
Energy: 0.8101604262031736
Energy: 0.9040235561458901
Energy: 0.8477617032074949
Energy: 0.8105356411401285
Energy: 0.8100333810906636
Energy: 0.846675610649359
Energy: 0.8175126476130736
Energy: 0.8597435973031454
Energy: 0.9895043764950496
Energy: 0.9605656459440924
Energy: 0.9640926435028663
Energy: 1.048767516454013
Energy: 0.9316667095206428
Energy: 0.9540065969690557
Energy: 0.8105982266706204
Energy: 0.8837868159120666
Energy: 0.8096628413762943
Energy: 0.8127768063639639
Energy: 0.8412898538144211
Energy: 0.8096052587765684
Energy: 0.8101831065303629
Energy: 0.9204562851999015
Energy: 0.9200142314591614
Energy: 0.810219821542464
Energy: 0.92366770143558
Energy: 0.8908508978049013
Energy: 1.14452991822096
Energy: 0.841698930639555
Energy: 0.9159830766978165
Energy: 0.9111160921659438
Energy: 0.841482891104113
Energy: 0.9143862030544707
Energy: 0.8610461490197522
Energy: 0.8417630379005913
Energy: 0.8418197717825093
Energy: 0.9143000809321202
Energy: 0.8508415120544001
Energy: 0.8843538215951623
Energy: 0.9125311976486126
Energy: 0.8878865879277512
Energy: 0.9477152773005004
Energy: 0.9104866681752707
Energy: 0.925256142715288
Energy: 0.9518967534382011
Energy: 0.9117665778796116
Energy: 0.9470986295276616
Energy: 0.911703628142879
Energy: 0.91395156710886
Energy: 0.9801811754893386
Energy: 0.91209991229723
Energy: 1.0569280417957794
Energy: 0.9810354726841559
Energy: 0.9804112369555382
Energy: 1.0573404528137023
Energy: 0.9399553769005488
Energy: 0.951490031752278
Energy: 1.1977181670245653
Energy: 1.1042055734439278
Energy: 0.9506346344500403
Energy: 0.9426470522989003
Energy: 1.0620242424492405
Energy: 0.9509862187729269
Energy: 0.9106711961949822
Energy: 1.0496361306558313
Energy: 0.9115470322482508
Energy: 0.9780730513392638
Energy: 1.062537167577462
Energy: 0.9788023661121976
Energy: 0.9278289467905761
Energy: 1.057853877899423
Energy: 1.0493490606694666
Energy: 0.9291295192965134
Energy: 1.054558758987514
Energy: 1.039735696200303
Energy: 1.171315903430648
Energy: 0.9465946950896725
Energy: 0.938842160748293
Energy: 1.050090393916785
Energy: 0.9624328799201696
Energy: 0.9497406844309992
Energy: 1.2755386588379323
Energy: 0.9760517748970363
Energy: 0.9789206962840903
Energy: 1.2013774406997362
Energy: 0.9764492449007829
Energy: 1.0493845743953
Energy: 1.2716608701727714
Energy: 1.0605590910023943
Energy: 1.0495999794984008
Energy: 1.0547226999298955
Energy: 1.0555675105990097
Energy: 1.1240579335761007
Energy: 0.9558880383345935
Energy: 1.0574191434478624
Energy: 0.9571448397631813
Energy: 0.9900011703614284
Energy: 1.1462002100247282
Energy: 0.9570265144459923

minimum gb energy = 0.8096052587765684 eV
minimum distance =  2.28831535340114 Angstroms
sigma value = 43


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

Energy: 1.8374671994957064
Energy: 1.0401825003298268
Energy: 0.8824562392335495
Energy: 0.8690232248070492
Energy: 1.2959538143069298
Energy: 0.9112542182107525
Energy: 1.0355216053583534
Energy: 0.8299527933387256
Energy: 0.8302548401417664
Energy: 0.9220964662998837
Energy: 0.8287552547553579
Energy: 0.8614448752674436
Energy: 1.0826749926948114
Energy: 0.835285792100775
Energy: 0.8661622824651325
Energy: 0.9221559571880222
Energy: 0.8307083243716901
Energy: 0.823013721717719
Energy: 0.9221746231423535
Energy: 0.8659469399453343
Energy: 0.8227552102544464
Energy: 0.922005346898988
Energy: 0.9527437996304982
Energy: 0.8519977069270722
Energy: 0.8522901402517753
Energy: 0.8142948611186165
Energy: 0.8289104090506255
Energy: 0.8523219496484521
Energy: 0.8186260279970898
Energy: 0.828641109633323
Energy: 0.7269372423125396
Energy: 0.8140651280537514
Energy: 0.8643511690135495
Energy: 0.8169074677077744
Energy: 0.8141545340909219
Energy: 0.8325491396828805
Energy: 1.0453009830491011
Energy: 0.8145584759134525
Energy: 0.8140894869897239
Energy: 0.912839751154123
Energy: 0.8148460866110897
Energy: 0.877070127487666
Energy: 0.9946225499605383
Energy: 0.8134854701375172
Energy: 0.798443482433788
Energy: 0.8021974258912089
Energy: 0.8109184393357132
Energy: 0.8315445829593772
Energy: 0.7543821308960593
Energy: 0.829788877849598
Energy: 0.7511130731825973
Energy: 0.7566018197360737
Energy: 0.7752613772612446
Energy: 0.7514191123018784
Energy: 0.7522198268444028
Energy: 0.7825362168889161
Energy: 0.7752557961235544
Energy: 0.7518271996787602
Energy: 0.7834045443017427
Energy: 0.7704862486370916
Energy: 0.6963823385838079
Energy: 0.7113975324959869
Energy: 0.711367756303115
Energy: 0.8032584056910507
Energy: 0.7118587212246543
Energy: 0.8130902944053702
Energy: 0.7515909817804439
Energy: 0.7117847484874157
Energy: 0.7115230607190509
Energy: 0.7517098625342398
Energy: 0.7119968424121297
Energy: 0.7618661815775659
Energy: 0.9668615045554496
Energy: 0.7825654767666972
Energy: 0.7640668881715444
Energy: 0.969243059710558
Energy: 0.7328638701785243
Energy: 0.7691250434856368
Energy: 0.6880858965408624
Energy: 0.8682083179859678
Energy: 0.687176116150595
Energy: 0.6898772614838411
Energy: 0.7146071142808896
Energy: 0.6877161795919023
Energy: 0.6876869816130687
Energy: 0.7334026600723277
Energy: 0.7326745434142613
Energy: 0.6877274469859572
Energy: 0.7821387496900747
Energy: 0.7333497438589023
Energy: 0.9580932780987557
Energy: 0.6763105184633708
Energy: 0.6756314508452087
Energy: 0.733546189919511
Energy: 0.676452043323042
Energy: 0.7420996482756966
Energy: 0.691968824093385
Energy: 0.6761688854001734
Energy: 0.6758621815801286
Energy: 0.9642013671123784
Energy: 0.6763351993138098
Energy: 0.7387192177731293
Energy: 0.6759416985655423
Energy: 0.7713522339411565
Energy: 0.781262722922416
Energy: 0.8284761698816359
Energy: 0.7729406793823984
Energy: 0.7416797391753894
Energy: 0.6763068112294166
Energy: 0.9634765061244043
Energy: 0.6759920418988481
Energy: 0.6787008057239783
Energy: 0.9672944393364991
Energy: 0.6762904325907447
Energy: 0.8338888323487442
Energy: 0.7776626356839773
Energy: 0.778160693504674
Energy: 0.9625647328907145
Energy: 0.7565514619101287
Energy: 0.7482390750958738
Energy: 0.7158591057810456
Energy: 0.6876410695746865
Energy: 0.6868645326080883
Energy: 0.7319222044527616
Energy: 0.687742615232356
Energy: 0.7516042884838401
Energy: 0.6783816507264058
Energy: 0.6876496793144562
Energy: 0.6870094370993949
Energy: 0.7433962073572473
Energy: 0.6878024486803616
Energy: 0.7787497710391923
Energy: 0.7112703688732852
Energy: 0.7417952255698942
Energy: 0.7396744074825623
Energy: 0.7115855615189697
Energy: 0.773469586395856
Energy: 0.7471955228457461
Energy: 0.7118164239528357
Energy: 0.7537245282409875
Energy: 0.711561980290469
Energy: 0.7140057574834971
Energy: 0.7519591338905337
Energy: 0.7117894702656198
Energy: 0.9770887965984506
Energy: 0.8016924707356131
Energy: 0.7546649459788969
Energy: 0.979498795017809
Energy: 0.7730745250782541
Energy: 0.7553957957419378
Energy: 0.817943138353091
Energy: 0.751435300869105
Energy: 0.7513202669246557
Energy: 0.9011689557696003
Energy: 0.7520459013351468
Energy: 0.7863022367094461
Energy: 0.7132513961423393
Energy: 0.7513040982109933
Energy: 0.7513546395073785
Energy: 0.8099221680467242
Energy: 0.7512253569920759
Energy: 0.8229836569520743
Energy: 0.7906749065490946
Energy: 0.790312993647186
Energy: 0.7844862161427505
Energy: 0.8147615009534869
Energy: 0.7990564458850383
Energy: 0.8143805394170456
Energy: 0.817171584033357
Energy: 0.8480263096875107
Energy: 0.8143006149988959
Energy: 0.8191216015343246
Energy: 0.9002103401111661
Energy: 0.8146855982575869
Energy: 1.0231681048068593
Energy: 0.8263887718325905
Energy: 0.8506783233673986
Energy: 0.9111201593589293
Energy: 0.823922914075465
Energy: 0.8503553770022199
Energy: 1.048635528302261
Energy: 0.8299258183356361
Energy: 0.8307597705050813
Energy: 0.8304246612940379
Energy: 0.8293178308344564
Energy: 0.8235255597845884
Energy: 0.7534524902503175
Energy: 0.9222457784775941
Energy: 0.8613424854096616
Energy: 0.8276889738806559
Energy: 0.9221341867891812
Energy: 0.8520099609935996
Energy: 0.929245142197894
Energy: 0.9230832301223738
Energy: 0.9222472049846144
Energy: 0.8308711554995349
Energy: 0.9261902398252281
Energy: 0.909819168899223
Energy: 1.0528343948025591
Energy: 0.8515769381310268
Energy: 0.8491174271470804
Energy: 0.921625418500015
Energy: 0.9871248253683477
Energy: 0.921928176796989
Energy: 1.082378948674718
Energy: 0.853733195339609
Energy: 0.8627009726470908
Energy: 0.92227827882644
Energy: 0.8507520626779758
Energy: 0.8624368239896333
Energy: 1.0792315667419168
Energy: 0.9223623024147766
Energy: 0.922394301874728
Energy: 0.9240938684502998
Energy: 0.9264003805887662
Energy: 0.954720688260808

minimum gb energy = 0.6756314508452087 eV
minimum distance =  2.2739245587933 Angstroms
sigma value = 81


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

Energy: 0.04895475054370372
Energy: 0.9702217215123368
Energy: 0.04978468611265606
Energy: 0.051967504723065036
Energy: 0.04960802308999381
Energy: 0.049665303230805966
Energy: 0.10374744441432059
Energy: 0.04997566002527415
Energy: 0.05019200017674453
Energy: 0.10218659677670534
Energy: 0.05204337959909934
Energy: 0.05019555951250425
Energy: 0.10124686186120822
Energy: 0.0498061164652119
Energy: 0.049748775845874345
Energy: 0.10120348721933947
Energy: 0.049536724804367466
Energy: 0.10187873981711876
Energy: 0.053888119910517805
Energy: 0.04969266949350683
Energy: 0.04930950603905885
Energy: 0.05246949004139652
Energy: 0.04970250492275819
Energy: 0.10309705298258921
Energy: 0.1022813007857379
Energy: 0.10127992082325199
Energy: 0.10119641755622838
Energy: 0.10321449388723035
Energy: 0.10118898503040313
Energy: 0.10123986437453146
Energy: 0.05075392727486063
Energy: 0.05011258800724715
Energy: 0.04965439419250754
Energy: 0.05257321016288165
Energy: 0.05035120359764059
Energy: 0.04962491183922357
Energy: 0.10123373300506673
Energy: 0.050012755737108366
Energy: 0.05016037679878611
Energy: 0.10107355399380606
Energy: 0.049865777532836636
Energy: 0.050196180839297236
Energy: 0.1011360876796756
Energy: 0.049556679754762384
Energy: 0.04990340207957493
Energy: 0.10124164596049336
Energy: 0.04960960215894723
Energy: 0.10281929669013797
Energy: 0.05190866546348989
Energy: 0.04967299694908148
Energy: 0.10295963186521599
Energy: 0.0531544334943816
Energy: 0.04983870229131881
Energy: 0.10432047854714387
Energy: 0.04969906154259333
Energy: 0.10100112795175364
Energy: 0.10108369130264394
Energy: 0.04937573278722789
Energy: 0.1012103189941417
Energy: 0.10070403694096808

minimum gb energy = 0.04895475054370372 eV
minimum distance =  2.46767810625336 Angstroms
sigma value = 3


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

Energy: 0.8778028132976089
Energy: 0.8770543656896298
Energy: 0.8607388988677827
Energy: 0.9018242034506695
Energy: 0.8384177480850582
Energy: 0.9730043782612733
Energy: 0.8608525380415053
Energy: 0.8946040007863114
Energy: 0.9097358885679402
Energy: 0.863950280935375
Energy: 0.8969272807192128
Energy: 0.8694419289755287
Energy: 0.9185971358124572
Energy: 0.8891400190184754
Energy: 0.8826022470549448
Energy: 0.8902533617027389
Energy: 0.8293855011845678
Energy: 0.9046620806242561
Energy: 0.8372108396809286
Energy: 0.8830691466249552
Energy: 0.8767995602381572
Energy: 0.8372916942535691
Energy: 0.7653560114138367
Energy: 0.8954728844018038
Energy: 0.7758013653805366
Energy: 0.9106989983831534
Energy: 0.9093833813611345
Energy: 0.7759273807608272
Energy: 0.8979772081096533
Energy: 0.909506862169544
Energy: 0.8391635815789943
Energy: 0.8688757690518337
Energy: 0.895682466832387
Energy: 0.8566806641893454
Energy: 0.8685341890542129
Energy: 0.8921115047529179
Energy: 0.845292290478845
Energy: 0.8580441067069884
Energy: 0.8576641446424311
Energy: 0.845249320706734
Energy: 0.8617721934950943
Energy: 0.8633705599970213
Energy: 0.8364190966602785
Energy: 0.8980794165743038
Energy: 0.8628323003066499
Energy: 0.8363830332874468
Energy: 0.8888151391209915
Energy: 0.8169377656234884
Energy: 0.8766762325149382
Energy: 0.8602350761874031
Energy: 0.8837487676744812
Energy: 0.8851428231836872
Energy: 0.8093600404248837
Energy: 0.8845423978400636
Energy: 0.8147716938750429
Energy: 0.7845940487148945
Energy: 0.7846204532374703
Energy: 0.8150572213802054
Energy: 0.7891326693134844
Energy: 0.8203874638145953
Energy: 0.8341791267074746
Energy: 0.9082085622584716
Energy: 0.9357731448565249
Energy: 0.89035683602712
Energy: 0.8361338261331349
Energy: 0.8915017977178731
Energy: 0.7380187745950016
Energy: 0.8688523382615035
Energy: 0.8683091349591955
Energy: 0.7353680836963747
Energy: 0.8694907495651928
Energy: 0.7354294514302324
Energy: 0.7375462603325931
Energy: 0.8612538769543797
Energy: 0.8926668625802502
Energy: 0.7376618251449903
Energy: 0.8610183540309433
Energy: 0.7409573734482521
Energy: 0.836028707870361
Energy: 0.85239164871677
Energy: 0.8429323571440367
Energy: 0.8542928656316703
Energy: 0.7684517464313918
Energy: 0.8483714945861044
Energy: 0.817856728629476
Energy: 0.7022585367317947
Energy: 0.7022166803032154
Energy: 0.8170842420579526
Energy: 0.7053648721298427
Energy: 0.7024958223779478
Energy: 0.81478490000078
Energy: 0.8549941699686556
Energy: 0.8548398172544676
Energy: 0.8159388771854913
Energy: 0.8055085456535337
Energy: 0.8679219615058513
Energy: 0.6857324656457042
Energy: 0.8291296508463839
Energy: 0.6900644804066507
Energy: 0.6853294042552441
Energy: 0.8430839630243299
Energy: 0.684495865924668
Energy: 0.684465183205722
Energy: 0.8479761784137138
Energy: 0.848263170320101
Energy: 0.684568564801645
Energy: 0.8457926403474118
Energy: 0.6870479167267692
Energy: 0.8026384767388396
Energy: 0.7536050643949813
Energy: 0.8481401878714155
Energy: 0.8459096303165368
Energy: 0.774020841492536
Energy: 0.8472172878297959
Energy: 0.8209359925835071
Energy: 0.6843260499094639
Energy: 0.6842725132109896
Energy: 0.8227295880576341
Energy: 0.6870423207843513
Energy: 0.6845371023595201
Energy: 0.8042827827034543
Energy: 0.8456576346243267
Energy: 0.8310413131874915
Energy: 0.8045989924018165
Energy: 0.8163671473682811
Energy: 0.8339370693629252
Energy: 0.7048163655397851
Energy: 0.8525144498174622
Energy: 0.7649513817231814
Energy: 0.7042906168354216
Energy: 0.8159229655643576
Energy: 0.7027651898840583
Energy: 0.7027114470396487
Energy: 0.8520654596047655
Energy: 0.85297436409121
Energy: 0.7027004350083018
Energy: 0.8536623317206653
Energy: 0.8508977270712428
Energy: 0.8212293759464605
Energy: 0.7410700544063701
Energy: 0.7389148999519828
Energy: 0.8719820546680725
Energy: 0.7398116047204798
Energy: 0.8728832657462227
Energy: 0.8520903665306472
Energy: 0.7359490982040046
Energy: 0.7358882837576803
Energy: 0.8374859244475962
Energy: 0.7395756647692928
Energy: 0.7359953289116214
Energy: 0.8412581381722413
Energy: 0.9085268083710061
Energy: 0.9087128937196525
Energy: 0.8419151939476172
Energy: 0.8644006417579759
Energy: 0.9376863625337475
Energy: 0.793246995505036
Energy: 0.8485350095733266
Energy: 0.8484390209088897
Energy: 0.7855349773955245
Energy: 0.8519793137029997
Energy: 0.7862517564792961
Energy: 0.7524759848099648
Energy: 0.8906505946872744
Energy: 0.8894163029741083
Energy: 0.7524288680605878
Energy: 0.8885707071830796
Energy: 0.8854490351079399
Energy: 0.8447889958006832
Energy: 0.8321943888330041
Energy: 0.8428854811847856
Energy: 0.9062587496798211
Energy: 0.8315495313597453
Energy: 0.9071055714554719
Energy: 0.7837955010561803
Energy: 0.850394672655481
Energy: 0.8482480316559151
Energy: 0.7833601684062562
Energy: 0.8506208298342092
Energy: 0.8528548827570863
Energy: 0.8533509499930247
Energy: 0.8715278102923794
Energy: 0.871651069537155
Energy: 0.8527060824513519
Energy: 0.9027141914833834
Energy: 0.87752933841053
Energy: 0.9281601210080493
Energy: 0.8762587473389103
Energy: 0.8888729376195323
Energy: 0.9006991126629929
Energy: 0.7962822098355712
Energy: 0.909224642318835
Energy: 0.7951578250103962
Energy: 0.83990996356535
Energy: 0.83942347833141
Energy: 0.7948859131647795
Energy: 0.8430003378472859
Energy: 0.8645479371110839

minimum gb energy = 0.6842725132109896 eV
minimum distance =  2.2978840485724 Angstroms
sigma value = 67


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

Energy: 1.1547509516907726
Energy: 1.0688274415984589
Energy: 1.1652835787915716
Energy: 1.11433543332475
Energy: 1.2769882408224127
Energy: 1.094321187560403
Energy: 1.0467952406322956
Energy: 1.0755772359327598
Energy: 1.0757343360835112
Energy: 1.049253472779674
Energy: 1.0808550626215638
Energy: 1.0764833670094491
Energy: 1.1233276172175746
Energy: 1.1374952683789776
Energy: 1.0724707035492775
Energy: 1.0827245551883524
Energy: 1.1588688484189904
Energy: 1.0728354227528325
Energy: 1.013075926070605
Energy: 1.0723364049602173
Energy: 1.073611172597376
Energy: 1.0150761595667073
Energy: 1.0864360486389202
Energy: 1.073127627365117
Energy: 1.0002517550570091
Energy: 1.1088593094266048
Energy: 1.0753911522973951
Energy: 1.0001516501351826
Energy: 1.0803034252470463
Energy: 1.074656408827244
Energy: 1.0812237820248907
Energy: 1.0497587219260225
Energy: 1.1473150082147145
Energy: 0.9269762353369461
Energy: 1.0506771957005883
Energy: 1.1475410938212538
Energy: 1.0088778067934547
Energy: 1.0035029835612497
Energy: 1.0028754001931361
Energy: 1.009468280392386
Energy: 1.089908599385054
Energy: 1.0030458158187532
Energy: 1.0053045253951676
Energy: 1.08432745301752
Energy: 1.0024879199347487
Energy: 1.0029847488702737
Energy: 1.0778664876278716
Energy: 1.0027411653097853
Energy: 1.0345021357534745
Energy: 1.0227532375581356
Energy: 1.0696974086324325
Energy: 1.0333892877586195
Energy: 0.919322208700509
Energy: 1.0503090895691747
Energy: 1.0374819855284299
Energy: 0.9294853503983777
Energy: 0.9213764916934221
Energy: 1.03726540479958
Energy: 0.9251935661553198
Energy: 0.9211876983038911
Energy: 1.0322118460446437
Energy: 1.0448044409534287
Energy: 1.0664899647957817
Energy: 0.8806030468011617
Energy: 1.0053492031956945
Energy: 1.067631659057167
Energy: 0.8776188934471792
Energy: 1.0441408610816834
Energy: 0.9749966333559338
Energy: 0.8760095392020791
Energy: 1.0461426178755793
Energy: 0.8752751429005273
Energy: 0.878803305887208
Energy: 1.0488515690382274
Energy: 1.035961747967272
Energy: 0.8781803441916399
Energy: 1.0474303279093877
Energy: 0.8779506618464546
Energy: 1.0366272686352505
Energy: 1.025497367511463
Energy: 1.0360535933736537
Energy: 0.8773586565325489
Energy: 1.0245747000620269
Energy: 1.0474369265759775
Energy: 1.0011995146691692
Energy: 0.8829245329624753
Energy: 0.8775165114008354
Energy: 1.0029536104917238
Energy: 0.8794362084117268
Energy: 0.8777244409035518
Energy: 1.0139157753434307
Energy: 1.0392946152857685
Energy: 1.0472501273545571
Energy: 0.9887022265999301
Energy: 0.95331116775704
Energy: 1.0447836952990741
Energy: 0.9259664831815857
Energy: 1.0591061495176224
Energy: 0.9641060150380664
Energy: 0.9266125121997788
Energy: 0.9649716332908969
Energy: 0.9235503900184338
Energy: 0.9196369100657513
Energy: 1.0605858720141152
Energy: 1.063918137910508
Energy: 0.9203382410506153
Energy: 1.0466873066062152
Energy: 0.9193872988743221
Energy: 1.0464271181560796
Energy: 1.0312073588107717
Energy: 1.1086714538803977
Energy: 0.8958902912064246
Energy: 1.0309250910578052
Energy: 1.1092734279565601
Energy: 1.0031651831565325
Energy: 1.0348711323013455
Energy: 1.0057376286888917
Energy: 1.0032505444937854
Energy: 1.006876331924702
Energy: 1.0027749098261705
Energy: 1.007157807074937
Energy: 1.0520224729014265
Energy: 1.0492542321346787
Energy: 1.035755273875461
Energy: 1.110820445020685
Energy: 1.047004153725194
Energy: 1.1223553796731824
Energy: 1.1003809548577417
Energy: 1.046655143078964
Energy: 1.082419233407888
Energy: 1.1016870440082072
Energy: 1.050875262974919
Energy: 1.0440642520898464
Energy: 1.077966084683984
Energy: 1.0040432992610293
Energy: 1.0443484053975283
Energy: 1.0884632507365612
Energy: 1.0024387324606177

minimum gb energy = 0.8752751429005273 eV
minimum distance =  2.28843576336829 Angstroms
sigma value = 33


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

Energy: 2.0015193497025106
Energy: 1.2187022471694444
Energy: 1.218014892718904
Energy: 1.2917790634997477
Energy: 1.2023961044938476
Energy: 1.1892099836103613
Energy: 1.2235839545635652
Energy: 1.2115258889270726
Energy: 1.2088075767910589
Energy: 1.2025367657430341
Energy: 1.2190339529103837
Energy: 1.2081840864840057
Energy: 1.2450011545872788
Energy: 1.2029734811081068
Energy: 1.204893507575931
Energy: 1.2009464911257686
Energy: 1.110911622943836
Energy: 1.204740689772364
Energy: 1.200787389526927
Energy: 1.2050396608566731
Energy: 1.2045114764547529
Energy: 1.1924478885381886
Energy: 1.0915187550628143
Energy: 1.2041208388959899
Energy: 1.094683312234724
Energy: 1.2095087160821003
Energy: 1.208168698956937
Energy: 1.0949207295200152
Energy: 1.194434274099774
Energy: 1.2081317500560174
Energy: 1.1740331545144231
Energy: 1.190924628649185
Energy: 1.2176952905793534
Energy: 0.9980018996072157
Energy: 1.1922471658597276
Energy: 1.1923743617305653
Energy: 1.095842943886136
Energy: 1.2126185485092622
Energy: 1.2009855533045894
Energy: 1.0954975740908275
Energy: 1.2105531351312333
Energy: 1.112718419423063
Energy: 1.0954616160169273
Energy: 0.9999262786977158
Energy: 1.1141710055506047
Energy: 1.0953711672649966
Energy: 0.9996593407937461
Energy: 1.1129789356741644
Energy: 1.1400430538916353
Energy: 1.1154986934946902
Energy: 1.1763829880630297
Energy: 1.1968290989463592
Energy: 1.0894339790015222
Energy: 1.1805609849371883
Energy: 1.144589404989285
Energy: 0.999892912907568
Energy: 0.9996903917981639
Energy: 1.1454208278515923
Energy: 1.0020352747589012
Energy: 0.9996705157528264
Energy: 1.141118204228625
Energy: 1.1065947523178126
Energy: 1.1685533210175743
Energy: 1.0032165679748681
Energy: 1.1747342086752208
Energy: 1.1697463905905243
Energy: 0.9991464111070408
Energy: 1.0712631704761726
Energy: 0.9996997156560729
Energy: 0.9992372390927343
Energy: 1.1551999177045142
Energy: 0.9997802666817203
Energy: 0.9989069827095374
Energy: 1.1758769008454488
Energy: 0.9994462359346467
Energy: 0.9990126043811925
Energy: 1.178747723872787
Energy: 0.9994789709841543
Energy: 1.1444380167591603
Energy: 1.178186326991054
Energy: 1.1907807805820174
Energy: 0.9720327435502547
Energy: 1.141726947398163
Energy: 1.1835552906107125
Energy: 1.0699683432053968
Energy: 1.1126788402053278
Energy: 1.1125387413756527
Energy: 1.069954064766935
Energy: 1.0979049111670554
Energy: 1.1124831749893997
Energy: 1.1733375946470121
Energy: 1.193978883313861
Energy: 1.1934330219246956
Energy: 1.1975480573771864
Energy: 1.0245674115777896
Energy: 1.206714296528252
Energy: 1.2546417829549366
Energy: 1.0251545712613224
Energy: 1.1944893173147775
Energy: 1.2015660802521047
Energy: 1.0243413766122358
Energy: 1.1944498894147286
Energy: 1.307551843273149
Energy: 1.2091996148036446
Energy: 1.1978542169454527
Energy: 1.1982941270644143
Energy: 1.2189029684869435
Energy: 1.2118955454345015
Energy: 1.1871398363667285
Energy: 1.302562556876117
Energy: 1.3264522204820584
Energy: 1.024586876663808
Energy: 1.3024200471858816
Energy: 1.1797630201842877
Energy: 1.1598783058873563
Energy: 1.2107333384847263
Energy: 1.2090549072311954
Energy: 1.1603392492687508
Energy: 1.2141374573925212
Energy: 1.2079004921539562
Energy: 1.2466742561964153
Energy: 1.2049120596347087
Energy: 1.204494532691699
Energy: 1.1903292048445875
Energy: 1.0921308497096023
Energy: 1.2043877960039144
Energy: 1.192717933334245
Energy: 1.2029120898647698
Energy: 1.204550276507221
Energy: 1.1850280889205658
Energy: 1.091603969738152
Energy: 1.2045173507372842
Energy: 1.0949101879143022
Energy: 1.211452286321312
Energy: 1.2081254186322166
Energy: 1.0948713387562226
Energy: 1.213506983030752
Energy: 1.2083298001465446
Energy: 1.1699944511138534
Energy: 1.2933493522031527
Energy: 1.2933448674335737
Energy: 1.1072130173802792
Energy: 1.1917182592047681
Energy: 1.1898257840370925
Energy: 1.1146619072297297
Energy: 1.2098721274034427
Energy: 1.208686348981066
Energy: 1.0954671236530438
Energy: 1.209310981671405
Energy: 1.1113417917731665
Energy: 1.0956345776769976
Energy: 1.1096341307329005
Energy: 1.1135480827803763
Energy: 1.0955403834594806
Energy: 0.9990007324730161
Energy: 1.1128342763658734
Energy: 1.1436303901412754
Energy: 1.177997700865454
Energy: 1.1762574582691256
Energy: 1.1617947657970047
Energy: 1.0907649882492652
Energy: 1.1761872203782324
Energy: 1.140576125234906
Energy: 1.00000869538884
Energy: 0.9995281380123445
Energy: 1.1426629887558324
Energy: 1.0033258785485295
Energy: 0.9996529747667
Energy: 1.1416181218752843
Energy: 1.1732989894722778
Energy: 1.1685918432729683
Energy: 0.9991834843024584
Energy: 1.092831819180887
Energy: 1.1690739206810565
Energy: 0.9989944779477575
Energy: 1.1683239844915547
Energy: 1.166473081390887
Energy: 0.9990047901618678
Energy: 1.15484308193108
Energy: 0.9998395679771241
Energy: 0.9987105660189124
Energy: 1.1762370673742586
Energy: 0.9997083104799455
Energy: 0.998890178716434
Energy: 1.1152939510313327
Energy: 0.9993363310052789
Energy: 1.146552373536679
Energy: 1.113836538009336
Energy: 1.1776291132150989
Energy: 1.2160223314632388
Energy: 1.1418126096122885
Energy: 1.1788853389058538
Energy: 1.0694425551062003
Energy: 1.0965633869341835
Energy: 1.1130689564261917
Energy: 1.0687634077651647
Energy: 1.098340046921945
Energy: 1.1126194774631137
Energy: 1.0870859838961737
Energy: 1.1295689988737299
Energy: 1.200239026996701
Energy: 1.1061716925749545
Energy: 1.0245929284364004
Energy: 1.2080423470385733
Energy: 1.265006786837194
Energy: 1.0250265108272587
Energy: 1.195247844373136
Energy: 1.2658107897622448
Energy: 1.181622526753824
Energy: 1.1958742075470805
Energy: 1.2907861784835708
Energy: 1.2105624201146712
Energy: 1.1966219321799665
Energy: 1.1986388473166767
Energy: 1.2127069402295603
Energy: 1.2122628782498217
Energy: 1.232271112645932
Energy: 1.2015700047532012
Energy: 1.2235565330917342
Energy: 1.0237164650223078
Energy: 1.2008218552325518
Energy: 1.1811919649416807

minimum gb energy = 0.9720327435502547 eV
minimum distance =  2.26103216278293 Angstroms
sigma value = 41


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

Energy: 1.7929515241282643
Energy: 1.467516265352638
Energy: 1.4698211137973647
Energy: 1.1556191269279854
Energy: 1.4319147686316944
Energy: 1.4734270319847178
Energy: 1.2615950431945384
Energy: 1.3452415960299038
Energy: 1.3467543045780426
Energy: 1.3209195207948736
Energy: 1.3453822590561277
Energy: 1.342588847624494
Energy: 1.4281469965331854
Energy: 1.1989534975476999
Energy: 1.3370001830557972
Energy: 1.3294053220142996
Energy: 1.2121449658061598
Energy: 1.3314728659106594
Energy: 1.3267332644245748
Energy: 1.2858410284819235
Energy: 1.2775459154547206
Energy: 1.3286022667020352
Energy: 1.1981340431371152
Energy: 1.3404702368367396
Energy: 1.203294102353426
Energy: 1.3458762535036717
Energy: 1.3499272740967814
Energy: 1.2039718368700116
Energy: 1.3453177539601353
Energy: 1.2882230819361227
Energy: 1.3593165014177175
Energy: 1.3867133948740544
Energy: 1.3848572051115027
Energy: 1.226453230494011
Energy: 1.3816309407914575
Energy: 1.2865587342795464
Energy: 1.200043468808863
Energy: 1.3431094439171845
Energy: 1.1735507897188457
Energy: 1.213415694424524
Energy: 1.3422532576919222
Energy: 1.2209266056183312
Energy: 1.2017919279305096
Energy: 1.164804998349156
Energy: 1.2207652901605917
Energy: 1.201927961964963
Energy: 1.2223247448845052
Energy: 1.2006592459304375
Energy: 1.2863972207614123
Energy: 1.2234849515532549
Energy: 1.2247726676019675
Energy: 1.296264137198399
Energy: 1.2563052090376268
Energy: 1.2218465179021085
Energy: 1.3386112119346363
Energy: 1.2183674286527246
Energy: 1.2157499897679391
Energy: 1.2361682295698584
Energy: 1.2153254307235217
Energy: 1.1618433788875533
Energy: 1.3520225169356275
Energy: 1.215600532706968
Energy: 1.3202211109856692
Energy: 1.357738397021579
Energy: 1.1355021776508691
Energy: 1.352200907464167
Energy: 1.4256172354416743
Energy: 1.1344989811534194
Energy: 1.3050015326742719
Energy: 1.4249259192385895
Energy: 1.1335940786281362
Energy: 1.283777397985535
Energy: 1.4298642895653193
Energy: 1.3457592819980886
Energy: 1.319553696008882
Energy: 1.3363589024935905
Energy: 1.338941228917941
Energy: 1.351778187867404
Energy: 1.4088237101708811
Energy: 1.3310414041074385
Energy: 1.3812316302999033
Energy: 1.132897527616668
Energy: 1.326443390816509
Energy: 1.356822588549531

minimum gb energy = 1.132897527616668 eV
minimum distance =  2.27412327246524 Angstroms
sigma value = 11


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

Energy: 2.209839753628489
Energy: 1.659570164223217
Energy: 1.6464874963885854
Energy: 1.50257852173101
Energy: 1.4938942918450737
Energy: 1.517917129760564
Energy: 1.5536822008163436
Energy: 1.3536228330471327
Energy: 1.3557929051280455
Energy: 1.4340207581865005
Energy: 1.345818899615401
Energy: 1.36681491088176
Energy: 1.624332759241916
Energy: 1.3556286497338612
Energy: 1.3574402695313483
Energy: 1.6247518394448393
Energy: 1.3414670909269824
Energy: 1.3595028185497535
Energy: 1.4395229073424278
Energy: 1.3448652896955102
Energy: 1.3621065696164583
Energy: 1.4538417393641103
Energy: 1.327676912773542
Energy: 1.3754766905623328
Energy: 1.4371356912503606
Energy: 1.3678594868439022
Energy: 1.3682295377304368
Energy: 1.4313180475344536
Energy: 1.3577451005688614
Energy: 1.3657845059680847
Energy: 1.4310278418112832
Energy: 1.4185888417156913
Energy: 1.3818162096360944
Energy: 1.3620431666790838
Energy: 1.418256778014827
Energy: 1.3803869210665856
Energy: 1.4115135873365598
Energy: 1.365566538338674
Energy: 1.3902586817776423
Energy: 1.4155452119713012
Energy: 1.3646541683851547
Energy: 1.4181121408480322
Energy: 1.372153225666708
Energy: 1.3779117353266432
Energy: 1.3697467139745572
Energy: 1.3486838328561905
Energy: 1.436587721833758
Energy: 1.366231706091415
Energy: 1.334031320726071
Energy: 1.461260960164868
Energy: 1.4230665347716134
Energy: 1.334612390961981
Energy: 1.4606085142579361
Energy: 1.3419569936807516
Energy: 1.3333537322392361
Energy: 1.4555257613738317
Energy: 1.4096998445691913
Energy: 1.3395071424785006
Energy: 1.5849888111090138
Energy: 1.3418838901498424
Energy: 1.3624209520311361
Energy: 1.3748851510517124
Energy: 1.366919642186864
Energy: 1.3460825287685065
Energy: 1.3712997107415223
Energy: 1.3664360566875164
Energy: 1.3958549991207607
Energy: 1.3515721253306592
Energy: 1.4268749239747167
Energy: 1.390295270572624
Energy: 1.3523614643339676
Energy: 1.4346835469266157
Energy: 1.328953978464882
Energy: 1.435256864182375
Energy: 1.4291873931483878
Energy: 1.330205552996649
Energy: 1.4335217038819983
Energy: 1.3588821141875305
Energy: 1.3812753424641702
Energy: 1.5760125757534171
Energy: 1.408613232884386
Energy: 1.3494029344809502
Energy: 1.6261672313477944
Energy: 1.3721872687969536
Energy: 1.3216244519070064
Energy: 1.4400326511013173
Energy: 1.3919145059984717
Energy: 1.3218280319046283
Energy: 1.4320393282887522
Energy: 1.3476061704346827
Energy: 1.3123806911023008
Energy: 1.3387506947565726
Energy: 1.338470246681301
Energy: 1.3139996310888535
Energy: 1.3549004205889446
Energy: 1.338595980854302
Energy: 1.3441307441935473
Energy: 1.3927078000446538
Energy: 1.35794708989121
Energy: 1.3407665992461295
Energy: 1.3965572454399229
Energy: 1.3748691771290642
Energy: 1.7509451848696276
Energy: 1.487675418879172
Energy: 1.4875926359415677
Energy: 1.3654066520884132
Energy: 1.4958202290349332
Energy: 1.3992573335001486
Energy: 1.3698606406854013
Energy: 1.3926827607676568
Energy: 1.3609058282483866
Energy: 1.3715937482527236
Energy: 1.4020181297046086
Energy: 1.373770537952382
Energy: 1.443622998821356
Energy: 1.3342882845614594
Energy: 1.3355969522953555
Energy: 1.4112873959627386
Energy: 1.3335741913784724
Energy: 1.37437024047767
Energy: 1.4768673160705552
Energy: 1.3398604163410335
Energy: 1.3697228415156333
Energy: 1.478750539455176
Energy: 1.3158617181443557
Energy: 1.3798876513144729
Energy: 1.3663539148231154
Energy: 1.4156260372057234
Energy: 1.3683671257526744
Energy: 1.3316635122995757
Energy: 1.4118210756848026
Energy: 1.3809347737339774
Energy: 1.3793185470553349
Energy: 1.4109842921378488
Energy: 1.4160889946532744
Energy: 1.3119893466253982
Energy: 1.416849775802549
Energy: 1.3595482962190364
Energy: 1.4887721085972832
Energy: 1.3786884467632663
Energy: 1.3781905499256806
Energy: 1.3739828252294846
Energy: 1.3714699079748054
Energy: 1.3587656191414716
Energy: 1.5072247208188272
Energy: 1.37500652111632
Energy: 1.381025984639084
Energy: 1.5071392371710528
Energy: 1.3647711680913244
Energy: 1.4628094063655808
Energy: 1.4375986229574953
Energy: 1.3517343161054503
Energy: 1.3748490967037046
Energy: 1.3946685343796947
Energy: 1.3407386778194919
Energy: 1.361964296850997
Energy: 1.4276859748566844
Energy: 1.3398558130641909
Energy: 1.3381078663215438
Energy: 1.4393521372585565
Energy: 1.32276379766082
Energy: 1.337938907387419
Energy: 1.444295637658936
Energy: 1.3349171833802163
Energy: 1.407254488937477
Energy: 1.4370790086285097
Energy: 1.3274196597136287
Energy: 1.348171617695505
Energy: 1.6086995050114707
Energy: 1.3670462913582315
Energy: 1.369559594580395
Energy: 1.6086519237075205
Energy: 1.3652002569970723
Energy: 1.4104619121687498
Energy: 1.6340594329730633
Energy: 1.3477877954266604
Energy: 1.3544511656438643
Energy: 1.4334584463695568
Energy: 1.3306944188130887
Energy: 1.4446853941558302
Energy: 1.403650757079613
Energy: 1.3844320528480378
Energy: 1.3871075941132425
Energy: 1.331546021154141
Energy: 1.3831180892529973
Energy: 1.358991095419026

minimum gb energy = 1.3119893466253982 eV
minimum distance =  2.25372018301467 Angstroms
sigma value = 57


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

Energy: 1.979314925079268
Energy: 1.3703180506878552
Energy: 1.3695231662929532
Energy: 1.6713867675376193
Energy: 2.0270651705868614
Energy: 1.3693495078307873
Energy: 1.3777561675159118
Energy: 1.3613257280780215
Energy: 1.3174183962218118
Energy: 1.388004165000764
Energy: 1.36295489805894
Energy: 1.3199598956003344
Energy: 1.466546103062106
Energy: 1.306460917904909
Energy: 1.3061686460088329
Energy: 1.4678447393157574
Energy: 1.3064761329817596
Energy: 1.3174312545621996
Energy: 1.3899290476428126
Energy: 1.3423684291746698
Energy: 1.3189150816484412
Energy: 1.3185509043715986
Energy: 1.3412460597350124
Energy: 1.3193090206458462
Energy: 1.3898473525142543
Energy: 1.31968331330406
Energy: 1.318352693683596
Energy: 1.3574379031594388
Energy: 1.4694947382291992
Energy: 1.3185810213913907
Energy: 1.4296492029006227
Energy: 1.385773649480894
Energy: 1.354644642753924
Energy: 1.3593715631159489
Energy: 1.3864930111280553
Energy: 1.3191803864137004
Energy: 1.480465206556609
Energy: 1.3627244937889782
Energy: 1.363486928961666
Energy: 1.355512115430583
Energy: 1.3637389592453397
Energy: 1.3558315109948813
Energy: 1.4661751157460272
Energy: 1.3563935728341627
Energy: 1.3205338113455791
Energy: 1.47895277899392
Energy: 1.3865232422173872
Energy: 1.3193487560701784
Energy: 1.281262765196503
Energy: 1.3183585892901366
Energy: 1.2976794279507986
Energy: 1.2961201812889154
Energy: 1.3176592860878988
Energy: 1.2962766789581286
Energy: 1.2823633839476813
Energy: 1.3169547614285408
Energy: 1.297030717293494
Energy: 1.3145128554651424
Energy: 1.4676417541555418
Energy: 1.2963014974731222
Energy: 1.5019736877759997
Energy: 1.355954800215667
Energy: 1.3200852314309564
Energy: 1.5048558989118297
Energy: 1.386936079358832
Energy: 1.3202401242606383
Energy: 1.4282969618810517
Energy: 1.3443960935280503
Energy: 1.3449902180482889
Energy: 1.319393453894662
Energy: 1.343780585757911
Energy: 1.315275704891783
Energy: 1.3897829875020624
Energy: 1.3629522702612005
Energy: 1.3177128267127458
Energy: 1.3857747048450382
Energy: 1.3865055654564638
Energy: 1.3430204545426185
Energy: 1.4290186506302642
Energy: 1.4592457069308553
Energy: 1.31819817782312
Energy: 1.3570395800318118
Energy: 1.4476867948933398
Energy: 1.3176189566595429
Energy: 1.3933162472451868
Energy: 1.2968351566761915
Energy: 1.318904550809597
Energy: 1.3529163504126072
Energy: 1.2970280936012377
Energy: 1.3183432700140323
Energy: 1.4665197514223127
Energy: 1.2964819876058196
Energy: 1.2960624757457733
Energy: 1.468290721721742
Energy: 1.3409208086204443
Energy: 1.320073127740712
Energy: 1.3779860757434113
Energy: 1.3614802531982595
Energy: 1.31712646258913
Energy: 1.2926688141763942
Energy: 1.3873407011434893
Energy: 1.3189222351118142

minimum gb energy = 1.281262765196503 eV
minimum distance =  2.29984472442033 Angstroms
sigma value = 9


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

Energy: 2.3141911754434874
Energy: 1.554074884687088
Energy: 1.4895236599157946
Energy: 1.456540768388794
Energy: 1.4786581178351463
Energy: 1.4504700817836085
Energy: 1.5494918830883426
Energy: 1.4597459681899858
Energy: 1.4653736886527684
Energy: 1.4051355799170886
Energy: 1.454108264360094
Energy: 1.4208464385967976
Energy: 1.5624065408856136
Energy: 1.424999547984321
Energy: 1.4433818371787952
Energy: 1.5629257768529778
Energy: 1.4276641655084217
Energy: 1.4440485972321815
Energy: 1.4511237150180865
Energy: 1.4100396663013735
Energy: 1.404479982257636
Energy: 1.4338132726731039
Energy: 1.415031409144785
Energy: 1.4040889080986925
Energy: 1.4874798953587918
Energy: 1.449461822801304
Energy: 1.4071043430755992
Energy: 1.4510803161634862
Energy: 1.46998550105132
Energy: 1.4156653510479744
Energy: 1.4464571530188617
Energy: 1.4047012063188302
Energy: 1.4060543239959176
Energy: 1.418320027160868
Energy: 1.4065113475434678
Energy: 1.3978561554589553
Energy: 1.431949790712352
Energy: 1.39013739636055
Energy: 1.4567849236771626
Energy: 1.4294480366425522
Energy: 1.407058133842119
Energy: 1.4203177505369136
Energy: 1.4892657755464778
Energy: 1.4181088274448914
Energy: 1.4083671703345717
Energy: 1.4895784948561803
Energy: 1.4066955449613514
Energy: 1.4042341472873068
Energy: 1.4953407945718078
Energy: 1.4139696287883088
Energy: 1.412323651826224
Energy: 1.4149824809268345
Energy: 1.490786133919168
Energy: 1.4638134656417359
Energy: 1.562889148982688
Energy: 1.4130080258180648
Energy: 1.4140829337393273
Energy: 1.401116497481197
Energy: 1.4139015420229653
Energy: 1.412051917130883
Energy: 1.4895993736554625
Energy: 1.4005784059718491
Energy: 1.3956997278785495
Energy: 1.4883732270533623
Energy: 1.4185512890814742
Energy: 1.3968769012221807
Energy: 1.4697033891890081
Energy: 1.4270702010163787
Energy: 1.4153835275324143
Energy: 1.4683874883859978
Energy: 1.4532095211276133
Energy: 1.4507244226253275
Energy: 1.6712192276426603
Energy: 1.4314710233622843
Energy: 1.4334632826537073
Energy: 1.4180135398728317
Energy: 1.4317312084994926
Energy: 1.4601361152152685
Energy: 1.5139987598011604
Energy: 1.4067104299995608
Energy: 1.4046828145627386
Energy: 1.4060286868421525
Energy: 1.570720258730578
Energy: 1.4054618794891673
Energy: 1.4780013384709527
Energy: 1.3954685090582277
Energy: 1.4029227772980866
Energy: 1.479165629113591
Energy: 1.3980944248521403
Energy: 1.4423913518427265
Energy: 1.454525022666028
Energy: 1.4478369734580026
Energy: 1.4286385356067242
Energy: 1.43635337959965
Energy: 1.41840926555601
Energy: 1.4098846365495492
Energy: 1.4645047639184021
Energy: 1.4069932230599176
Energy: 1.4043344320344209
Energy: 1.4579459818402765
Energy: 1.4046958258249438
Energy: 1.4026136256587667
Energy: 1.635160371171367
Energy: 1.469651687815271
Energy: 1.4682263105700457
Energy: 1.4483878410447442
Energy: 1.5313914744665085
Energy: 1.4165438342483547
Energy: 1.5384904619334656
Energy: 1.4054533333897048
Energy: 1.434819187768362
Energy: 1.4673564946790236
Energy: 1.402246673638575
Energy: 1.445599590535806
Energy: 1.5630466030355674
Energy: 1.4083190524765548
Energy: 1.4353146700108816
Energy: 1.5635510023629906
Energy: 1.4165851907246445
Energy: 1.4337004897368657
Energy: 1.4797740659617213
Energy: 1.4578837914436702
Energy: 1.4621326831922716
Energy: 1.4041522908293493
Energy: 1.4549089495072232
Energy: 1.4227725710056613

minimum gb energy = 1.39013739636055 eV
minimum distance =  2.25365439723126 Angstroms
sigma value = 27


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

Energy: 1.6177922372181797
Energy: 1.4846998213314568
Energy: 1.5025091877760823
Energy: 1.5035225850147809
Energy: 1.9959664161706816
Energy: 1.5030743093735242
Energy: 1.4923117331702462
Energy: 1.4951477725431288
Energy: 1.4950729265166653
Energy: 1.4580360960203373
Energy: 1.4987693277697094
Energy: 1.4146467486782326
Energy: 1.4672051178657497
Energy: 1.4253915179739145
Energy: 1.424480310010734
Energy: 1.4685951166877045
Energy: 1.4124963281630984
Energy: 1.4102517369563763
Energy: 1.4479176659626656
Energy: 1.4119742724084927
Energy: 1.4129824369532835
Energy: 1.4454754585692156
Energy: 1.415152392704155
Energy: 1.411855128946845
Energy: 1.4996950104010285
Energy: 1.4672600394105724
Energy: 1.4177391375171096
Energy: 1.4228888858926523
Energy: 1.5031704851822143
Energy: 1.4345220511162362
Energy: 1.4682801202852485
Energy: 1.417218331042169
Energy: 1.406844811606693
Energy: 1.4503801770293498
Energy: 1.4178843116458002
Energy: 1.4118524319954897
Energy: 1.448093358256047
Energy: 1.353875515596234
Energy: 1.3504357963024303
Energy: 1.4497577886485487
Energy: 1.3544060039298025
Energy: 1.3500444222335428
Energy: 1.4426009498896346
Energy: 1.3566165538268706
Energy: 1.4232377873418565
Energy: 1.440246272720418
Energy: 1.4272531499883983
Energy: 1.4166991264339641
Energy: 1.6411960534786514
Energy: 1.4197333961236738
Energy: 1.4204431835099918
Energy: 1.414517924456239
Energy: 1.4209693638231022
Energy: 1.4198386908868594
Energy: 1.6517334114190145
Energy: 1.413275379220238
Energy: 1.4195110918752283
Energy: 1.4146602211663437
Energy: 1.4122741031924457
Energy: 1.415706967081475
Energy: 1.4308623237648204
Energy: 1.4218119968741154
Energy: 1.421961260900487
Energy: 1.4302318085735741
Energy: 1.444420029371081
Energy: 1.412573077623806
Energy: 1.4241025261156584
Energy: 1.4238914149950799
Energy: 1.4232258278274426
Energy: 1.4399222125912143
Energy: 1.4250247732297259
Energy: 1.4261034369748993
Energy: 1.3864587740843501
Energy: 1.4687718427596153
Energy: 1.3716042354731626
Energy: 1.3497103580132828
Energy: 1.4795558644615572
Energy: 1.3483144418625028
Energy: 1.483864045374916
Energy: 1.4401657451789311
Energy: 1.4388095960991087
Energy: 1.4246769196227238
Energy: 1.4753509501741775
Energy: 1.3530528007864955
Energy: 1.4336426318081872
Energy: 1.424292266466921
Energy: 1.428851520402842
Energy: 1.4159698109372763
Energy: 1.4296495943779481
Energy: 1.432405224558037
Energy: 1.4881541363209887
Energy: 1.4134419202202897
Energy: 1.4404385025824802
Energy: 1.4346683767617616
Energy: 1.4108202241453351
Energy: 1.4396202411666414
Energy: 1.499381316838698
Energy: 1.4610608108083676
Energy: 1.4504303271910428
Energy: 1.4998474657409309
Energy: 1.528764255782599
Energy: 1.4518022797308714
Energy: 1.5010782881339568
Energy: 1.4048147984867136
Energy: 1.4131446406511767
Energy: 1.4008891741022953
Energy: 1.4217104134454004
Energy: 1.4065007290664442
Energy: 1.427726701229147
Energy: 1.3818893435941753
Energy: 1.3712196019149008
Energy: 1.4355510268952265
Energy: 1.3501599967151106
Energy: 1.3590132940815323
Energy: 1.4511984239933047
Energy: 1.3616737080099224
Energy: 1.362644253398523
Energy: 1.4519757298001195
Energy: 1.3488756326606381
Energy: 1.3594069560237527
Energy: 1.6219066304687653
Energy: 1.4048862211851958
Energy: 1.406676206194567
Energy: 1.40950560949531
Energy: 1.4201952331379246
Energy: 1.4128290391815084
Energy: 1.4533258338111064
Energy: 1.491857284702958
Energy: 1.4903500858562417
Energy: 1.4552438272993036
Energy: 1.5301074314384289
Energy: 1.4928751526782356
Energy: 1.49762494947283
Energy: 1.4165213769759677
Energy: 1.4372494573016785
Energy: 1.4976092283535112
Energy: 1.4136862811697692
Energy: 1.435484573783319
Energy: 1.4749843380751801
Energy: 1.4009240745677531
Energy: 1.4006433341050368
Energy: 1.4800266525989556
Energy: 1.418163609344603
Energy: 1.4114991869980655
Energy: 1.448506330386402
Energy: 1.4612329272329012
Energy: 1.4671554109473266
Energy: 1.4176225682950905
Energy: 1.468721679156804
Energy: 1.39482357793726

minimum gb energy = 1.3483144418625028 eV
minimum distance =  2.26625503420535 Angstroms
sigma value = 19


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

Energy: 2.219904227827157
Energy: 1.8170145503225066
Energy: 1.404851110939258
Energy: 1.743651683234414
Energy: 1.6238180136244154
Energy: 1.3740275575426033
Energy: 1.5158153115313378
Energy: 1.407424166940197
Energy: 1.404738668896077
Energy: 1.3922893508954357
Energy: 1.418063746043304
Energy: 1.3900270331352544
Energy: 1.4651963149610878
Energy: 1.3910165779964339
Energy: 1.3884325006956126
Energy: 1.4631852955877496
Energy: 1.3890094297818727
Energy: 1.3883898936789705
Energy: 1.434110344363144
Energy: 1.3903325124223533
Energy: 1.3907376018261637
Energy: 1.4076368669356998
Energy: 1.3905479100511795
Energy: 1.3900427405272602
Energy: 1.4142706803537783
Energy: 1.4122918088019771
Energy: 1.4187767155201585
Energy: 1.3997634491558413
Energy: 1.4739566287859205
Energy: 1.3920424184948845
Energy: 1.4862592055487405
Energy: 1.389888212187058
Energy: 1.390397162989142
Energy: 1.4898572037101647
Energy: 1.3902512790366999
Energy: 1.3914461414007968
Energy: 1.537086822332907
Energy: 1.4012791087708172
Energy: 1.4014858185658585
Energy: 1.5373398571490147
Energy: 1.393831168796598
Energy: 1.5183637879552283
Energy: 1.419729324369798
Energy: 1.3734734866857192
Energy: 1.3956083318706258
Energy: 1.41388780737281
Energy: 1.3730398981648582
Energy: 1.4090462636796754
Energy: 1.4114081602699249
Energy: 1.3980582698726738
Energy: 1.3982209753624886
Energy: 1.388693007922035
Energy: 1.4013905751905493
Energy: 1.3993757729155534
Energy: 1.458711623545795
Energy: 1.382442316246793
Energy: 1.3793448326313413
Energy: 1.4103403994152786
Energy: 1.3814316393151347
Energy: 1.3753293065378163
Energy: 1.5013120307288075
Energy: 1.3718305000280622
Energy: 1.374656077856684
Energy: 1.5023352664259328
Energy: 1.3718176098278907
Energy: 1.398892343766092
Energy: 1.493765663706483
Energy: 1.3749123255531248
Energy: 1.376586978620492
Energy: 1.4647356228948651
Energy: 1.4263164510094868
Energy: 1.3749002230977445
Energy: 1.4776944496047384
Energy: 1.3955609695285642
Energy: 1.3600670523303475
Energy: 1.3889108112222646
Energy: 1.4207942917283818
Energy: 1.3601660397031534
Energy: 1.458465514411164
Energy: 1.3809274212083589
Energy: 1.3806995984227741
Energy: 1.3760173598424263
Energy: 1.3966239952923403
Energy: 1.3812249431174397
Energy: 1.5044203085345127
Energy: 1.3745424109982856
Energy: 1.3740158172273524
Energy: 1.4272695220183182
Energy: 1.3717431497109749
Energy: 1.3982126900116285
Energy: 1.4537925254333173
Energy: 1.3758115632210564
Energy: 1.3718604639222298
Energy: 1.417229796735429
Energy: 1.3730329377131167
Energy: 1.3610940468900263
Energy: 1.4514641015652072
Energy: 1.3931550440431038
Energy: 1.4035698513006585
Energy: 1.3698286827885386
Energy: 1.383604702383527
Energy: 1.4224570360820068
Energy: 1.4795298069838416
Energy: 1.3619721862969765
Energy: 1.3619203315151849
Energy: 1.4240482321349008
Energy: 1.4318965904340404
Energy: 1.3607133936959728
Energy: 1.452194191526427
Energy: 1.3918928039268617
Energy: 1.425143186849755
Energy: 1.4509619132069482
Energy: 1.4143426219090198
Energy: 1.371684740903733
Energy: 1.44421005439123
Energy: 1.3846408703111364
Energy: 1.3735876181418063
Energy: 1.3912758173155062
Energy: 1.4083393815426322
Energy: 1.3610585358606624
Energy: 1.3951591292925247
Energy: 1.3614464200522494
Energy: 1.3804987281237993
Energy: 1.3952527970090134
Energy: 1.3757057655698044
Energy: 1.381491357190232
Energy: 1.4187966251314506
Energy: 1.3748352440015905
Energy: 1.3767971022490608
Energy: 1.421768802893303
Energy: 1.3802825507005592
Energy: 1.3839925851198698
Energy: 1.4576487972544878
Energy: 1.4547399806322454
Energy: 1.3598412643214175
Energy: 1.3872460833529805
Energy: 1.4037304304475224
Energy: 1.3613767690749419
Energy: 1.420872794675498
Energy: 1.3630682784152435
Energy: 1.3617433979115523
Energy: 1.420620244708121
Energy: 1.390804812313894
Energy: 1.3614569181632963
Energy: 1.482671715774054
Energy: 1.3862130884690211
Energy: 1.398678727210773
Energy: 1.4601482042774845
Energy: 1.4375752981952332
Energy: 1.3987010688492465
Energy: 1.4348329351820974
Energy: 1.4008427607542704
Energy: 1.4000536900520542
Energy: 1.3851499073323927
Energy: 1.4041259275059654
Energy: 1.4121056349736572
Energy: 1.4204464157573067
Energy: 1.400151041778641
Energy: 1.3972498319272157
Energy: 1.3989718513627096
Energy: 1.389689080478805
Energy: 1.3994503362226538
Energy: 1.4590691471589263
Energy: 1.4045020831231272
Energy: 1.404653979002272
Energy: 1.4331170176691668
Energy: 1.3883356170713668
Energy: 1.4021731399970108
Energy: 1.4998677382878332
Energy: 1.4737078555192402
Energy: 1.4739437756562228
Energy: 1.3888153965072578
Energy: 1.4720659797074886
Energy: 1.360570525016933

minimum gb energy = 1.3598412643214175 eV
minimum distance =  2.26189363239452 Angstroms
sigma value = 101


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

Energy: 2.014002658043669
Energy: 1.3731647908874223
Energy: 1.3814231264012071
Energy: 1.3072105782325028
Energy: 2.0203131303869086
Energy: 1.3063273527830712
Energy: 1.4127555117083959
Energy: 1.3519218422678125
Energy: 1.3312301081140305
Energy: 1.378438169977927
Energy: 1.3696935520209865
Energy: 1.3308635587743811
Energy: 1.443543633681681
Energy: 1.326399131434389
Energy: 1.327974807955011
Energy: 1.4364649280127302
Energy: 1.3255134000471347
Energy: 1.327428818802534
Energy: 1.4091361558597926
Energy: 1.3356688554517586
Energy: 1.3317159087149348
Energy: 1.3510454871380797
Energy: 1.3323480005009372
Energy: 1.3308537941232679
Energy: 1.3397109214102965
Energy: 1.4429105880698059
Energy: 1.3630423896548587
Energy: 1.3410881191989028
Energy: 1.4380762950965182
Energy: 1.3438172213547137
Energy: 1.4020669306115927
Energy: 1.3315315182870218
Energy: 1.3335111381230564
Energy: 1.400676564041226
Energy: 1.3320128693017672
Energy: 1.332897652774031
Energy: 1.4334881428255195
Energy: 1.3323237418404732
Energy: 1.33384933258542
Energy: 1.4325457261052221
Energy: 1.3332328720224866
Energy: 1.3536572920421601
Energy: 1.3896500981464337
Energy: 1.331174224952576
Energy: 1.3309082579260014
Energy: 1.4020405448570552
Energy: 1.3292506317748427
Energy: 1.3403447944106792
Energy: 1.3228796372309706
Energy: 1.3628474851060668
Energy: 1.3266089662008476
Energy: 1.3256686585183606
Energy: 1.3500556760400442
Energy: 1.3251796151312147
Energy: 1.3658159390464977
Energy: 1.338135655400298
Energy: 1.3307891033056023
Energy: 1.323266344568609
Energy: 1.336309968038182
Energy: 1.3301811735244287
Energy: 1.5693547445222054
Energy: 1.3070570168055395
Energy: 1.3045304988208024
Energy: 1.5682168223000053
Energy: 1.3047502003222267
Energy: 1.3036226479929012
Energy: 1.4137697221770906
Energy: 1.330865231690201
Energy: 1.3332353035641324
Energy: 1.414978546562844
Energy: 1.3632114370475295
Energy: 1.3364729807096714
Energy: 1.37852179818115
Energy: 1.3575034995066197
Energy: 1.3748241806623842
Energy: 1.3219711842965332
Energy: 1.4131755502015781
Energy: 1.3716521626046376
Energy: 1.3874336566274843
Energy: 1.353360173035142
Energy: 1.33603329682259
Energy: 1.3680490206644849
Energy: 1.3594419207111297
Energy: 1.3361735088369364
Energy: 1.462003705522601
Energy: 1.3315051824616166
Energy: 1.352598833506859
Energy: 1.4020839832750098
Energy: 1.331613518820408
Energy: 1.3565293594018075
Energy: 1.443685546353885
Energy: 1.3303673980623667
Energy: 1.3324100400275292
Energy: 1.3742128797404962
Energy: 1.38564034730257
Energy: 1.3316386231459056
Energy: 1.7158877270739197
Energy: 1.4228934789401229
Energy: 1.3518219448344344
Energy: 1.301365045393182
Energy: 1.4231282179314333
Energy: 1.3004459324473825
Energy: 1.4106958538624381
Energy: 1.3504420397794226
Energy: 1.350458260042195
Energy: 1.3622662612442993
Energy: 1.3709919681744176
Energy: 1.3356668631545439
Energy: 1.4461104104204134
Energy: 1.373311996430889
Energy: 1.3817356168887402
Energy: 1.4369920867777557
Energy: 1.3731794421924794
Energy: 1.381928079129716
Energy: 1.4161881897737645
Energy: 1.3543053720318108
Energy: 1.3418045978186082
Energy: 1.3504660139630262
Energy: 1.381308875764205
Energy: 1.342822527351852
Energy: 1.3411661326527842
Energy: 1.3505428626554854
Energy: 1.3670326547030844
Energy: 1.3406494069451074
Energy: 1.3520544628533284
Energy: 1.3752284032862345
Energy: 1.4086283491756302
Energy: 1.3343749171932646
Energy: 1.3328502016954284
Energy: 1.3918984025729664
Energy: 1.3987946276710344
Energy: 1.3509586131833806
Energy: 1.4328165245011646
Energy: 1.3705633774467094
Energy: 1.3684164093098343
Energy: 1.432914574370345
Energy: 1.3348707797977606
Energy: 1.3350574082290356
Energy: 1.4647688959366734
Energy: 1.3289665040990604
Energy: 1.328767777224355
Energy: 1.3974260612894072
Energy: 1.3464123882281376
Energy: 1.350667179263414
Energy: 1.3675140830364874
Energy: 1.3321378033892504
Energy: 1.3316388430950374
Energy: 1.3633177138731247
Energy: 1.3703099060983959
Energy: 1.3439509088463606
Energy: 1.321681930066039
Energy: 1.3394262090134301
Energy: 1.3383633114714264
Energy: 1.3231964423763214
Energy: 1.3361257103022317
Energy: 1.3557196965544702
Energy: 1.465334873938064
Energy: 1.3764683449106263
Energy: 1.376590253282602
Energy: 1.3524215800442605
Energy: 1.3564863671674496
Energy: 1.329349174832942
Energy: 1.4140344448991735
Energy: 1.3565839631247165
Energy: 1.3571185105824466
Energy: 1.4156103828648208
Energy: 1.330149953732876
Energy: 1.3362067402038182
Energy: 1.4036366054755292
Energy: 1.351620415903553
Energy: 1.363908635846968
Energy: 1.37114120205562
Energy: 1.4129887549907767
Energy: 1.363556104578294
Energy: 1.4038106566838817
Energy: 1.3511468719252397
Energy: 1.3505598967451475
Energy: 1.3721687598907963
Energy: 1.351911799015485
Energy: 1.3635706030576913
Energy: 1.4139760917070425
Energy: 1.3555842093958403
Energy: 1.3558033665579248
Energy: 1.365340623800498
Energy: 1.3305720420100657
Energy: 1.3361748639336042
Energy: 1.4619939283317096
Energy: 1.3307390795153535
Energy: 1.3313924517034101
Energy: 1.4100330141488868
Energy: 1.3251691788732827
Energy: 1.334484564954296
Energy: 1.408087951615877
Energy: 1.351362015010849
Energy: 1.3401275046706365
Energy: 1.3884252984008916
Energy: 1.4078534819639623
Energy: 1.3399254596376473

minimum gb energy = 1.3004459324473825 eV
minimum distance =  2.27106549290056 Angstroms
sigma value = 33


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

Energy: 0.02046603111389601
Energy: 0.023591252006406622
Energy: 0.021417171413614145
Energy: 0.023225563324214892
Energy: 1.0846999961806434
Energy: 0.021004604391764704
Energy: 0.021392556702154446
Energy: 0.15719719763706347
Energy: 0.1553374652239607
Energy: 0.1551822417006959
Energy: 0.1552303407241899
Energy: 0.15533087315173533
Energy: 1.6094380802530641
Energy: 1.0859614410417555
Energy: 1.0847066456385328
Energy: 1.6128275855222047
Energy: 1.0833688704722635
Energy: 1.0830567572939127
Energy: 0.6835246067667918
Energy: 0.15719719763706347
Energy: 0.1553374652239607
Energy: 0.1551822417006959
Energy: 0.1552303407237225
Energy: 0.15533087315220276

minimum gb energy = 0.02046603111389601 eV
minimum distance =  2.45880009715485 Angstroms
sigma value = 1