Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Fe__MO_549900287421_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.851000025868416
cohesive_energy=4.290337375544713
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013335937914847402
Energy: 0.013732366107120225
Energy: 0.7287239565424972
Energy: 0.013732366107120225
Energy: 0.013335937914847402
Energy: 0.013732366107120225
Energy: 0.013732366107120225
Energy: 3.173676002797353
Energy: 0.013732366107120225
Energy: 2.826786372203951
Energy: 0.013732366107120225
Energy: 2.826786372203951
Energy: 0.7287239565424972
Energy: 0.013732366107120225
Energy: 0.013335937914847402
Energy: 0.013732366107120225
Energy: 0.7287239565424972
Energy: 0.013732366107120225
Energy: 0.013732366107120225
Energy: 2.8267863722049316
Energy: 0.013732366107120225
Energy: 2.8267863722044555
Energy: 0.013732366107120225
Energy: 2.8267863722044555
Energy: 0.013335937914847402
Energy: 0.013732366107120225
Energy: 0.7287239565424972
Energy: 0.013732366107120225
Energy: 0.013335937914847402
Energy: 0.013732366107120225
Energy: 0.013732366107120225
Energy: 2.826786372203951
Energy: 0.013732366107120225
Energy: 2.826786372203951
Energy: 0.013732366107120225
Energy: 2.826786372203951

minimum gb energy = 0.013335937914847402 eV
minimum distance =  2.39871204398014 Angstroms
sigma value = 1


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

Energy: 1.239927735161992
Energy: 1.329083381846388
Energy: 1.3056156378941293
Energy: 1.329083381846388
Energy: 1.239927735161992
Energy: 1.329083381846388
Energy: 1.24120236862172
Energy: 1.3084917316186981
Energy: 1.2350827562529394
Energy: 1.3084917316186981
Energy: 1.2412023686229336
Energy: 1.3084917316186981
Energy: 1.2429426963320833
Energy: 1.3085004723215004
Energy: 1.2337922986913958
Energy: 1.3085004723215004
Energy: 1.2429426963320833
Energy: 1.3085004723215004
Energy: 1.2740487690324023
Energy: 1.2625851018933534
Energy: 1.226957860352147
Energy: 1.2625851018933534
Energy: 1.2740487690324023
Energy: 1.2625851018933534
Energy: 1.2740401241782267
Energy: 1.3294013415718526
Energy: 1.2623178924441936
Energy: 1.3294013415730663
Energy: 1.2740401241794403
Energy: 1.3294013415730663
Energy: 1.2339656487760806
Energy: 1.3077228828452392
Energy: 1.2442873772984933
Energy: 1.3077228828452392
Energy: 1.2339656487760806
Energy: 1.3077228828452392
Energy: 1.233900702953351
Energy: 1.3079373856712504
Energy: 1.2453944774857353
Energy: 1.3079373856712504
Energy: 1.233900702953351
Energy: 1.3079373856712504
Energy: 1.3031318136966359
Energy: 1.3296719583724879
Energy: 1.2197093367597407
Energy: 1.3296719583724879
Energy: 1.3031318136966359
Energy: 1.3296719583724879
Energy: 1.274894855734185
Energy: 1.2649941845813726
Energy: 1.2274592005273037
Energy: 1.2649941845813726
Energy: 1.274894855734185
Energy: 1.2649941845813726
Energy: 1.236204312678824
Energy: 1.308575814526518
Energy: 1.244469099135156
Energy: 1.308575814526518
Energy: 1.236204312678824
Energy: 1.308575814526518
Energy: 1.2457450483908683
Energy: 1.283752085651601
Energy: 1.2350363874046673
Energy: 1.2837520856503875
Energy: 1.2457450483908683
Energy: 1.2837520856503875
Energy: 1.2235392620529408
Energy: 1.3291573304865272
Energy: 1.2235002285835916
Energy: 1.3291573304865272
Energy: 1.2235392620529408
Energy: 1.3291573304865272
Energy: 1.2349790186653957
Energy: 1.2837520856503875
Energy: 1.2631112478054252
Energy: 1.2837520856503875
Energy: 1.2349790186653957
Energy: 1.2837520856503875
Energy: 1.2444895802982965
Energy: 1.3085852142093448
Energy: 1.2364987845237616
Energy: 1.3085852142093448
Energy: 1.2444895802982965
Energy: 1.3085852142093448
Energy: 1.227464277945622
Energy: 1.2649183663819383
Energy: 1.2753428788096328
Energy: 1.2649183663819383
Energy: 1.227464277945622
Energy: 1.2649183663819383
Energy: 1.2192421623470617
Energy: 1.329642584998538
Energy: 1.3031593739228273
Energy: 1.329642584998538
Energy: 1.2192421623470617
Energy: 1.329642584998538
Energy: 1.2454109545017182
Energy: 1.3081369998539323
Energy: 1.2338602243759174
Energy: 1.3081369998539323
Energy: 1.2454109545017182
Energy: 1.3081369998539323
Energy: 1.244273581539334
Energy: 1.3077791598467814
Energy: 1.2341051891654615
Energy: 1.3077791598467814
Energy: 1.2442735815381205
Energy: 1.3077791598467814
Energy: 1.2738852262093139
Energy: 1.3294045415648403
Energy: 1.274017931237085
Energy: 1.3294045415648403
Energy: 1.2738852262093139
Energy: 1.3294045415648403
Energy: 1.226796654500879
Energy: 1.2625896256282987
Energy: 1.2739056199163832
Energy: 1.2625896256295124
Energy: 1.2267966545020927
Energy: 1.2625896256295124
Energy: 1.233700239312543
Energy: 1.3084874320886435
Energy: 1.2429393753030369
Energy: 1.3084874320886435
Energy: 1.233700239312543
Energy: 1.3084874320886435
Energy: 1.235164896324712
Energy: 1.3085025482159227
Energy: 1.2412149217707853
Energy: 1.3085025482159227
Energy: 1.235164896324712
Energy: 1.3085025482159227
Energy: 1.2925134078943683
Energy: 1.329083381846388
Energy: 1.239927735161992
Energy: 1.329083381846388
Energy: 1.2925134078943683
Energy: 1.329083381846388

minimum gb energy = 1.2192421623470617 eV
minimum distance =  2.26988290161058 Angstroms
sigma value = 33


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

Energy: 1.7152597875539841
Energy: 1.3785757495983286
Energy: 1.3075692945789532
Energy: 1.3785757495983286
Energy: 1.7152597875539841
Energy: 1.378575749597638
Energy: 1.27501190890162
Energy: 1.3541695339343212
Energy: 1.388888360683294
Energy: 1.3541695339350115
Energy: 1.27501190890093
Energy: 1.3541695339350115
Energy: 1.2745360650269562
Energy: 1.3762524509805367
Energy: 1.3522003977439574
Energy: 1.3762524509805367
Energy: 1.2745360650269562
Energy: 1.3762524509805367
Energy: 1.2732073199385812
Energy: 1.3232348193516648
Energy: 1.3743770952317558
Energy: 1.3232348193516648
Energy: 1.2732073199378908
Energy: 1.3232348193516648
Energy: 1.2732162527223818
Energy: 1.3552293949796075
Energy: 1.3731673700485278
Energy: 1.3552293949802978
Energy: 1.2732162527223818
Energy: 1.3552293949802978
Energy: 1.2647410724710555
Energy: 1.3552640953513244
Energy: 1.2992867193347934
Energy: 1.3552640953513244
Energy: 1.2647410724697061
Energy: 1.3552640953513244
Energy: 1.2645464828359643
Energy: 1.355076004302621
Energy: 1.346620147955045
Energy: 1.355076004302621
Energy: 1.2645464828366548
Energy: 1.355076004302621
Energy: 1.2998972610407915
Energy: 1.3562765109381072
Energy: 1.3073376640528676
Energy: 1.3562765109387975
Energy: 1.2998972610414818
Energy: 1.3562765109381072
Energy: 1.2730625887765912
Energy: 1.3229479807241902
Energy: 1.2628245364959878
Energy: 1.3229479807235
Energy: 1.2730625887765912
Energy: 1.3229479807235
Energy: 1.2630894681161322
Energy: 1.3762478567149639
Energy: 1.2741756449828876
Energy: 1.3762478567149639
Energy: 1.2630894681161322
Energy: 1.3762478567149639
Energy: 1.2765006759211102
Energy: 1.3581798400562557
Energy: 1.2742523266983492
Energy: 1.3581798400562557
Energy: 1.2765006759211102
Energy: 1.3581798400555654
Energy: 1.3523149619303239
Energy: 1.3567152732279968
Energy: 1.301633580905647
Energy: 1.3567152732273067
Energy: 1.3523149619303239
Energy: 1.3567152732273067
Energy: 1.3734828673928527
Energy: 1.3293277911602075
Energy: 1.2752898120348524
Energy: 1.3293277911602075
Energy: 1.3734828673928527
Energy: 1.3293277911602075
Energy: 1.3471177073350737
Energy: 1.3758507660399182
Energy: 1.2689887410640575
Energy: 1.375850766039228
Energy: 1.3471177073350737
Energy: 1.375850766039228
Energy: 1.3526933262833747
Energy: 1.354943930646577
Energy: 1.3896970132755926
Energy: 1.354943930646577
Energy: 1.3526933262833747
Energy: 1.354943930646577
Energy: 1.352724200381674
Energy: 1.355086974477886
Energy: 1.29508716616293
Energy: 1.355086974477886
Energy: 1.352724200381674
Energy: 1.355086974477886
Energy: 1.3736698435896733
Energy: 1.3547975009063427
Energy: 1.2740302858812027
Energy: 1.3547975009056525
Energy: 1.3736698435896733
Energy: 1.3547975009056525
Energy: 1.373900449640824
Energy: 1.3497159668413454
Energy: 1.383120245592148
Energy: 1.349715966842036
Energy: 1.373900449640824
Energy: 1.349715966842036
Energy: 1.2974003691636269
Energy: 1.3563466666141095
Energy: 1.284955259291457
Energy: 1.3563466666141095
Energy: 1.2974003691636269
Energy: 1.3563466666141095
Energy: 1.347098082628301
Energy: 1.3233119369560025
Energy: 1.3792632242653782
Energy: 1.3233119369560025
Energy: 1.3470980826276107
Energy: 1.3233119369560025
Energy: 1.3484761599415565
Energy: 1.3763773435244855
Energy: 1.3083119836292263
Energy: 1.3763773435244855
Energy: 1.3484761599415565
Energy: 1.3763773435251758
Energy: 1.3075434118531333
Energy: 1.3612565296556591
Energy: 1.4378361921092921
Energy: 1.3612565296563495
Energy: 1.3075434118531333
Energy: 1.3612565296556591
Energy: 1.2729171451723966
Energy: 1.3564928962852902
Energy: 1.3731436459699542
Energy: 1.3564928962859808
Energy: 1.272917145173087
Energy: 1.3564928962852902
Energy: 1.3734594834068299
Energy: 1.350046860702126
Energy: 1.2730964095414121
Energy: 1.3500468607014358
Energy: 1.3734594834061395
Energy: 1.3500468607014358
Energy: 1.3008500786605302
Energy: 1.354743023065496
Energy: 1.3521557320240085
Energy: 1.354743023065496
Energy: 1.3008500786605302
Energy: 1.354743023065496
Energy: 1.2702400345609646
Energy: 1.3743521353283377
Energy: 1.3280935451047202
Energy: 1.3743521353283377
Energy: 1.2702400345609646
Energy: 1.3743521353283377
Energy: 1.2702259958781736
Energy: 1.37433607743099
Energy: 1.3427453153963753
Energy: 1.3743360774302997
Energy: 1.2702259958774835
Energy: 1.3743360774302997
Energy: 1.3009924965159807
Energy: 1.3547048283242888
Energy: 1.3521663346702189
Energy: 1.3547048283249794
Energy: 1.3009924965152906
Energy: 1.3547048283249794
Energy: 1.3735297663689447
Energy: 1.350043017993441
Energy: 1.2732294782687565
Energy: 1.3500430179941314
Energy: 1.3735297663689447
Energy: 1.350043017993441
Energy: 1.272910708818319
Energy: 1.3564890889451133
Energy: 1.3145795502763014
Energy: 1.3564890889451133
Energy: 1.2729107088190097
Energy: 1.3564890889451133
Energy: 1.3073696910509343
Energy: 1.3612565296563495
Energy: 1.4377422568592708
Energy: 1.3612565296563495
Energy: 1.3073696910509343
Energy: 1.3612565296563495
Energy: 1.348486747622929
Energy: 1.3763922953561596
Energy: 1.308301155951929
Energy: 1.3763922953561596
Energy: 1.348486747622929
Energy: 1.3763922953561596
Energy: 1.3472056965134578
Energy: 1.3233133087269615
Energy: 1.379325093876632
Energy: 1.3233133087276518
Energy: 1.3472056965141481
Energy: 1.3233133087276518
Energy: 1.2974063083301752
Energy: 1.356348241327453
Energy: 1.2630171194917388
Energy: 1.3563482413267627
Energy: 1.2974063083301752
Energy: 1.3563482413267627
Energy: 1.3738622992123601
Energy: 1.349691142854954
Energy: 1.4628596884629494
Energy: 1.349691142854954
Energy: 1.3738622992116696
Energy: 1.349691142854954
Energy: 1.3735979333617312
Energy: 1.3549725145621447
Energy: 1.2740549625311102
Energy: 1.3549725145621447
Energy: 1.3735979333617312
Energy: 1.3549725145621447
Energy: 1.3524034190765788
Energy: 1.3550555677959355
Energy: 1.287802704295539
Energy: 1.3550555677959355
Energy: 1.352403419077269
Energy: 1.3550555677959355
Energy: 1.3525515882921733
Energy: 1.3547353732574698
Energy: 1.3894837881141164
Energy: 1.3547353732574698
Energy: 1.3525515882921733
Energy: 1.3547353732574698
Energy: 1.348894138215452
Energy: 1.3758471134044403
Energy: 1.2691429899658029
Energy: 1.3758471134044403
Energy: 1.348894138215452
Energy: 1.3758471134044403
Energy: 1.3732348446929417
Energy: 1.3292245432926033
Energy: 1.2754434457453026
Energy: 1.3292245432926033
Energy: 1.3732348446922513
Energy: 1.3292245432926033
Energy: 1.352309931902835
Energy: 1.356713453727814
Energy: 1.2846926794738
Energy: 1.356713453727814
Energy: 1.352309931902835
Energy: 1.356713453727814

minimum gb energy = 1.2628245364959878 eV
minimum distance =  2.23586109669106 Angstroms
sigma value = 51


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

Energy: 1.4472541613963124
Energy: 1.3697540196378792
Energy: 1.4414240383702317
Energy: 1.3697540196394788
Energy: 1.4472541613963124
Energy: 1.3697540196394788
Energy: 1.4086845132593753
Energy: 1.476242242977523
Energy: 1.6754168727804113
Energy: 1.476242242977523
Energy: 1.4086845132593753
Energy: 1.476242242977523
Energy: 1.287334683255232
Energy: 1.3699174692689524
Energy: 1.5414521167318
Energy: 1.3699174692673528
Energy: 1.287334683255232
Energy: 1.3699174692673528
Energy: 1.303576046837473
Energy: 1.3233802108231854
Energy: 1.5417410353106449
Energy: 1.3233802108231854
Energy: 1.303576046837473
Energy: 1.3233802108231854
Energy: 1.2885638528756105
Energy: 1.324822609778542
Energy: 1.4519659326287964
Energy: 1.3248226097769427
Energy: 1.2885638528756105
Energy: 1.3248226097769427
Energy: 1.4470133559606313
Energy: 1.3230081353366485
Energy: 1.6026693733850688
Energy: 1.3230081353366485
Energy: 1.4470133559606313
Energy: 1.3230081353366485
Energy: 1.4475041324618454
Energy: 1.3239060720886409
Energy: 1.5213060321295087
Energy: 1.3239060720870413
Energy: 1.4475041324618454
Energy: 1.3239060720870413
Energy: 1.3114352738001462
Energy: 1.3232514561569328
Energy: 1.257386292605843
Energy: 1.3232514561585325
Energy: 1.3114352738001462
Energy: 1.3232514561585325
Energy: 1.6102516536219225
Energy: 1.372301736082657
Energy: 1.2976203531770905
Energy: 1.372301736082657
Energy: 1.6102516536219225
Energy: 1.372301736082657
Energy: 1.2875791766219482
Energy: 1.3701797177026727
Energy: 1.2574507131362687
Energy: 1.3701797177026727
Energy: 1.2875791766219482
Energy: 1.3701797177026727
Energy: 1.541515264210359
Energy: 1.323748374849974
Energy: 1.6749779127835398
Energy: 1.3237483748483745
Energy: 1.541515264210359
Energy: 1.3237483748483745
Energy: 1.4467751886034041
Energy: 1.3699451888526746
Energy: 1.6024477299457993
Energy: 1.3699451888526746
Energy: 1.4467751886034041
Energy: 1.3699451888526746
Energy: 1.3820720119900907
Energy: 1.3234471198463562
Energy: 1.5417977937882528
Energy: 1.3234471198463562
Energy: 1.3820720119900907
Energy: 1.3234471198463562
Energy: 1.287481381952622
Energy: 1.3703974625732915
Energy: 1.5418236457585583
Energy: 1.3703974625732915
Energy: 1.287481381952622
Energy: 1.3703974625732915
Energy: 1.2873879652499371
Energy: 1.3707105202379704
Energy: 1.5416309861503925
Energy: 1.3707105202379704
Energy: 1.2873879652499371
Energy: 1.3707105202395697
Energy: 1.2879628112078705
Energy: 1.3369893519390577
Energy: 1.5416002381020282
Energy: 1.3369893519374585
Energy: 1.2879628112078705
Energy: 1.3369893519374585
Energy: 1.446693066999227
Energy: 1.3710672949663163
Energy: 1.6019240528504737
Energy: 1.3710672949679161
Energy: 1.446693066999227
Energy: 1.3710672949679161
Energy: 1.446884551739449
Energy: 1.3266448495287613
Energy: 1.676245919594999
Energy: 1.3266448495303607
Energy: 1.4468845517426483
Energy: 1.3266448495303607

minimum gb energy = 1.257386292605843 eV
minimum distance =  2.21179271255252 Angstroms
sigma value = 19


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

Energy: 1.5988340198327675
Energy: 1.4356769250526207
Energy: 1.4263484353634932
Energy: 1.4356769250526207
Energy: 1.5988340198327675
Energy: 1.4356769250526207
Energy: 1.302650934984222
Energy: 1.4028560123935132
Energy: 1.4025592197252332
Energy: 1.4028560123935132
Energy: 1.302650934984222
Energy: 1.4028560123935132
Energy: 1.2851987929487731
Energy: 1.4147510263951824
Energy: 1.395542384609844
Energy: 1.4147510263951824
Energy: 1.2851987929487731
Energy: 1.4147510263951824
Energy: 1.3473202137669198
Energy: 1.3783584688099362
Energy: 1.395351891240886
Energy: 1.3783584688099362
Energy: 1.3473202137669198
Energy: 1.3783584688099362
Energy: 1.3301493279917829
Energy: 1.4318532052290134
Energy: 1.6384644314753671
Energy: 1.4318532052290134
Energy: 1.3301493279917829
Energy: 1.4318532052299622
Energy: 1.6385182862264915
Energy: 1.4319160828219066
Energy: 1.3301419485763684
Energy: 1.4319160828219066
Energy: 1.6385182862264915
Energy: 1.4319160828219066
Energy: 1.395527732943191
Energy: 1.378365805687434
Energy: 1.3299736290467008
Energy: 1.378365805687434
Energy: 1.3955277329450886
Energy: 1.378365805687434
Energy: 1.395617649902981
Energy: 1.4147483765575346
Energy: 1.285068224950181
Energy: 1.4147483765575346
Energy: 1.395617649902981
Energy: 1.4147483765575346
Energy: 1.4024076320376355
Energy: 1.4028042613448084
Energy: 1.3328120790494995
Energy: 1.4028042613448084
Energy: 1.4024076320376355
Energy: 1.4028042613448084
Energy: 1.4186288232519952
Energy: 1.4356769250526207
Energy: 1.5988340198327675
Energy: 1.4356769250526207
Energy: 1.4186288232519952
Energy: 1.4356769250526207
Energy: 1.4025592197252332
Energy: 1.4028560123935132
Energy: 1.302650934984222
Energy: 1.4028560123935132
Energy: 1.4025592197252332
Energy: 1.4028560123935132
Energy: 1.395542384609844
Energy: 1.4147510263951824
Energy: 1.2851987929487731
Energy: 1.4147510263951824
Energy: 1.395542384609844
Energy: 1.4147510263951824
Energy: 1.395351891240886
Energy: 1.3783584688099362
Energy: 1.3299880777900464
Energy: 1.3783584688099362
Energy: 1.395351891240886
Energy: 1.3783584688099362
Energy: 1.6384644314744183
Energy: 1.4318532052299622
Energy: 1.3301493279917829
Energy: 1.4318532052299622
Energy: 1.6384644314744183
Energy: 1.4318532052290134
Energy: 1.3301419485773172
Energy: 1.4319160828219066
Energy: 1.569974944878261
Energy: 1.4319160828219066
Energy: 1.3301419485773172
Energy: 1.4319160828219066
Energy: 1.347006628288049
Energy: 1.378365805687434
Energy: 1.3955277329441396
Energy: 1.378365805687434
Energy: 1.347006628288049
Energy: 1.378365805687434
Energy: 1.285068224950181
Energy: 1.4147483765575346
Energy: 1.395617649902981
Energy: 1.4147483765575346
Energy: 1.285068224950181
Energy: 1.4147483765575346
Energy: 1.3328120790494995
Energy: 1.4028042613448084
Energy: 1.4024076320376355
Energy: 1.4028042613448084
Energy: 1.3328120790494995
Energy: 1.4028042613448084
Energy: 1.5988340198327675
Energy: 1.4356769250526207
Energy: 1.4186288232519952
Energy: 1.4356769250526207
Energy: 1.5988340198327675
Energy: 1.4356769250526207
Energy: 1.302650934984222
Energy: 1.4028560123935132
Energy: 1.4025592197252332
Energy: 1.4028560123935132
Energy: 1.302650934984222
Energy: 1.4028560123935132
Energy: 1.2851987929487731
Energy: 1.4147510263951824
Energy: 1.395542384609844
Energy: 1.4147510263951824
Energy: 1.2851987929487731
Energy: 1.4147510263942336
Energy: 1.3299880777900464
Energy: 1.3783584688099362
Energy: 1.395351891240886
Energy: 1.3783584688099362
Energy: 1.3299880777900464
Energy: 1.3783584688099362
Energy: 1.3301493279917829
Energy: 1.4318532052299622
Energy: 1.6384644314744183
Energy: 1.4318532052290134
Energy: 1.3301493279917829
Energy: 1.4318532052290134
Energy: 1.4936100543642656
Energy: 1.4319160828219066
Energy: 1.3301419485763684
Energy: 1.4319160828219066
Energy: 1.4936100543642656
Energy: 1.4319160828228552
Energy: 1.3955277329441396
Energy: 1.378365805687434
Energy: 1.3629156870285966
Energy: 1.378365805687434
Energy: 1.395527732943191
Energy: 1.378365805687434
Energy: 1.395617649902981
Energy: 1.4147483765575346
Energy: 1.285068224950181
Energy: 1.4147483765575346
Energy: 1.395617649902981
Energy: 1.4147483765575346
Energy: 1.4024076320376355
Energy: 1.4028042613448084
Energy: 1.3328120790494995
Energy: 1.4028042613448084
Energy: 1.4024076320376355
Energy: 1.4028042613448084
Energy: 1.4186288232519952
Energy: 1.4356769250526207
Energy: 1.5988340198327675
Energy: 1.4356769250526207
Energy: 1.4186288232519952
Energy: 1.4356769250526207
Energy: 1.4025592197252332
Energy: 1.4028560123935132
Energy: 1.302650934984222
Energy: 1.4028560123935132
Energy: 1.4025592197252332
Energy: 1.4028560123935132
Energy: 1.395542384609844
Energy: 1.4147510263951824
Energy: 1.2851987929487731
Energy: 1.4147510263951824
Energy: 1.395542384609844
Energy: 1.4147510263951824

minimum gb energy = 1.285068224950181 eV
minimum distance =  2.22049406905502 Angstroms
sigma value = 27


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

Energy: 1.1568161710358995
Energy: 1.3102572509420256
Energy: 1.4845020118779735
Energy: 1.3102572509424746
Energy: 1.1568161710358995
Energy: 1.3102572509422366
Energy: 1.1525972198670502
Energy: 1.2821968519916607
Energy: 1.227325011320258
Energy: 1.2821968519918987
Energy: 1.1525972198670502
Energy: 1.2821968519918987
Energy: 1.1961099560914417
Energy: 1.5323278279304617
Energy: 1.1969708967316968
Energy: 1.5323278279304617
Energy: 1.1961099560914417
Energy: 1.5323278279304617
Energy: 1.1536466788510968
Energy: 1.3145992984131674
Energy: 1.1969384081616143
Energy: 1.3145992984131674
Energy: 1.1536466788513349
Energy: 1.3145992984131674
Energy: 1.2276169275752802
Energy: 1.310796846388525
Energy: 1.2259904379774373
Energy: 1.310796846388525
Energy: 1.2276169275750424
Energy: 1.3107968463887625
Energy: 1.1959665307457437
Energy: 1.3725112223145728
Energy: 1.2256170521248273
Energy: 1.3725112223150482
Energy: 1.1959665307455323
Energy: 1.3725112223145728
Energy: 1.1964913716339243
Energy: 1.2890916881051848
Energy: 1.196233245544274
Energy: 1.289091688104947
Energy: 1.1964913716339243
Energy: 1.2890916881051848
Energy: 1.1543910897088485
Energy: 1.3139569045403536
Energy: 1.2273197927047772
Energy: 1.313956904540591
Energy: 1.154391089708611
Energy: 1.313956904540591
Energy: 1.1962583376263778
Energy: 1.3113728840925913
Energy: 1.1962224448957548
Energy: 1.3113728840925913
Energy: 1.1962583376266154
Energy: 1.31137288409238
Energy: 1.1962057322946038
Energy: 1.537250963262473
Energy: 1.1961990121172568
Energy: 1.537250963262711
Energy: 1.1962057322946038
Energy: 1.537250963262711
Energy: 1.1525000953071585
Energy: 1.3113727028668827
Energy: 1.1962926526116464
Energy: 1.3113727028668827
Energy: 1.1525000953069204
Energy: 1.3113727028668827
Energy: 1.2272960690090833
Energy: 1.3139855239688087
Energy: 1.1544065004663815
Energy: 1.3139855239685971
Energy: 1.2272960690088457
Energy: 1.3139855239688087

minimum gb energy = 1.1525000953069204 eV
minimum distance =  2.25093327447489 Angstroms
sigma value = 9


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

Energy: 1.6317014627210678
Energy: 1.5101599539219228
Energy: 1.293799792279988
Energy: 1.5101599539219228
Energy: 1.6317014627217206
Energy: 1.5101599539212698
Energy: 1.342373974084108
Energy: 1.4662337461881518
Energy: 1.3123286417463798
Energy: 1.4478113697323542
Energy: 1.342373974084108
Energy: 1.4836440173265937
Energy: 1.2988518331929144
Energy: 1.52113416067563
Energy: 1.3162753012216442
Energy: 1.52113416067563
Energy: 1.2988518331929144
Energy: 1.52113416067563
Energy: 1.295710850676391
Energy: 1.4783148448216545
Energy: 1.2605051038788397
Energy: 1.4783148448223076
Energy: 1.295710850676391
Energy: 1.4783148448216545
Energy: 1.265450451086704
Energy: 1.5063944207175373
Energy: 1.2611716532799593
Energy: 1.5063944207175373
Energy: 1.265450451086704
Energy: 1.50639442071819
Energy: 1.237343372931126
Energy: 1.4663780733086662
Energy: 1.2963185565183615
Energy: 1.4385260723612867
Energy: 1.237343372931126
Energy: 1.4663780733086662
Energy: 1.357432998212392
Energy: 1.4883607181741862
Energy: 1.2862121027772664
Energy: 1.4883607181741862
Energy: 1.357432998213045
Energy: 1.4883607181741862
Energy: 1.44867839973904
Energy: 1.4773218669851673
Energy: 1.356405481400005
Energy: 1.4773218669845143
Energy: 1.44867839973904
Energy: 1.4773218669845143
Energy: 1.344337728074634
Energy: 1.517942528387704
Energy: 1.323948571943524
Energy: 1.517942528387051
Energy: 1.344337728074634
Energy: 1.517942528387051
Energy: 1.4419315407589506
Energy: 1.5195346583962392
Energy: 1.265798892488109
Energy: 1.5195346583962392
Energy: 1.4419315407596036
Energy: 1.5195346583962392
Energy: 1.4052909476694424
Energy: 1.4810128996767908
Energy: 1.311255928606413
Energy: 1.4810128996774437
Energy: 1.4052909476694424
Energy: 1.4810128996780967
Energy: 1.3182460990167941
Energy: 1.4881843425741015
Energy: 1.2985009189573993
Energy: 1.4881843425741015
Energy: 1.3182460990167941
Energy: 1.4881843425741015
Energy: 1.265433574372874
Energy: 1.4142229616906719
Energy: 1.2661668808612756
Energy: 1.4142229616906719
Energy: 1.2654335743735268
Energy: 1.4142229616906719
Energy: 1.3659115774064217
Energy: 1.519544703403334
Energy: 1.2256733812250773
Energy: 1.5195447034026812
Energy: 1.3659115774064217
Energy: 1.5195447034026812
Energy: 1.3165168956590185
Energy: 1.5319082366510128
Energy: 1.303575218266303
Energy: 1.5319082366510128
Energy: 1.3165168956590185
Energy: 1.5319082366510128
Energy: 1.3200345472301986
Energy: 1.4727217436251305
Energy: 1.2986748139032103
Energy: 1.4727217436257836
Energy: 1.3200345472301986
Energy: 1.4727217436251305
Energy: 1.438452128806859
Energy: 1.5242660645358987
Energy: 1.2663786039688874
Energy: 1.5242660645358987
Energy: 1.438452128806859
Energy: 1.5242660645358987
Energy: 1.2550895837794043
Energy: 1.407777570552273
Energy: 1.3152883884189353
Energy: 1.407777570552273
Energy: 1.2550895837787512
Energy: 1.407777570552273
Energy: 1.45347334064124
Energy: 1.5189287183195685
Energy: 1.2352626875986998
Energy: 1.5189287183195685
Energy: 1.453473340641893
Energy: 1.5189287183195685
Energy: 1.2699173869323315
Energy: 1.5375030088908073
Energy: 1.2699052655888077
Energy: 1.5375030088908073
Energy: 1.2699173869316787
Energy: 1.5375030088914605
Energy: 1.2352564647275124
Energy: 1.519141020549151
Energy: 1.4534419105348266
Energy: 1.5191410205498037
Energy: 1.2352564647275124
Energy: 1.5191410205498037
Energy: 1.3152460132507522
Energy: 1.4077407832871078
Energy: 1.2552281784291963
Energy: 1.407740783286455
Energy: 1.3152460132507522
Energy: 1.407740783286455
Energy: 1.2662053623780263
Energy: 1.5242455814579097
Energy: 1.4384597923446587
Energy: 1.5242455814579097
Energy: 1.2662053623780263
Energy: 1.5242455814579097
Energy: 1.2986796790096182
Energy: 1.4726758920987106
Energy: 1.3200027298325243
Energy: 1.4726758920987106
Energy: 1.2986796790089654
Energy: 1.4726758920987106
Energy: 1.303560075329623
Energy: 1.5321619517354286
Energy: 1.316548857381689
Energy: 1.5321619517354286
Energy: 1.303560075329623
Energy: 1.5321619517354286
Energy: 1.2256949297228896
Energy: 1.5195682697378572
Energy: 1.4021133101168402
Energy: 1.5195682697378572
Energy: 1.2256949297228896
Energy: 1.5195682697378572
Energy: 1.266219732255155
Energy: 1.414315612754023
Energy: 1.2654524923707866
Energy: 1.414315612754023
Energy: 1.266219732255155
Energy: 1.41431561275337
Energy: 1.2985502945726377
Energy: 1.488194188813741
Energy: 1.3182465393458844
Energy: 1.488194188813741
Energy: 1.2985502945726377
Energy: 1.488194188813741
Energy: 1.3111611141254895
Energy: 1.4810192869444323
Energy: 1.3136086549256565
Energy: 1.4810192869444323
Energy: 1.3111611141254895
Energy: 1.4810192869444323
Energy: 1.2657759651502225
Energy: 1.5195299999635272
Energy: 1.4418686030121777
Energy: 1.5195299999635272
Energy: 1.2657759651502225
Energy: 1.5195299999635272
Energy: 1.32331261443573
Energy: 1.51794252838901
Energy: 1.3443531775905726
Energy: 1.517942528388357
Energy: 1.32331261443573
Energy: 1.517942528388357
Energy: 1.3564248464779756
Energy: 1.4772203410309206
Energy: 1.4485361000747679
Energy: 1.4772203410309206
Energy: 1.3564248464779756
Energy: 1.4772203410309206
Energy: 1.286078850285036
Energy: 1.4883146064140798
Energy: 1.5215203470557677
Energy: 1.4883146064140798
Energy: 1.286078850285036
Energy: 1.4883146064140798
Energy: 1.296399325108757
Energy: 1.4132138660095026
Energy: 1.2373628760309043
Energy: 1.4132138660095026
Energy: 1.296399325108757
Energy: 1.4132138660095026
Energy: 1.2940011490243604
Energy: 1.5063677366974215
Energy: 1.2654602797241112
Energy: 1.5063677366980746
Energy: 1.2940011490237073
Energy: 1.5063677366980746
Energy: 1.2604378427412828
Energy: 1.4782727346564526
Energy: 1.2957237869705183
Energy: 1.4782727346571056
Energy: 1.2604378427412828
Energy: 1.4782727346571056
Energy: 1.316223104072366
Energy: 1.5210730732230549
Energy: 1.2988568796642441
Energy: 1.5210730732237077
Energy: 1.316223104072366
Energy: 1.5210730732237077
Energy: 1.31244578780131
Energy: 1.44781136973366
Energy: 1.3425857048834506
Energy: 1.4478113697330073
Energy: 1.31244578780131
Energy: 1.44781136973366
Energy: 1.3348416634635845
Energy: 1.5101599539212698
Energy: 1.6317014627210678
Energy: 1.5101599539212698
Energy: 1.3348416634629314
Energy: 1.5101599539212698
Energy: 1.3123286417463798
Energy: 1.4836440173265937
Energy: 1.342373974084108
Energy: 1.4836440173265937
Energy: 1.3123286417463798
Energy: 1.4836440173272467
Energy: 1.3162753012216442
Energy: 1.52113416067563
Energy: 1.2988518331935675
Energy: 1.52113416067563
Energy: 1.3162753012222972
Energy: 1.5211341606762827
Energy: 1.2605051038794925
Energy: 1.4783148448216545
Energy: 1.295710850676391
Energy: 1.4783148448223076
Energy: 1.2605051038794925
Energy: 1.4783148448223076
Energy: 1.2611716532786534
Energy: 1.50639442071819
Energy: 1.2654504510873568
Energy: 1.5063944207175373
Energy: 1.2611716532786534
Energy: 1.5063944207175373

minimum gb energy = 1.2256733812250773 eV
minimum distance =  2.20977932952246 Angstroms
sigma value = 57


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

Energy: 1.3575563272407374
Energy: 1.4773620771653955
Energy: 1.3412510577353185
Energy: 1.4773620771653955
Energy: 1.357556327239251
Energy: 1.4773620771653955
Energy: 1.0997538419260657
Energy: 1.4180180507004385
Energy: 1.134194554876696
Energy: 1.4180180507004385
Energy: 1.0997538419275525
Energy: 1.4180180507004385
Energy: 1.0919068604160285
Energy: 1.4153575261083302
Energy: 1.1349406948243561
Energy: 1.4153575261083302
Energy: 1.0919068604160285
Energy: 1.4153575261083302
Energy: 1.1333753201126702
Energy: 1.424812953600512
Energy: 1.2007209850044236
Energy: 1.424812953600512
Energy: 1.1333753201141565
Energy: 1.424812953600512
Energy: 1.1334767537955859
Energy: 1.4780565151404745
Energy: 1.1341032362226406
Energy: 1.4780565151404745
Energy: 1.1334767537955859
Energy: 1.478056515138988
Energy: 1.1336607846568831
Energy: 1.4157027821467223
Energy: 1.0900512058675884
Energy: 1.4157027821452357
Energy: 1.1336607846568831
Energy: 1.4157027821467223
Energy: 1.133624716991428
Energy: 1.4157413234800325
Energy: 1.090513886149401
Energy: 1.4157413234800325
Energy: 1.133624716991428
Energy: 1.4157413234800325
Energy: 1.13347482114194
Energy: 1.4779864354354566
Energy: 1.2005561056626712
Energy: 1.4779864354354566
Energy: 1.13347482114194
Energy: 1.4779864354354566
Energy: 1.1332896452008574
Energy: 1.423627127115981
Energy: 1.1336842058918999
Energy: 1.423627127115981
Energy: 1.1332896452023442
Energy: 1.423627127115981
Energy: 1.0920106520793587
Energy: 1.4153551450400417
Energy: 1.1345517673115177
Energy: 1.4153551450415283
Energy: 1.0920106520793587
Energy: 1.4153551450415283
Energy: 1.0998680683788935
Energy: 1.418018050701925
Energy: 1.2259032989295946
Energy: 1.418018050701925
Energy: 1.09986806838038
Energy: 1.418018050701925
Energy: 1.3575563272407374
Energy: 1.4773620771639089
Energy: 1.194759828625695
Energy: 1.4773620771639089
Energy: 1.357556327239251
Energy: 1.4773620771639089
Energy: 1.0997538419275525
Energy: 1.4180180507004385
Energy: 1.134194554876696
Energy: 1.4180180507004385
Energy: 1.0997538419275525
Energy: 1.4180180507004385
Energy: 1.0919068604160285
Energy: 1.4153575261083302
Energy: 1.1349406948228695
Energy: 1.4153575261083302
Energy: 1.0919068604160285
Energy: 1.4153575261083302
Energy: 1.1333753201141565
Energy: 1.424812953600512
Energy: 1.1404284908341622
Energy: 1.424812953600512
Energy: 1.1333753201126702
Energy: 1.424812953600512
Energy: 1.1334767537955859
Energy: 1.4780565151404745
Energy: 1.1341032362226406
Energy: 1.4780565151404745
Energy: 1.1334767537940995
Energy: 1.4780565151404745
Energy: 1.1336607846568831
Energy: 1.4157027821467223
Energy: 1.0900512058675884
Energy: 1.4157027821467223
Energy: 1.1336607846568831
Energy: 1.4157027821467223
Energy: 1.133624716991428
Energy: 1.4157413234800325
Energy: 1.090513886149401
Energy: 1.4157413234800325
Energy: 1.133624716991428
Energy: 1.4157413234800325
Energy: 1.13347482114194
Energy: 1.4779864354354566
Energy: 1.1407871298069328
Energy: 1.4779864354354566
Energy: 1.13347482114194
Energy: 1.4779864354354566

minimum gb energy = 1.0900512058675884 eV
minimum distance =  2.20627710180135 Angstroms
sigma value = 11


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

Energy: 1.187054629891461
Energy: 1.3889796589305774
Energy: 1.1746073488444881
Energy: 1.3889796589305774
Energy: 1.187054629891461
Energy: 1.3889796589305774
Energy: 1.025846592769395
Energy: 1.348102608233769
Energy: 1.0229017095276112
Energy: 1.348102608233769
Energy: 1.025846592769395
Energy: 1.348102608233769
Energy: 1.1868453992993302
Energy: 1.3317820417053061
Energy: 1.1198648191689313
Energy: 1.3317820417042172
Energy: 1.1868453992993302
Energy: 1.3317820417053061
Energy: 1.0332754512508673
Energy: 1.3221530638190906
Energy: 1.0241275912684953
Energy: 1.3221530638201793
Energy: 1.0332754512508673
Energy: 1.3221530638190906
Energy: 1.023629369169588
Energy: 1.388617494536505
Energy: 1.1048078625097892
Energy: 1.388617494536505
Energy: 1.023629369169588
Energy: 1.388617494536505
Energy: 1.0512402749042375
Energy: 1.3556037007215676
Energy: 1.022797864423185
Energy: 1.3556037007215676
Energy: 1.0512402749042375
Energy: 1.3556037007215676
Energy: 1.0499196426952624
Energy: 1.367069349596128
Energy: 1.0231603315562523
Energy: 1.367069349596128
Energy: 1.0499196426941733
Energy: 1.367069349596128
Energy: 1.054797896607529
Energy: 1.3894889378587543
Energy: 1.0372268136827332
Energy: 1.389488937856577
Energy: 1.054797896607529
Energy: 1.3894889378576658
Energy: 1.0545703386276246
Energy: 1.3886046092934572
Energy: 1.0233248028916804
Energy: 1.3886046092934572
Energy: 1.0545703386276246
Energy: 1.3886046092934572
Energy: 1.051384032561354
Energy: 1.333136575185071
Energy: 1.022879154411892
Energy: 1.333136575185071
Energy: 1.051384032561354
Energy: 1.333136575185071
Energy: 1.049908688951765
Energy: 1.354133436162886
Energy: 1.0229696770738375
Energy: 1.354133436163975
Energy: 1.049908688951765
Energy: 1.354133436163975
Energy: 1.0249145008815572
Energy: 1.3890892964222055
Energy: 1.0232523795708264
Energy: 1.3890892964222055
Energy: 1.0249145008815572
Energy: 1.3890892964222055
Energy: 1.0594432053451261
Energy: 1.2181854580594675
Energy: 1.0498700427524885
Energy: 1.2181854580594675
Energy: 1.0594432053451261
Energy: 1.2181854580594675
Energy: 1.187253128937708
Energy: 1.3321426935155858
Energy: 1.0541483310614441
Energy: 1.3321426935155858
Energy: 1.187253128937708
Energy: 1.3321426935144969
Energy: 1.0294658836445172
Energy: 1.3493002261245373
Energy: 1.0229103348137873
Energy: 1.3493002261245373
Energy: 1.0294658836445172
Energy: 1.3493002261245373
Energy: 1.1878753633904422
Energy: 1.3902391622757937
Energy: 1.0545441691648603
Energy: 1.3902391622757937
Energy: 1.1878753633904422
Energy: 1.3902391622757937
Energy: 1.0324106870624288
Energy: 1.3474492891664194
Energy: 1.0504166444791734
Energy: 1.3474492891664194
Energy: 1.0324106870624288
Energy: 1.3474492891664194
Energy: 1.1873686748899583
Energy: 1.3321583403590305
Energy: 1.088563737363977
Energy: 1.3321583403568527
Energy: 1.1873686748888697
Energy: 1.3321583403579418
Energy: 1.0341157196381494
Energy: 1.3211004311925436
Energy: 1.0231491747822794
Energy: 1.3211004311925436
Energy: 1.0341157196370605
Energy: 1.3211004311925436
Energy: 1.024828860452495
Energy: 1.3894036191805132
Energy: 1.050478015062057
Energy: 1.3894036191805132
Energy: 1.024828860452495
Energy: 1.3894036191805132
Energy: 1.2214802124974222
Energy: 1.3592813454284454
Energy: 1.0232703643763168
Energy: 1.3592813454284454
Energy: 1.2214802124974222
Energy: 1.3592813454284454
Energy: 1.0515019476914897
Energy: 1.3661031537922839
Energy: 1.023427446259767
Energy: 1.366103153791195
Energy: 1.0515019476925787
Energy: 1.366103153791195
Energy: 1.0544231598095386
Energy: 1.3919744821038973
Energy: 1.0372299982727164
Energy: 1.3919744821038973
Energy: 1.0544231598084497
Energy: 1.3919744821038973
Energy: 1.0252498522317857
Energy: 1.3894208792750617
Energy: 1.0231091724242687
Energy: 1.3894208792750617
Energy: 1.0252498522317857
Energy: 1.3894208792750617
Energy: 1.0553029779723035
Energy: 1.3328516052855741
Energy: 1.0234314598980625
Energy: 1.332851605286663
Energy: 1.0553029779723035
Energy: 1.3328516052855741
Energy: 1.0513778448848656
Energy: 1.3555479034244513
Energy: 1.0230361406268969
Energy: 1.3555479034244513
Energy: 1.051377844883777
Energy: 1.3555479034244513

minimum gb energy = 1.022797864423185 eV
minimum distance =  2.24744112456153 Angstroms
sigma value = 41


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

Energy: 1.3953112749487442
Energy: 1.33857091364249
Energy: 0.9746618147951469
Energy: 1.3385709136416317
Energy: 1.3953112749496024
Energy: 1.3385709136416317
Energy: 1.235473410735821
Energy: 1.2365007137782034
Energy: 0.9388819888022377
Energy: 1.2365007137782034
Energy: 1.2354734107366792
Energy: 1.2365007137782034
Energy: 1.047109401183411
Energy: 1.2745325228773356
Energy: 0.9750346774106442
Energy: 1.2745325228773356
Energy: 1.047109401183411
Energy: 1.2745325228773356
Energy: 1.1022224554816444
Energy: 1.203361806420122
Energy: 0.9389839377884189
Energy: 1.203361806420122
Energy: 1.1022224554816444
Energy: 1.203361806420122
Energy: 1.0573592769643048
Energy: 1.2053764977546222
Energy: 1.0068326812173822
Energy: 1.2053764977546222
Energy: 1.0573592769643048
Energy: 1.2053764977546222
Energy: 1.272552504559121
Energy: 1.2704362931394
Energy: 0.9388625206912851
Energy: 1.2704362931402582
Energy: 1.272552504559121
Energy: 1.2704362931402582
Energy: 0.9400171441939541
Energy: 1.2737938961550364
Energy: 0.9386540344525156
Energy: 1.2737938961541784
Energy: 0.9400171441939541
Energy: 1.2737938961541784
Energy: 1.1372625238757539
Energy: 1.3050968598388177
Energy: 0.9431009896843483
Energy: 1.3050968598388177
Energy: 1.1372625238757539
Energy: 1.3050968598388177
Energy: 0.9746980810301928
Energy: 1.2561800151740221
Energy: 1.2352175546739952
Energy: 1.2561800151740221
Energy: 0.9746980810301928
Energy: 1.2561800151740221
Energy: 1.2793145140070237
Energy: 1.274541154074768
Energy: 1.2365990749445503
Energy: 1.274541154075626
Energy: 1.2793145140070237
Energy: 1.274541154075626
Energy: 1.2782858125342604
Energy: 1.300771766259503
Energy: 1.2364018949589637
Energy: 1.300771766259503
Energy: 1.2782858125334022
Energy: 1.300771766259503
Energy: 0.9782059993321526
Energy: 1.3041317932086964
Energy: 0.9432244647496606
Energy: 1.3114047341286506
Energy: 0.9782059993321526
Energy: 1.3041317932095546
Energy: 0.9748776124424655
Energy: 1.2470447176007222
Energy: 1.1664750888336037
Energy: 1.247044717599864
Energy: 0.9748776124424655
Energy: 1.247044717599864
Energy: 0.9389992884935284
Energy: 1.2746901517846305
Energy: 0.9390756923548584
Energy: 1.2746901517846305
Energy: 0.9389992884935284
Energy: 1.2746901517846305
Energy: 1.2716616565583496
Energy: 1.2723790269453121
Energy: 0.9390628876282254
Energy: 1.2723790269453121
Energy: 1.2716616565583496
Energy: 1.2723790269453121
Energy: 1.0593999303962225
Energy: 1.305198141098138
Energy: 0.9388188859009188
Energy: 1.305198141098138
Energy: 1.0593999303962225
Energy: 1.305198141098138
Energy: 1.2356801395745167
Energy: 1.2708601576207204
Energy: 1.0072957870885144
Energy: 1.2708601576207204
Energy: 1.235680139573658
Energy: 1.2708601576207204
Energy: 1.046992771243456
Energy: 1.2739557948089035
Energy: 0.9749142840318471
Energy: 1.273955794809762
Energy: 1.046992771243456
Energy: 1.273955794809762
Energy: 1.23533958813293
Energy: 1.2365655441722816
Energy: 0.938855547542924
Energy: 1.2365655441722816
Energy: 1.23533958813293
Energy: 1.2365655441722816
Energy: 1.2367131384219991
Energy: 1.2737962853449627
Energy: 1.132901250189979
Energy: 1.273796285345821
Energy: 1.2367131384219991
Energy: 1.273796285345821
Energy: 1.2326703289327077
Energy: 1.2390703912270544
Energy: 0.9748880834248573
Energy: 1.2390703912270544
Energy: 1.2326703289327077
Energy: 1.2390703912270544
Energy: 1.0483179483172127
Energy: 1.2738449021642506
Energy: 0.9748885492825732
Energy: 1.2738449021642506
Energy: 1.0483179483180707
Energy: 1.2738449021642506
Energy: 1.271974745262092
Energy: 1.205553483120542
Energy: 0.938827629842593
Energy: 1.205553483120542
Energy: 1.271974745262092
Energy: 1.205553483120542
Energy: 1.0591052248439683
Energy: 1.2464690166252979
Energy: 0.9751394529766026
Energy: 1.2464690166252979
Energy: 1.0591052248439683
Energy: 1.2464690166252979
Energy: 0.9759136352333933
Energy: 1.246377013499041
Energy: 0.9386370144659472
Energy: 1.246377013499041
Energy: 0.9759136352333933
Energy: 1.246377013499041
Energy: 0.9390254159038068
Energy: 1.2038640440034367
Energy: 0.9389770198163825
Energy: 1.203864044004295
Energy: 0.9390254159038068
Energy: 1.2038640440034367
Energy: 1.1363912710035873
Energy: 1.2741152651790724
Energy: 0.9429493163250893
Energy: 1.2741152651790724
Energy: 1.1363912710035873
Energy: 1.2741152651790724
Energy: 0.9748387307980891
Energy: 1.247376030810201
Energy: 1.2354252090912694
Energy: 1.247376030810201
Energy: 0.974838730797231
Energy: 1.247376030810201
Energy: 1.1340223708094996
Energy: 1.2738114612728886
Energy: 1.2363296158464643
Energy: 1.2738114612728886
Energy: 1.1340223708094996
Energy: 1.2738114612720306
Energy: 0.939053048259012
Energy: 1.2048964044119412
Energy: 1.2366458000305884
Energy: 1.2048964044119412
Energy: 0.939053048259012
Energy: 1.2048964044119412
Energy: 0.9747946958441438
Energy: 1.2738835612736283
Energy: 0.9426176320143614
Energy: 1.2738835612736283
Energy: 0.9747946958441438
Energy: 1.2738835612736283
Energy: 0.9749187755173516
Energy: 1.2824840718871735
Energy: 1.2356172132578458
Energy: 1.2824840718871735
Energy: 0.9749187755173516
Energy: 1.2824840718871735
Energy: 0.9390212034652707
Energy: 1.2737423043260587
Energy: 0.9386618210416936
Energy: 1.2737423043260587
Energy: 0.9390212034652707
Energy: 1.2737423043260587

minimum gb energy = 0.9386370144659472 eV
minimum distance =  2.23418684881733 Angstroms
sigma value = 33


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

Energy: 1.167433045112261
Energy: 1.1551631578154355
Energy: 0.8785680169331068
Energy: 1.1551631578148334
Energy: 1.1674330451128634
Energy: 1.1551631578148334
Energy: 1.7170849458258672
Energy: 1.0688835295897492
Energy: 0.8388364494297113
Energy: 1.0688835295891472
Energy: 1.7170849458258672
Energy: 1.0688835295891472
Energy: 1.1487461511673074
Energy: 1.1614246813950024
Energy: 0.8574586482759465
Energy: 1.1614246813944002
Energy: 1.1487461511673074
Energy: 1.1614246813944002
Energy: 1.4339254805498416
Energy: 1.0492097430574252
Energy: 0.8386191874119658
Energy: 1.049209743056823
Energy: 1.4339254805492394
Energy: 1.0492097430574252
Energy: 0.9156579828343459
Energy: 1.1368103785908685
Energy: 0.8617786546494804
Energy: 1.136810378591471
Energy: 0.9156579828343459
Energy: 1.136810378591471
Energy: 1.309734525324333
Energy: 1.1220722344596394
Energy: 0.838791381809158
Energy: 1.1220722344602418
Energy: 1.309734525324333
Energy: 1.1220722344602418
Energy: 0.9074046871723579
Energy: 1.104070524426059
Energy: 0.8388010659363967
Energy: 1.104070524426059
Energy: 0.9074046871723579
Energy: 1.104070524426059
Energy: 1.175950351395944
Energy: 0.9935398977372103
Energy: 0.8352219041835987
Energy: 0.9935398977366082
Energy: 1.175950351395944
Energy: 0.9935398977354035
Energy: 0.8368466650879962
Energy: 1.1446189756766605
Energy: 1.0523001552082771
Energy: 1.144618975677865
Energy: 0.8368466650879962
Energy: 1.144618975677865
Energy: 1.0722610460498152
Energy: 1.158386892961776
Energy: 1.0472492904006763
Energy: 1.1583868929623784
Energy: 1.0722610460498152
Energy: 1.1583868929623784
Energy: 0.8389306293616713
Energy: 1.1232406480977408
Energy: 1.0477481003211055
Energy: 1.123240648096536
Energy: 0.8389306293622736
Energy: 1.1232406480971384
Energy: 1.324799647912342
Energy: 1.1577923648764998
Energy: 1.0564069935162093
Energy: 1.1577923648777044
Energy: 1.3247996479129445
Energy: 1.1577923648777044
Energy: 1.0543094735505458
Energy: 1.1444957500020747
Energy: 1.3000584035095717
Energy: 1.144495750002677
Energy: 1.0543094735505458
Energy: 1.144495750002677
Energy: 1.0777237173618086
Energy: 1.1766547980931163
Energy: 1.303363991492744
Energy: 1.1766547980931163
Energy: 1.0777237173612064
Energy: 1.1766547980931163
Energy: 1.0740591730029507
Energy: 1.1231981125593193
Energy: 1.303734667982078
Energy: 1.1231981125599217
Energy: 1.0740591730029507
Energy: 1.1231981125605242
Energy: 1.0587421172749194
Energy: 1.1571370763325526
Energy: 1.0563812091318698
Energy: 1.1571370763325526
Energy: 1.0587421172749194
Energy: 1.1571370763325526
Energy: 1.0544471082164384
Energy: 1.152220576235448
Energy: 1.2997678596881377
Energy: 1.1522205762366524
Energy: 1.054447108215836
Energy: 1.15222057623605
Energy: 0.8439754955570347
Energy: 1.176446009077739
Energy: 1.0473148268104937
Energy: 1.176446009077739
Energy: 0.8439754955564325
Energy: 1.176446009077739
Energy: 1.074143125850768
Energy: 1.1522842860059224
Energy: 1.0471085678014513
Energy: 1.1522842860059224
Energy: 1.074143125850768
Energy: 1.1522842860059224
Energy: 0.8412020265966791
Energy: 1.157712835721438
Energy: 0.8353223273472602
Energy: 1.15771283572204
Energy: 0.8412020265966791
Energy: 1.157712835721438
Energy: 1.0546815913704266
Energy: 1.1448015896954928
Energy: 1.0519889444526211
Energy: 1.1448015896960952
Energy: 1.0546815913704266
Energy: 1.1448015896954928
Energy: 0.9107451103072757
Energy: 1.1764378725811175
Energy: 0.8386513812514329
Energy: 1.1764378725811175
Energy: 0.9107451103072757
Energy: 1.1764378725811175
Energy: 1.3147576220935981
Energy: 1.1620707883798505
Energy: 0.8441670539192931
Energy: 1.1620707883798505
Energy: 1.3147576220935981
Energy: 1.1620707883792483
Energy: 0.9182283864087135
Energy: 1.1692510382994785
Energy: 0.8385720309172688
Energy: 1.1692510382994785
Energy: 0.9182283864087135
Energy: 1.1692510382994785
Energy: 1.2999266323155128
Energy: 1.1440900310450448
Energy: 1.0552505522284998
Energy: 1.1440900310450448
Energy: 1.2999266323149103
Energy: 1.1440900310450448
Energy: 1.0564675558334815
Energy: 1.176790433630357
Energy: 0.8568289772710664
Energy: 1.176790433630357
Energy: 1.0564675558328795
Energy: 1.176790433630357
Energy: 1.5808834905812192
Energy: 1.0479627975734425
Energy: 0.8438093141011079
Energy: 1.0479627975734425
Energy: 1.5808834905812192
Energy: 1.0479627975734425
Energy: 1.080227888175058
Energy: 1.1750506734716581
Energy: 0.9748637571533372
Energy: 1.1750506734710555
Energy: 1.0802278881756604
Energy: 1.1750506734710555
Energy: 1.3021290291372432
Energy: 1.1224145015474525
Energy: 1.0553078579574222
Energy: 1.1224145015480547
Energy: 1.3021290291372432
Energy: 1.1224145015480547
Energy: 1.0568396536406008
Energy: 1.1766789505057789
Energy: 0.8908665810189795
Energy: 1.1766789505057789
Energy: 1.0568396536399987
Energy: 1.1766789505057789
Energy: 1.3120905237791907
Energy: 1.0464490828786221
Energy: 0.8438346813791382
Energy: 1.0464490828786221
Energy: 1.3120905237785885
Energy: 1.0464490828786221
Energy: 0.9179636488543014
Energy: 1.1585121839427548
Energy: 0.8576797773020479
Energy: 1.1585121839421526
Energy: 0.9179636488543014
Energy: 1.1585121839421526
Energy: 1.053904033843107
Energy: 1.098825555135731
Energy: 0.8409549013342629
Energy: 1.0988255551363337
Energy: 1.0539040338443115
Energy: 1.098825555135731
Energy: 0.9100184912808974
Energy: 1.1047898238852927
Energy: 1.0745601628915091
Energy: 1.104789823884088
Energy: 0.9100184912808974
Energy: 1.1047898238846905
Energy: 1.074505887973364
Energy: 1.1046517558889555
Energy: 0.910252873679473
Energy: 1.1046517558889555
Energy: 1.0745058879727618
Energy: 1.1046517558889555
Energy: 0.8409597806236451
Energy: 1.09880683586911
Energy: 1.0538492617874815
Energy: 1.09880683586911
Energy: 0.8409597806230428
Energy: 1.09880683586911
Energy: 0.8577738001759342
Energy: 1.158514047525163
Energy: 0.9180440250730226
Energy: 1.1585140475257654
Energy: 0.857773800175332
Energy: 1.1585140475257654
Energy: 0.8438426747029838
Energy: 1.0464618163044332
Energy: 1.3122395671714384
Energy: 1.0464618163050352
Energy: 0.8438426747029838
Energy: 1.0464618163044332
Energy: 0.8908665810183772
Energy: 1.1766738589333943
Energy: 1.0567808892198007
Energy: 1.176673858932792
Energy: 0.8908665810183772
Energy: 1.1766738589321897
Energy: 0.9435239226607318
Energy: 1.122641767886112
Energy: 1.3021340872914913
Energy: 1.122641767886112
Energy: 0.9435239226613341
Energy: 1.122641767886112
Energy: 0.9748982092816838
Energy: 1.1750399038821717
Energy: 1.080163892137166
Energy: 1.1750399038827737
Energy: 0.9748982092822862
Energy: 1.1750399038827737
Energy: 0.8438264074019063
Energy: 0.9966087842130766
Energy: 1.5804324593855412
Energy: 0.9966087842124743
Energy: 0.8438264074019063
Energy: 0.9966087842124743
Energy: 0.8568311741491301
Energy: 1.17676800978662
Energy: 1.0566985602391217
Energy: 1.17676800978662
Energy: 0.8568311741491301
Energy: 1.17676800978662
Energy: 0.9432671948006045
Energy: 1.1440024076806823
Energy: 1.2999520252123968
Energy: 1.144002407681285
Energy: 0.9432671948006045
Energy: 1.144002407681285
Energy: 0.8386152528237714
Energy: 1.1691706704411637
Energy: 0.9182670019112569
Energy: 1.1691706704399591
Energy: 0.838615252823169
Energy: 1.1691706704399591
Energy: 0.8441872716594392
Energy: 1.1620707883804529
Energy: 1.3151749963884145
Energy: 1.1620707883810553
Energy: 0.8441872716588369
Energy: 1.1620707883804529
Energy: 0.8385130929198451
Energy: 1.1766412873532404
Energy: 0.9107130443195152
Energy: 1.1766412873532404
Energy: 0.8385130929192427
Energy: 1.1766412873532404

minimum gb energy = 0.8352219041835987 eV
minimum distance =  2.26711347195245 Angstroms
sigma value = 67


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

Energy: 0.2528207613363617
Energy: 0.2536128166218349
Energy: 1.678250068649023
Energy: 0.2536128166218349
Energy: 0.2528207613363617
Energy: 0.2536128166214232
Energy: 0.27434786261322025
Energy: 0.8586817258642309
Energy: 0.6599059839368875
Energy: 0.8586817258642309
Energy: 0.27434786261322025
Energy: 0.8586817258642309
Energy: 0.2528207613363617
Energy: 0.2536128166222466
Energy: 1.4734397264941745
Energy: 0.2536128166214232
Energy: 0.2528207613363617
Energy: 0.2536128166214232
Energy: 0.27434786261322025
Energy: 0.8586817258646424
Energy: 0.6599066475799958
Energy: 0.8586817258642309
Energy: 0.27434786261322025
Energy: 0.8586817258646424
Energy: 0.2528207613363617
Energy: 0.2536128166222466
Energy: 1.473439726495364
Energy: 0.2536128166214232
Energy: 0.2528207613363617
Energy: 0.2536128166218349
Energy: 0.274347862613632
Energy: 0.8586817258642309
Energy: 0.6599070152418973
Energy: 0.8586817258638191
Energy: 0.27434786261285427
Energy: 0.8586817258642309
Energy: 0.2528207613363617
Energy: 0.2536128166218349
Energy: 1.4734397264949524
Energy: 0.2536128166218349
Energy: 0.2528207613363617
Energy: 0.2536128166222466

minimum gb energy = 0.2528207613363617 eV
minimum distance =  2.4339068798779 Angstroms
sigma value = 3


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

Energy: 1.3837311324206885
Energy: 1.1521835574467698
Energy: 0.954582596102682
Energy: 1.1521835574467698
Energy: 1.3837311324201405
Energy: 1.1521835574473176
Energy: 1.651940187172871
Energy: 0.8615310176782687
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Energy: 1.274734549103541
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Energy: 1.274734549104089
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Energy: 1.2823988205749675
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Energy: 1.2823988205749675
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Energy: 1.3463536078318923
Energy: 1.1252854277738729
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Energy: 1.1163267583270675
Energy: 0.8517639789681881
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Energy: 1.0819505987433076
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Energy: 1.270807191138982
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Energy: 1.0833608089659366
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Energy: 1.0629289177703483
Energy: 1.0833608089653886
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Energy: 0.8632408854488701
Energy: 1.0925413177792949
Energy: 1.0317710730731342
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Energy: 1.0205960533316432
Energy: 1.0903149779887131
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Energy: 1.026235092744972
Energy: 1.1266450419605163
Energy: 1.0290133719626773
Energy: 1.126645041961064
Energy: 1.0262350927455202
Energy: 1.1266450419605163
Energy: 0.8409739742057549
Energy: 1.0174132621176488
Energy: 1.2621722986539115
Energy: 1.0174132621176488
Energy: 0.8409739742057549
Energy: 1.0174132621176488
Energy: 0.8403333574188863
Energy: 1.0925447815563765
Energy: 1.045600671084544
Energy: 1.0925447815563765
Energy: 0.8403333574194342
Energy: 1.0925447815563765
Energy: 0.8592030774601268
Energy: 1.03274503143598
Energy: 1.2622695246863616
Energy: 1.03274503143598
Energy: 0.8592030774601268
Energy: 1.03274503143598
Energy: 0.8421661628004634
Energy: 1.1268093024085675
Energy: 1.2809831699159602
Energy: 1.126809302409115
Energy: 0.8421661628004634
Energy: 1.126809302409115
Energy: 0.8412270360883616
Energy: 0.8579014673404091
Energy: 1.396890060494053
Energy: 0.8579014673409568
Energy: 0.8412270360883616
Energy: 0.8579014673409568
Energy: 0.8566437423784622
Energy: 1.1473457666976419
Energy: 1.2989471552063099
Energy: 1.1473457666970943
Energy: 0.8566437423784622
Energy: 1.1473457666970943
Energy: 0.859265480686659
Energy: 0.8741901770830548
Energy: 1.4043025977785637
Energy: 0.874190177082507
Energy: 0.859265480686659
Energy: 0.874190177082507
Energy: 0.8732503344894342
Energy: 1.126608187442133
Energy: 1.2808016747007482
Energy: 1.126608187442133
Energy: 0.8732503344894342
Energy: 1.126608187442133
Energy: 0.8411760395149709
Energy: 0.8569409849955668
Energy: 1.3972230804934103
Energy: 0.8569409849961147
Energy: 0.8411760395149709
Energy: 0.8569409849961147
Energy: 0.8564372979693917
Energy: 1.0926120173390315
Energy: 1.0455845158774961
Energy: 1.0926120173384835
Energy: 0.8564372979693917
Energy: 1.0926120173390315
Energy: 0.8530223660818254
Energy: 1.0264294690884666
Energy: 1.1506073686226184
Energy: 1.0264294690890143
Energy: 0.8530223660818254
Energy: 1.0264294690884666
Energy: 1.0401094093697119
Energy: 1.0865189991424864
Energy: 1.0283678895965391
Energy: 1.0865189991424864
Energy: 1.040109409369164
Energy: 1.0865189991424864

minimum gb energy = 0.8397343968051336 eV
minimum distance =  2.24192327336829 Angstroms
sigma value = 81


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

Energy: 1.4459719835468166
Energy: 1.2994971547683325
Energy: 1.0569109423706498
Energy: 1.2994971547683325
Energy: 1.4459719835468166
Energy: 1.2994971547683325
Energy: 1.5476443423725497
Energy: 0.9537522862562763
Energy: 0.9360689603183641
Energy: 0.9537522862562763
Energy: 1.5476443423725497
Energy: 0.9537522862562763
Energy: 1.3954348608617966
Energy: 1.2903981916293477
Energy: 1.145596583645392
Energy: 1.2903981916308511
Energy: 1.3954348608617966
Energy: 1.2903981916308511
Energy: 1.2844000597043406
Energy: 0.9942998985658745
Energy: 0.9457907100525133
Energy: 0.9942998985651228
Energy: 1.2844000597050924
Energy: 0.9942998985651228
Energy: 1.070555861731471
Energy: 1.2057795195353802
Energy: 1.003304704744396
Energy: 1.2057795195346284
Energy: 1.070555861731471
Energy: 1.2057795195346284
Energy: 1.2832875212038035
Energy: 1.1954735897809945
Energy: 1.010690322139223
Energy: 1.1954735897809945
Energy: 1.2832875212045551
Energy: 1.1954735897802424
Energy: 1.039478881000478
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Energy: 1.1543109218309802
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Energy: 1.039478881000478
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Energy: 1.011841032335457
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Energy: 1.0464197249169311
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Energy: 1.0118410323362088
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Energy: 0.9324447899260928
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Energy: 0.9406623550732499
Energy: 1.2691196220837369
Energy: 1.302502667419333
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Energy: 0.9406623550724981
Energy: 1.269119622084489
Energy: 0.929018249018661
Energy: 1.1669953417257568
Energy: 1.2960832289429212
Energy: 1.1669953417257568
Energy: 0.929018249018661
Energy: 1.1669953417257568
Energy: 1.0068654183565804
Energy: 1.2586639908613766
Energy: 1.3018240773695018
Energy: 1.2586639908636321
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Energy: 1.2586639908636321
Energy: 1.0062500410948718
Energy: 1.1647269147746155
Energy: 1.2794699144150636
Energy: 1.1647269147753672
Energy: 1.0062500410948718
Energy: 1.1647269147753672
Energy: 1.0113735472715317
Energy: 1.2691452796453468
Energy: 1.0464383196487397
Energy: 1.269145279644595
Energy: 1.0113735472715317
Energy: 1.269145279644595
Energy: 1.0107201517808135
Energy: 1.2021203012281663
Energy: 1.129246631023076
Energy: 1.2021203012281663
Energy: 1.0107201517800617
Energy: 1.2021203012281663
Energy: 1.2792894786513505
Energy: 1.2447284996722787
Energy: 1.02033307602411
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Energy: 1.2792894786513505
Energy: 1.2447284996722787
Energy: 1.280530426900984
Energy: 1.2587630369852654
Energy: 1.0016168256152553
Energy: 1.2587630369860172
Energy: 1.280530426901736
Energy: 1.2587630369860172
Energy: 1.3518043850920027
Energy: 1.269343307009756
Energy: 0.9441934475972041
Energy: 1.2693433070105078
Energy: 1.3518043850920027
Energy: 1.2693433070105078
Energy: 1.351140319044739
Energy: 1.260621774122731
Energy: 1.0631131740183564
Energy: 1.260621774122731
Energy: 1.351140319044739
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Energy: 1.4690546247282985
Energy: 1.1958778822461449
Energy: 0.9385774642647579
Energy: 1.1958778822453928
Energy: 1.4690546247275467
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Energy: 1.4648569408383967
Energy: 1.236029771412057
Energy: 0.9387727646355157
Energy: 1.236029771412057
Energy: 1.4648569408383967
Energy: 1.236029771412057
Energy: 1.3513281614046917
Energy: 1.260621855253469
Energy: 1.1618627026564292
Energy: 1.260621855253469
Energy: 1.3513281614046917
Energy: 1.260621855253469
Energy: 1.3403144510647356
Energy: 1.2693616144540383
Energy: 0.9437484263994306
Energy: 1.269361614455542
Energy: 1.3403144510647356
Energy: 1.269361614455542
Energy: 1.2794146228778187
Energy: 1.2661425053811888
Energy: 1.001518322354943
Energy: 1.2661425053826925
Energy: 1.2794146228778187
Energy: 1.2661425053826925
Energy: 1.2818963129333403
Energy: 1.2449367712772303
Energy: 1.0208435884882743
Energy: 1.2449367712787338
Energy: 1.2818963129340921
Energy: 1.2449367712787338
Energy: 1.0109140009608848
Energy: 1.2026119261022272
Energy: 1.286260409774528
Energy: 1.2026119261037307
Energy: 1.0109140009608848
Energy: 1.2026119261037307
Energy: 1.0113053119888202
Energy: 1.2691929909743673
Energy: 1.0548932464051641
Energy: 1.2691929909743673
Energy: 1.0113053119888202
Energy: 1.2691929909743673
Energy: 1.006531295432553
Energy: 1.1647269147746155
Energy: 1.2308059811701013
Energy: 1.1647269147753672
Energy: 1.006531295432553
Energy: 1.1647269147753672
Energy: 0.9987369015308242
Energy: 1.2584611381491169
Energy: 1.3016300531135443
Energy: 1.2584611381498687
Energy: 0.9987369015308242
Energy: 1.2584611381498687
Energy: 0.9288486431414077
Energy: 1.1699257800459817
Energy: 1.4566432344354938
Energy: 1.16992578004523
Energy: 0.9288486431414077
Energy: 1.16992578004523
Energy: 0.9406089218864888
Energy: 1.2691389659328622
Energy: 1.3022893428615026
Energy: 1.2691389659336139
Energy: 0.9406089218864888
Energy: 1.2691389659336139
Energy: 0.9324729246743476
Energy: 0.9303759231515208
Energy: 1.38207823406116
Energy: 0.9303759231515208
Energy: 0.9324729246750993
Energy: 0.9303759231515208
Energy: 1.0292837393022716
Energy: 1.2584697482843423
Energy: 1.3017991046909365
Energy: 1.2584697482835905
Energy: 1.0292837393022716
Energy: 1.2584697482835905
Energy: 0.9387775922296759
Energy: 0.930214305039149
Energy: 1.3942627632219027
Energy: 0.9302143050383972
Energy: 0.9387775922296759
Energy: 0.930214305039149
Energy: 1.0114838017047199
Energy: 1.1949460894332413
Energy: 1.0547255982928485
Energy: 1.1949460894332413
Energy: 1.0114838017054717
Energy: 1.1949460894332413
Energy: 1.039465887553782
Energy: 1.2202704357097245
Energy: 1.142377909954299
Energy: 1.2202704357089726
Energy: 1.039465887553782
Energy: 1.2202704357089726

minimum gb energy = 0.9288486431414077 eV
minimum distance =  2.18643185001805 Angstroms
sigma value = 43


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

Energy: 1.4668240664218744
Energy: 1.359342586681227
Energy: 1.1680285981513574
Energy: 1.359342586681227
Energy: 1.4668240664218744
Energy: 1.359342586681227
Energy: 1.3331863492938352
Energy: 1.0460626964186877
Energy: 0.994701828926422
Energy: 1.0460626964186877
Energy: 1.3331863492929115
Energy: 1.0460626964186877
Energy: 1.0459767135955722
Energy: 1.2888668682253988
Energy: 1.1278736549361847
Energy: 1.2888668682253988
Energy: 1.0459767135955722
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Energy: 1.3362558965285711
Energy: 0.9874908962623179
Energy: 0.9906714834045771
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Energy: 1.3362558965285711
Energy: 0.9874908962623179
Energy: 0.9952644287823731
Energy: 1.2971339535006918
Energy: 1.1683841681554499
Energy: 1.2971339535006918
Energy: 0.9952644287823731
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Energy: 1.0024344137562935
Energy: 1.284640670450699
Energy: 0.9930956929547938
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Energy: 1.002434413757217
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Energy: 0.9893222607453555
Energy: 1.1476032950374453
Energy: 1.1614598461568735
Energy: 1.1476032950374453
Energy: 0.9893222607453555
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Energy: 1.0680631146367825
Energy: 1.274504909632694
Energy: 1.045273264614368
Energy: 1.274504909632694
Energy: 1.0680631146367825
Energy: 1.274504909632694
Energy: 0.98687275250318
Energy: 1.151739926309245
Energy: 1.4562233863703713
Energy: 1.151739926309245
Energy: 0.98687275250318
Energy: 1.151739926309245
Energy: 1.0030199634815542
Energy: 1.348083872045032
Energy: 1.418316271416239
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Energy: 1.0030199634815542
Energy: 1.348083872045032
Energy: 0.9894541491864232
Energy: 1.3316157877104506
Energy: 1.1613673430495577
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Energy: 0.9894541491864232
Energy: 1.3316157877104506
Energy: 0.9874763966464761
Energy: 1.273779068602365
Energy: 1.0457255521642204
Energy: 1.273779068602365
Energy: 0.9874763966464761
Energy: 1.273779068602365
Energy: 0.9869035202226645
Energy: 0.9870436354955856
Energy: 1.2614850141356149
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Energy: 0.9869035202226645
Energy: 0.9870436354955856
Energy: 0.9897835001336132
Energy: 1.348157023203382
Energy: 0.9934598025645035
Energy: 1.348157023203382
Energy: 0.9897835001336132
Energy: 1.348157023203382
Energy: 0.9893597083077385
Energy: 1.2812573041394795
Energy: 0.9869408920841095
Energy: 1.2812573041394795
Energy: 0.9893597083077385
Energy: 1.2812573041394795
Energy: 1.3614558683039892
Energy: 1.146646322150127
Energy: 0.9951932686961997
Energy: 1.146646322150127
Energy: 1.3614558683039892
Energy: 1.146646322150127
Energy: 1.3858150447644226
Energy: 1.2725212377734463
Energy: 1.2747514813621357
Energy: 1.2725212377734463
Energy: 1.3858150447644226
Energy: 1.2725212377734463
Energy: 1.4200689492484972
Energy: 1.3480603393459054
Energy: 0.9869318620912699
Energy: 1.348060339346829
Energy: 1.4200689492484972
Energy: 1.348060339346829
Energy: 1.422055266845809
Energy: 1.346540745703432
Energy: 0.9872812836330926
Energy: 1.346540745703432
Energy: 1.422055266845809
Energy: 1.346540745703432
Energy: 1.3593025553501217
Energy: 1.3327038444895458
Energy: 0.9910877315180893
Energy: 1.3327038444895458
Energy: 1.3593025553501217
Energy: 1.3327038444895458
Energy: 1.3856660643367253
Energy: 1.3954773784718681
Energy: 0.9981288542396148
Energy: 1.3954773784718681
Energy: 1.3856660643367253
Energy: 1.3954773784718681
Energy: 0.989879774487876
Energy: 1.280603509680887
Energy: 0.986831745564141
Energy: 1.280603509680887
Energy: 0.989879774487876
Energy: 1.280603509680887
Energy: 0.9895217526116212
Energy: 1.346304360518038
Energy: 0.9920909502914197
Energy: 1.346304360518038
Energy: 0.9895217526116212
Energy: 1.346304360518038
Energy: 0.987657487238684
Energy: 1.2820773335640316
Energy: 0.989649132789149
Energy: 1.2820773335631084
Energy: 0.987657487238684
Energy: 1.2820773335631084
Energy: 0.986803026726844
Energy: 1.3956873944252843
Energy: 1.0450370960411017
Energy: 1.3956873944252843
Energy: 0.986803026726844
Energy: 1.3956873944252843
Energy: 0.9900412143325594
Energy: 1.3311792419170376
Energy: 1.3316966184949637
Energy: 1.3311792419170376
Energy: 0.9900412143325594
Energy: 1.3311792419170376
Energy: 1.0028478299412344
Energy: 1.3461486586465126
Energy: 1.4184295370243976
Energy: 1.3461486586465126
Energy: 1.0028478299412344
Energy: 1.3461486586465126
Energy: 0.9877545908832845
Energy: 1.3224831622765971
Energy: 1.2323381836749372
Energy: 1.3224831622765971
Energy: 0.9877545908832845
Energy: 1.3224831622765971
Energy: 1.0674545034329457
Energy: 1.2731725836921055
Energy: 1.045049768836694
Energy: 1.273172583693029
Energy: 1.0674545034329457
Energy: 1.2731725836921055
Energy: 0.9899128963385062
Energy: 1.146705567559586
Energy: 1.1605850164927447
Energy: 1.146705567559586
Energy: 0.9899128963385062
Energy: 1.146705567559586
Energy: 0.98727193745291
Energy: 1.2836590202339704
Energy: 0.9916751034353298
Energy: 1.2836590202339704
Energy: 0.98727193745291
Energy: 1.2836590202339704

minimum gb energy = 0.986803026726844 eV
minimum distance =  2.23650782226743 Angstroms
sigma value = 57


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

Energy: 1.1364455968369025
Energy: 1.4459896793606348
Energy: 1.2910998765158115
Energy: 1.4459896793618303
Energy: 1.1364455968369025
Energy: 1.4459896793618303
Energy: 1.317117506114931
Energy: 1.144024390320629
Energy: 1.0591354331902778
Energy: 1.144024390320629
Energy: 1.317117506114931
Energy: 1.144024390320629
Energy: 1.0564570658578252
Energy: 1.4480170495638887
Energy: 1.2220149393005302
Energy: 1.4480170495638887
Energy: 1.0564570658578252
Energy: 1.4480170495650841
Energy: 1.0547745753375197
Energy: 1.0605715569684158
Energy: 1.0590297759775738
Energy: 1.0605715569684158
Energy: 1.0547745753375197
Energy: 1.0605715569684158
Energy: 1.0571017985452573
Energy: 1.062785620225846
Energy: 1.2092881698015863
Energy: 1.062785620225846
Energy: 1.0571017985452573
Energy: 1.062785620225846
Energy: 1.0766537052181553
Energy: 1.4359828685017426
Energy: 1.0562672531741717
Energy: 1.4359828685029383
Energy: 1.0766537052181553
Energy: 1.4359828685029383
Energy: 1.059005049217694
Energy: 1.2683749526262444
Energy: 1.3012947523658889
Energy: 1.2683749526262444
Energy: 1.059005049217694
Energy: 1.2683749526262444
Energy: 1.0732883862400309
Energy: 1.4301690984634456
Energy: 1.1370448353637896
Energy: 1.4301690984634456
Energy: 1.0732883862400309
Energy: 1.4301690984634456
Energy: 1.0573954562130972
Energy: 1.1422176469953076
Energy: 1.2089427016632637
Energy: 1.1422176469953076
Energy: 1.0573954562130972
Energy: 1.1422176469953076
Energy: 1.0632288136785564
Energy: 1.4364999834324457
Energy: 1.0564620831221705
Energy: 1.4364999834324457
Energy: 1.0632288136785564
Energy: 1.4364999834324457
Energy: 1.0589528089147529
Energy: 1.0589816593440715
Energy: 1.0597989361295894
Energy: 1.0589816593440715
Energy: 1.0589528089147529
Energy: 1.0589816593428756
Energy: 1.0613461835770026
Energy: 1.2652376456261154
Energy: 1.059518523081994
Energy: 1.2652376456249197
Energy: 1.0613461835770026
Energy: 1.2652376456249197
Energy: 1.057670100091198
Energy: 1.4341323170731108
Energy: 1.1282259085932465
Energy: 1.4341323170743066
Energy: 1.057670100091198
Energy: 1.4341323170743066
Energy: 1.341509627931021
Energy: 1.4226961703523968
Energy: 1.0630425878791667
Energy: 1.4226961703523968
Energy: 1.3415096279298255
Energy: 1.4226961703523968
Energy: 1.6211487305606542
Energy: 1.4274354921718975
Energy: 1.069441039200402
Energy: 1.4274354921718975
Energy: 1.6211487305606542
Energy: 1.4274354921718975
Energy: 1.0613926122444313
Energy: 1.4774602934239631
Energy: 1.0598246917233687
Energy: 1.4774602934239631
Energy: 1.0613926122444313
Energy: 1.4774602934239631
Energy: 1.0582088494414406
Energy: 1.2666906432228424
Energy: 1.0589143196967572
Energy: 1.266690643221647
Energy: 1.0582088494414406
Energy: 1.266690643221647
Energy: 1.0650267808250093
Energy: 1.2947894147303227
Energy: 1.0650470261710556
Energy: 1.2947894147303227
Energy: 1.0650267808250093
Energy: 1.2947894147303227
Energy: 1.0589132117624285
Energy: 1.2666905137373001
Energy: 1.058208383034166
Energy: 1.2666905137373001
Energy: 1.0589132117624285
Energy: 1.2666905137373001
Energy: 1.0599584014935701
Energy: 1.477683272877494
Energy: 1.0628880787229655
Energy: 1.477683272877494
Energy: 1.0599584014935701
Energy: 1.477683272877494
Energy: 1.0694243387747178
Energy: 1.4273091149914106
Energy: 1.6210801079428772
Energy: 1.4273091149914106
Energy: 1.0694243387747178
Energy: 1.4273091149914106
Energy: 1.0630720962919376
Energy: 1.2665668519904172
Energy: 1.3409119027307224
Energy: 1.2665668519904172
Energy: 1.0630720962919376
Energy: 1.2665668519904172
Energy: 1.1516379583226508
Energy: 1.4341041895230122
Energy: 1.0576816958253032
Energy: 1.4341041895230122
Energy: 1.1516379583226508
Energy: 1.4341041895230122
Energy: 1.0595140585824605
Energy: 1.2652627064929487
Energy: 1.0612992647577055
Energy: 1.2652627064929487
Energy: 1.0595140585824605
Energy: 1.2652627064929487

minimum gb energy = 1.0547745753375197 eV
minimum distance =  2.24258238517711 Angstroms
sigma value = 17


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

Energy: 1.1103335886320227
Energy: 1.10886103720623
Energy: 1.6652798470353505
Energy: 1.10886103720623
Energy: 1.1103335886337136
Energy: 1.10886103720623
Energy: 1.1216762465113774
Energy: 1.1081282924760834
Energy: 1.1080838014557086
Energy: 1.1081282924760834
Energy: 1.1216762465130687
Energy: 1.1081282924760834
Energy: 1.1007589275949856
Energy: 1.1005972766140077
Energy: 1.1043830379470136
Energy: 1.1005972766140077
Energy: 1.1007589275949856
Energy: 1.1005972766140077
Energy: 1.12864926297752
Energy: 1.1016390995318606
Energy: 1.1026302421933356
Energy: 1.1016390995318606
Energy: 1.12864926297752
Energy: 1.1016390995318606
Energy: 1.1069972549257552
Energy: 1.1071033696844252
Energy: 1.4052922358457367
Energy: 1.1071033696844252
Energy: 1.1069972549257552
Energy: 1.1071033696844252
Energy: 1.1032849234317774
Energy: 1.109593135146994
Energy: 1.112463661412069
Energy: 1.109593135146994
Energy: 1.1032849234317774
Energy: 1.109593135146994
Energy: 1.1102245999932194
Energy: 1.294926505552062
Energy: 1.1239957043869924
Energy: 1.294926505552062
Energy: 1.1102245999932194
Energy: 1.294926505552062
Energy: 1.1077008977056189
Energy: 1.2833566853545737
Energy: 1.1027128356244502
Energy: 1.2833566853545737
Energy: 1.1077008977056189
Energy: 1.2833566853545737
Energy: 1.106973868940533
Energy: 1.104034941250405
Energy: 1.292563884098313
Energy: 1.104034941250405
Energy: 1.106973868940533
Energy: 1.104034941250405
Energy: 1.1081380886984569
Energy: 1.0855550417751236
Energy: 1.108592481492222
Energy: 1.0855550417751236
Energy: 1.1081380886984569
Energy: 1.0855550417751236
Energy: 1.1092439700977137
Energy: 1.3902368433482908
Energy: 1.106604137372162
Energy: 1.3902368433499817
Energy: 1.1092439700977137
Energy: 1.3902368433499817
Energy: 1.101319627920707
Energy: 1.1018693607412737
Energy: 1.1063246450388384
Energy: 1.1018693607412737
Energy: 1.101319627920707
Energy: 1.1018693607412737
Energy: 1.1069706900371676
Energy: 1.2830231796949905
Energy: 1.1012771646260604
Energy: 1.2830231796949905
Energy: 1.1069706900371676
Energy: 1.2830231796949905
Energy: 1.1016261132338474
Energy: 1.1021983296715194
Energy: 1.100825133513044
Energy: 1.1021983296715194
Energy: 1.1016261132338474
Energy: 1.1021983296715194
Energy: 1.110266156149898
Energy: 1.394914688471925
Energy: 1.1084430137038064
Energy: 1.394914688471925
Energy: 1.110266156149898
Energy: 1.394914688470234
Energy: 1.106566357350284
Energy: 1.3894962668749338
Energy: 1.108174549768156
Energy: 1.3894962668749338
Energy: 1.106566357350284
Energy: 1.3894962668749338
Energy: 1.1072765189250664
Energy: 1.1015912946292725
Energy: 1.1007676010202867
Energy: 1.1015912946309636
Energy: 1.1072765189250664
Energy: 1.1015912946309636

minimum gb energy = 1.0855550417751236 eV
minimum distance =  2.25295289627243 Angstroms
sigma value = 17


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

Energy: 1.667386554256094
Energy: 1.6611247932402105
Energy: 1.4145751761108785
Energy: 1.6611247932402105
Energy: 1.667386554256094
Energy: 1.6611247932402105
Energy: 1.3776414473016345
Energy: 1.0890342902325933
Energy: 1.07762242022141
Energy: 1.0890342902325933
Energy: 1.3776414473016345
Energy: 1.0890342902319405
Energy: 1.0818598464168958
Energy: 1.1873885137409987
Energy: 1.3401171098791735
Energy: 1.1873885137409987
Energy: 1.0818598464168958
Energy: 1.1873885137416518
Energy: 1.0873858933321021
Energy: 1.0761399195362185
Energy: 1.203794118856932
Energy: 1.0761399195355652
Energy: 1.0873858933321021
Energy: 1.0761399195362185
Energy: 1.0752627171171711
Energy: 1.1270450104972765
Energy: 1.3977255306822807
Energy: 1.1270450104966236
Energy: 1.0752627171171711
Energy: 1.1270450104972765
Energy: 1.2027782009428516
Energy: 1.088303172814817
Energy: 1.2340117750658672
Energy: 1.088303172814817
Energy: 1.2027782009421983
Energy: 1.0883031728154697
Energy: 1.0784876133526644
Energy: 1.2070582624207087
Energy: 1.4260339079164814
Energy: 1.2070582624213617
Energy: 1.0784876133526644
Energy: 1.2070582624213617
Energy: 1.3607407789609731
Energy: 1.0745896904307317
Energy: 1.0751585604502958
Energy: 1.0745896904313847
Energy: 1.3607407789609731
Energy: 1.0745896904313847
Energy: 1.2380135502606766
Energy: 1.0817582236111318
Energy: 1.0899053416580662
Energy: 1.0817582236111318
Energy: 1.2380135502606766
Energy: 1.0817582236104786
Energy: 1.3428303087265026
Energy: 1.1295197307783187
Energy: 1.0791240069979204
Energy: 1.170109815393437
Energy: 1.3428303087265026
Energy: 1.1295197307783187
Energy: 1.2079728901415605
Energy: 1.0818831450572817
Energy: 1.1777773521949078
Energy: 1.0818831450585877
Energy: 1.2079728901422133
Energy: 1.0818831450566289
Energy: 1.086741028498315
Energy: 1.1052683333613036
Energy: 1.0814840347406602
Energy: 1.1052683333619568
Energy: 1.086741028498315
Energy: 1.1052683333606508
Energy: 1.079638333083856
Energy: 1.0764009190639388
Energy: 1.4001019509641346
Energy: 1.0764009190626327
Energy: 1.079638333084509
Energy: 1.0764009190639388
Energy: 1.0869392274557632
Energy: 1.5393597154054506
Energy: 1.6278950538392805
Energy: 1.5393597154047973
Energy: 1.0869392274557632
Energy: 1.5393597154047973
Energy: 1.093272117138968
Energy: 1.656253326251957
Energy: 1.1951303837298117
Energy: 1.656253326251957
Energy: 1.093272117138968
Energy: 1.656253326251957
Energy: 1.2021607663973821
Energy: 1.5845177712492193
Energy: 1.081558855751527
Energy: 1.614263446417573
Energy: 1.2021607663973821
Energy: 1.383231251447987
Energy: 1.2020486323279123
Energy: 1.3641550938098077
Energy: 1.0799316396687102
Energy: 1.3641550938091547
Energy: 1.2020486323279123
Energy: 1.3641550938091547
Energy: 1.5810202647001852
Energy: 1.4053055880934817
Energy: 1.0906862784326832
Energy: 1.4053055880941347
Energy: 1.5810202647001852
Energy: 1.4053055880934817
Energy: 1.505108208728323
Energy: 1.3933070061302737
Energy: 1.073395874649131
Energy: 1.393307006130927
Energy: 1.505108208728323
Energy: 1.393307006130927
Energy: 1.0722491366985785
Energy: 1.1275474007973663
Energy: 1.072219457197537
Energy: 1.1700334438755253
Energy: 1.0722491366979257
Energy: 1.5767066799185556
Energy: 1.0733712406586502
Energy: 1.3932706570409061
Energy: 1.3932112811794355
Energy: 1.393270657041559
Energy: 1.0733712406586502
Energy: 1.393270657042212
Energy: 1.0913522972298713
Energy: 1.4052889723945325
Energy: 1.5810192616839436
Energy: 1.4052889723951856
Energy: 1.0913522972298713
Energy: 1.4052889723951856
Energy: 1.089875253016309
Energy: 1.3642923244412006
Energy: 1.202067834672527
Energy: 1.3642923244418537
Energy: 1.089875253016309
Energy: 1.3642923244412006
Energy: 1.081569701561119
Energy: 1.3315556190779534
Energy: 1.202266596648049
Energy: 1.383047676221557
Energy: 1.0815697015604657
Energy: 1.3315556190779534
Energy: 1.1950805581155817
Energy: 1.6562142896936605
Energy: 1.0778224815037851
Energy: 1.6562142896936605
Energy: 1.1950805581155817
Energy: 1.6562142896936605
Energy: 1.6279985371424064
Energy: 1.5390691067178546
Energy: 1.087149455423197
Energy: 1.5390691067185076
Energy: 1.6279985371424064
Energy: 1.5390691067185076
Energy: 1.4003277755028098
Energy: 1.076432904511298
Energy: 1.079637632900323
Energy: 1.0764329045106449
Energy: 1.4003277755028098
Energy: 1.0764329045106449
Energy: 1.081485285593023
Energy: 1.1053743533778984
Energy: 1.0867630263299504
Energy: 1.1053743533785514
Energy: 1.0814852855923702
Energy: 1.1053743533778984
Energy: 1.178193929951057
Energy: 1.0819339799348433
Energy: 1.2079814874171317
Energy: 1.0819339799361491
Energy: 1.17819392995171
Energy: 1.0819339799354961
Energy: 1.079132674064358
Energy: 1.1295197307802776
Energy: 1.3427520068087
Energy: 1.1295197307796245
Energy: 1.0791326740650111
Energy: 1.1295197307796245
Energy: 1.0898710392316502
Energy: 1.0821493924117396
Energy: 1.2374990087841358
Energy: 1.0821493924104337
Energy: 1.0898710392316502
Energy: 1.0821493924110865
Energy: 1.0751587048327265
Energy: 1.074576485690539
Energy: 1.3607313326647115
Energy: 1.074576485690539
Energy: 1.0751587048327265
Energy: 1.074576485690539
Energy: 1.4261322398840803
Energy: 1.2070816560759048
Energy: 1.0784849877024378
Energy: 1.2070816560765578
Energy: 1.4261322398840803
Energy: 1.2070816560765578
Energy: 1.2338339147433082
Energy: 1.088250918653411
Energy: 1.2027544336967222
Energy: 1.0882509186547171
Energy: 1.2338339147433082
Energy: 1.088250918654064
Energy: 1.3975528581555186
Energy: 1.1270450104966236
Energy: 1.0752543397790055
Energy: 1.1270450104959704
Energy: 1.3975528581555186
Energy: 1.1270450104966236
Energy: 1.2038224726731794
Energy: 1.07613056549184
Energy: 1.087408533432432
Energy: 1.076130565492493
Energy: 1.2038224726731794
Energy: 1.0761305654931461
Energy: 1.3398813767639128
Energy: 1.1874592577090477
Energy: 1.0818748719377942
Energy: 1.1874592577090477
Energy: 1.3398813767639128
Energy: 1.1874592577090477
Energy: 1.0776202042993006
Energy: 1.0890641432471384
Energy: 1.3772702343985783
Energy: 1.0890641432471384
Energy: 1.0776202042999539
Energy: 1.0890641432477914
Energy: 1.1631647775318688
Energy: 1.6611247932402105
Energy: 1.667386554256094
Energy: 1.6611247932408633
Energy: 1.1631647775338279
Energy: 1.6611247932402105
Energy: 1.07762242022141
Energy: 1.0890342902332466
Energy: 1.3776414473022875
Energy: 1.0890342902325933
Energy: 1.07762242022141
Energy: 1.0890342902325933
Energy: 1.3401171098798266
Energy: 1.1873885137409987
Energy: 1.0818598464168958
Energy: 1.1873885137409987
Energy: 1.3401171098798266
Energy: 1.1873885137403455
Energy: 1.2037941188575854
Energy: 1.0761399195355652
Energy: 1.087385893332755
Energy: 1.0761399195355652
Energy: 1.2037941188575854
Energy: 1.0761399195362185
Energy: 1.3977255306822807
Energy: 1.1270450104972765
Energy: 1.0752627171178242
Energy: 1.1270450104966236
Energy: 1.3977255306822807
Energy: 1.1270450104966236

minimum gb energy = 1.072219457197537 eV
minimum distance =  2.24775752489493 Angstroms
sigma value = 57


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

Energy: 1.259995104674495
Energy: 1.6475315543997429
Energy: 1.4396981214530309
Energy: 1.6475315543997429
Energy: 1.259995104674495
Energy: 1.6475315543997429
Energy: 1.1666130050661763
Energy: 1.051525388864869
Energy: 1.0526118263326516
Energy: 1.051525388864869
Energy: 1.1666130050661763
Energy: 1.051525388864869
Energy: 1.0432091714375789
Energy: 1.2190265622837273
Energy: 1.3413511482152665
Energy: 1.219026562285854
Energy: 1.0432091714375789
Energy: 1.219026562285854
Energy: 1.298879950697082
Energy: 1.220917725240269
Energy: 1.22153142768016
Energy: 1.2209177252392056
Energy: 1.298879950697082
Energy: 1.2209177252392056
Energy: 1.047732136111077
Energy: 1.1106566549263335
Energy: 1.2374131518465838
Energy: 1.1106566549252703
Energy: 1.047732136111077
Energy: 1.1106566549242072
Energy: 1.2331973746239102
Energy: 1.22084538682212
Energy: 1.2216067006268065
Energy: 1.2208453868242468
Energy: 1.2331973746239102
Energy: 1.2208453868231834
Energy: 1.0477850974572305
Energy: 1.2204762397458335
Energy: 1.0545192600607878
Energy: 1.220476239749023
Energy: 1.0477850974572305
Energy: 1.220476239749023
Energy: 1.042982009372987
Energy: 1.1163729756366965
Energy: 1.0527719329823821
Energy: 1.116372975638823
Energy: 1.0429820093740503
Energy: 1.1163729756377598
Energy: 1.263715635121186
Energy: 1.4815545094294604
Energy: 1.0521053705491155
Energy: 1.4815545094315867
Energy: 1.263715635121186
Energy: 1.4815545094315867
Energy: 1.1529862445476446
Energy: 1.0528091930814052
Energy: 1.0576969191168497
Energy: 1.0528091930814052
Energy: 1.1529862445465815
Energy: 1.0528091930814052
Energy: 1.0478000663300113
Energy: 1.3568338333636045
Energy: 1.2053634867598002
Energy: 1.3568338333636045
Energy: 1.0478000663310745
Energy: 1.3568338333636045
Energy: 1.111796386959889
Energy: 1.207389622315129
Energy: 1.228933929551321
Energy: 1.2073896223140659
Energy: 1.111796386959889
Energy: 1.2073896223140659
Energy: 1.0509590281091814
Energy: 1.2199459813245446
Energy: 1.2057719700791192
Energy: 1.2199459813234814
Energy: 1.0509590281102446
Energy: 1.2199459813234814
Energy: 1.2329723370784345
Energy: 1.3817404150909447
Energy: 1.2290253163129632
Energy: 1.381740415092008
Energy: 1.2329723370784345
Energy: 1.3817404150909447
Energy: 1.0434395940734795
Energy: 1.2225424186025573
Energy: 1.0505782348543422
Energy: 1.2225424186025573
Energy: 1.0434395940734795
Energy: 1.2225424186036207
Energy: 1.4393093806846442
Energy: 1.4629704318352066
Energy: 1.0579092557086853
Energy: 1.4629704318362697
Energy: 1.439309380682518
Energy: 1.4629704318362697
Energy: 1.2592476530057546
Energy: 1.481791794580168
Energy: 1.051027195665993
Energy: 1.481791794581231
Energy: 1.2592476530057546
Energy: 1.481791794580168
Energy: 1.2331692793670057
Energy: 1.2219933681481687
Energy: 1.0508498345100221
Energy: 1.2219933681492317
Energy: 1.2331692793659428
Energy: 1.221993368150295
Energy: 1.0435357957718867
Energy: 1.3576190718998415
Energy: 1.2207315420533174
Energy: 1.3576190718998415
Energy: 1.0435357957718867
Energy: 1.3576190718998415
Energy: 1.2186245066803967
Energy: 1.2235345244946774
Energy: 1.2206386776079599
Energy: 1.2235345244936142
Energy: 1.2186245066803967
Energy: 1.2235345244946774
Energy: 1.0435984276167367
Energy: 1.2200226709743875
Energy: 1.2207016075735881
Energy: 1.220022670975451
Energy: 1.0435984276167367
Energy: 1.220022670975451
Energy: 1.0433338161086492
Energy: 1.3562523298686062
Energy: 1.2206703265534498
Energy: 1.3562523298707327
Energy: 1.0433338161086492
Energy: 1.3562523298696696
Energy: 1.0424127961139427
Energy: 1.237988235155156
Energy: 1.054518622281082
Energy: 1.2379882351562195
Energy: 1.0424127961139427
Energy: 1.237988235155156
Energy: 1.2594608563534346
Energy: 1.4824788513011034
Energy: 1.0507858902554288
Energy: 1.4824788512989768
Energy: 1.2594608563534346
Energy: 1.4824788512989768
Energy: 1.25974029096002
Energy: 1.4832804810640408
Energy: 1.0521092882594714
Energy: 1.4832804810629776
Energy: 1.2597402909589566
Energy: 1.4832804810629776
Energy: 1.04314797469555
Energy: 1.2367380670609527
Energy: 1.0518268839010525
Energy: 1.2367380670609527
Energy: 1.04314797469555
Energy: 1.2367380670598893
Energy: 1.0428134029079612
Energy: 1.3571529788979164
Energy: 1.2205246095158684
Energy: 1.3571529788979164
Energy: 1.0428134029079612
Energy: 1.3571529789000427

minimum gb energy = 1.0424127961139427 eV
minimum distance =  2.21397241191901 Angstroms
sigma value = 43


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

Energy: 1.3247569231206446
Energy: 1.131429191316664
Energy: 1.2626977846135758
Energy: 1.1314291913182135
Energy: 1.3247569231206446
Energy: 1.131429191316664
Energy: 1.1780635045197194
Energy: 1.1186382330041904
Energy: 1.1034196597219417
Energy: 1.1186382330041904
Energy: 1.1780635045197194
Energy: 1.1186382330041904
Energy: 1.1024727840105106
Energy: 1.2526716632052743
Energy: 1.107623286432462
Energy: 1.252671663206049
Energy: 1.1024727840105106
Energy: 1.252671663206049
Energy: 1.3333925244226257
Energy: 1.110855104479528
Energy: 1.2671883007162932
Energy: 1.110855104479528
Energy: 1.3333925244226257
Energy: 1.110855104479528
Energy: 1.0995907540277094
Energy: 1.174899043134682
Energy: 1.2311545473273484
Energy: 1.1748990431339075
Energy: 1.0995907540277094
Energy: 1.1748990431339075
Energy: 1.2318314104574593
Energy: 1.2397278208697073
Energy: 1.1260108709034538
Energy: 1.2397278208697073
Energy: 1.2318314104574593
Energy: 1.2397278208697073
Energy: 1.128337593477077
Energy: 1.2408192076352191
Energy: 1.1187549680067794
Energy: 1.2408192076352191
Energy: 1.128337593477077
Energy: 1.2408192076352191
Energy: 1.2535399200183794
Energy: 1.1746435910769506
Energy: 1.099701111190706
Energy: 1.1746435910769506
Energy: 1.2535399200183794
Energy: 1.1746435910769506
Energy: 1.2690764366340084
Energy: 1.1023412738840908
Energy: 1.2664155861523354
Energy: 1.1023412738848657
Energy: 1.2690764366340084
Energy: 1.1023412738848657
Energy: 1.3400507900879604
Energy: 1.2526345503168166
Energy: 1.1022048818357864
Energy: 1.2526345503168166
Energy: 1.3400507900879604
Energy: 1.2526345503168166
Energy: 1.1049612016015602
Energy: 1.1784017540003604
Energy: 1.5009107905923376
Energy: 1.1784017540003604
Energy: 1.1049612016015602
Energy: 1.1784017540003604
Energy: 1.1184495614308603
Energy: 1.1247382141242341
Energy: 1.324049052837756
Energy: 1.1247382141250089
Energy: 1.1184495614308603
Energy: 1.1247382141250089
Energy: 1.102359807455987
Energy: 1.1206569053744404
Energy: 1.252781091623665
Energy: 1.1206569053744404
Energy: 1.102359807455987
Energy: 1.1206569053744404
Energy: 1.2582013773153484
Energy: 1.1065437355598555
Energy: 1.1022150877091605
Energy: 1.1065437355606302
Energy: 1.258201377314574
Energy: 1.1065437355606302
Energy: 1.265886798143763
Energy: 1.3063031090958186
Energy: 1.1101542268951694
Energy: 1.306303109097368
Energy: 1.265886798143763
Energy: 1.306303109097368
Energy: 1.2400300723871538
Energy: 1.2595440137295386
Energy: 1.098301231262248
Energy: 1.2595440137295386
Energy: 1.2400300723863789
Energy: 1.2595440137295386
Energy: 1.1249465251170614
Energy: 1.1252150375992689
Energy: 1.2397216610234902
Energy: 1.1252150375984944
Energy: 1.1249465251170614
Energy: 1.1252150375984944
Energy: 1.1243883613338188
Energy: 1.2480455823038348
Energy: 1.1248706868275329
Energy: 1.24804558230306
Energy: 1.1243883613345935
Energy: 1.2480455823038348
Energy: 1.1140751359054004
Energy: 1.118820354200403
Energy: 1.2659214708901498
Energy: 1.118820354200403
Energy: 1.1140751359061751
Energy: 1.118820354200403
Energy: 1.1018987877921302
Energy: 1.2729229401207345
Energy: 1.2660627736175796
Energy: 1.2729229401207345
Energy: 1.1018987877921302
Energy: 1.2729229401207345
Energy: 1.1021340217893258
Energy: 1.268142611175966
Energy: 1.1179468560653716
Energy: 1.268142611175966
Energy: 1.1021340217893258
Energy: 1.268142611175966
Energy: 1.4902013363045632
Energy: 1.1094372766682845
Energy: 1.1025692197347838
Energy: 1.1094372766682845
Energy: 1.490201336305338
Energy: 1.1094372766682845
Energy: 1.7631671019091462
Energy: 1.4121710769965192
Energy: 1.1179573782138785
Energy: 1.4121710769965192
Energy: 1.7631671019091462
Energy: 1.4121710769965192
Energy: 1.1018401693146769
Energy: 1.2658993141480108
Energy: 1.1179318772385425
Energy: 1.2658993141472359
Energy: 1.1018401693146769
Energy: 1.2658993141472359
Energy: 1.1022069441585007
Energy: 1.4323458007446421
Energy: 1.2663510540002072
Energy: 1.4323458007446421
Energy: 1.1022069441592754
Energy: 1.4323458007446421
Energy: 1.1140565176776953
Energy: 1.4729044268968983
Energy: 1.2661037807207478
Energy: 1.4729044268968983
Energy: 1.1140565176776953
Energy: 1.4729044268968983
Energy: 1.123622995091693
Energy: 1.260490098048849
Energy: 1.2465524099807135
Energy: 1.260490098048849
Energy: 1.123622995091693
Energy: 1.2604900980480742
Energy: 1.2467019299577873
Energy: 1.248018930615917
Energy: 1.2466903112583654
Energy: 1.2480189306151424
Energy: 1.2467019299577873
Energy: 1.2480189306151424
Energy: 1.2465646114576825
Energy: 1.2561067833082304
Energy: 1.1061458587418855
Energy: 1.256106783309005
Energy: 1.2465646114576825
Energy: 1.2561067833082304
Energy: 1.2662168260332074
Energy: 1.4727571215652882
Energy: 1.1140153883293538
Energy: 1.4727571215652882
Energy: 1.2662168260332074
Energy: 1.4727571215652882
Energy: 1.2664321679195527
Energy: 1.432457413640318
Energy: 1.102186041969943
Energy: 1.432457413640318
Energy: 1.2664321679195527
Energy: 1.432457413640318
Energy: 1.117954259872058
Energy: 1.2659244200664854
Energy: 1.1018305632550085
Energy: 1.2659244200664854
Energy: 1.117954259872058
Energy: 1.2659244200672601
Energy: 1.1179704065127014
Energy: 1.4121598308424335
Energy: 1.5387849577538348
Energy: 1.4121598308424335
Energy: 1.1179704065127014
Energy: 1.4121598308424335
Energy: 1.1025745542691034
Energy: 1.1093052004280315
Energy: 1.4905073559391704
Energy: 1.1093052004288062
Energy: 1.1025745542691034
Energy: 1.1093052004288062
Energy: 1.1179359802443833
Energy: 1.2682976067573921
Energy: 1.1021278576912086
Energy: 1.2682976067573921
Energy: 1.1179359802443833
Energy: 1.2682976067573921
Energy: 1.2659513999134755
Energy: 1.2729017770452398
Energy: 1.1019021318156705
Energy: 1.2729017770452398
Energy: 1.2659513999134755
Energy: 1.2729017770452398

minimum gb energy = 1.098301231262248 eV
minimum distance =  2.26066093367199 Angstroms
sigma value = 81


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

Energy: 1.1627387592738532
Energy: 1.1632068642449716
Energy: 1.7429004647028878
Energy: 1.1632068642446804
Energy: 1.1627387592738532
Energy: 1.1632068642446804
Energy: 1.1629700536636505
Energy: 1.163310597095227
Energy: 1.1627746078700265
Energy: 1.163310597095227
Energy: 1.1629700536633596
Energy: 1.163310597095227
Energy: 1.162771910279109
Energy: 1.1632452623620744
Energy: 1.1635162129738785
Energy: 1.1632452623620744
Energy: 1.162771910279109
Energy: 1.1632452623620744
Energy: 1.3249896094827847
Energy: 1.1632068642449716
Energy: 1.1627387592741443
Energy: 1.1632068642449716
Energy: 1.3249896094830758
Energy: 1.1632068642446804
Energy: 1.1627746078697354
Energy: 1.1633105970949682
Energy: 1.1629700536636505
Energy: 1.1633105970949682
Energy: 1.1627746078697354
Energy: 1.1633105970949682
Energy: 1.1635162129741694
Energy: 1.1632452623620744
Energy: 1.16277191027885
Energy: 1.1632452623623657
Energy: 1.1635162129741694
Energy: 1.1632452623623657
Energy: 1.1627387592738532
Energy: 1.1632068642449716
Energy: 1.3249896094830758
Energy: 1.1632068642449716
Energy: 1.1627387592738532
Energy: 1.1632068642446804
Energy: 1.1629700536633596
Energy: 1.163310597095227
Energy: 1.1627746078700265
Energy: 1.1633105970949682
Energy: 1.1629700536636505
Energy: 1.163310597095227
Energy: 1.162771910279109
Energy: 1.1632452623623657
Energy: 1.1635162129738785
Energy: 1.1632452623620744
Energy: 1.162771910279109
Energy: 1.1632452623623657
Energy: 1.3249896094824936
Energy: 1.1632068642449716
Energy: 1.1627387592738532
Energy: 1.1632068642449716
Energy: 1.3249896094827847
Energy: 1.1632068642452627

minimum gb energy = 1.1627387592738532 eV
minimum distance =  2.22621497662115 Angstroms
sigma value = 3


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

Energy: 1.5784429769256894
Energy: 1.1491022153297143
Energy: 1.126397262945336
Energy: 1.1491022153297143
Energy: 1.5784429769256894
Energy: 1.1491022153305661
Energy: 1.275498446687323
Energy: 1.1098834588177167
Energy: 1.0604004195852883
Energy: 1.1098834588160131
Energy: 1.2754984466685837
Energy: 1.1098834588160131
Energy: 1.081120380300924
Energy: 1.0808108385543143
Energy: 1.166154037519386
Energy: 1.0808108385543143
Energy: 1.081120380300924
Energy: 1.0808108385543143
Energy: 1.6095250754920922
Energy: 1.369928756411584
Energy: 1.114170218446465
Energy: 1.3699287564132876
Energy: 1.6095250754920922
Energy: 1.369928756411584
Energy: 1.0891556870380255
Energy: 1.0858792285681511
Energy: 1.0565957560362742
Energy: 1.0858792285681511
Energy: 1.0891556870380255
Energy: 1.0858792285681511
Energy: 1.2794034484095071
Energy: 1.1545984966376024
Energy: 1.0622905911583505
Energy: 1.154598496639306
Energy: 1.2794034484095071
Energy: 1.154598496639306
Energy: 1.089201792076888
Energy: 1.0861589778047422
Energy: 1.1025895146527032
Energy: 1.0861589778038907
Energy: 1.089201792076888
Energy: 1.0861589778047422
Energy: 1.0736896163658494
Energy: 1.3714494517099498
Energy: 1.1120485506240438
Energy: 1.3714494517116536
Energy: 1.0736896163658494
Energy: 1.3714494517116536
Energy: 1.0810493865707498
Energy: 1.080094299286857
Energy: 1.4635222306035758
Energy: 1.080094299286857
Energy: 1.081049386569898
Energy: 1.0800942992860052
Energy: 1.0810137938616593
Energy: 1.1101405765572334
Energy: 1.0588146615319318
Energy: 1.1101405765572334
Energy: 1.0810137938616593
Energy: 1.1101405765572334
Energy: 1.458640219410126
Energy: 1.0586792591385663
Energy: 1.101243599175319
Energy: 1.0586792591385663
Energy: 1.458640219410126
Energy: 1.0586792591385663
Energy: 1.4559570578668046
Energy: 1.1989154562824609
Energy: 1.0588530975537165
Energy: 1.198915456281609
Energy: 1.4559570578668046
Energy: 1.198915456281609
Energy: 1.0811685281996322
Energy: 1.1812489479016983
Energy: 1.0587404973013226
Energy: 1.1812489479016983
Energy: 1.0811685281987804
Energy: 1.1812489479016983
Energy: 1.0798247390816007
Energy: 1.216035258800418
Energy: 1.1121778817831718
Energy: 1.2160352588021215
Energy: 1.0798247390816007
Energy: 1.2160352588012697
Energy: 1.085511802402953
Energy: 1.2053021408135343
Energy: 1.1123061548969975
Energy: 1.2053021408126825
Energy: 1.0855118024021013
Energy: 1.2053021408126825
Energy: 1.085836218474611
Energy: 1.1099959309213911
Energy: 1.0604719350390195
Energy: 1.1099959309222431
Energy: 1.085836218474611
Energy: 1.1099959309222431
Energy: 1.085618522165732
Energy: 1.1057118368235648
Energy: 1.0606069195218895
Energy: 1.1057118368227128
Energy: 1.085618522165732
Energy: 1.1057118368235648
Energy: 1.085663412306445
Energy: 1.2349535204964044
Energy: 1.112076610472203
Energy: 1.2349535204964044
Energy: 1.0856634123055935
Energy: 1.2349535204972562
Energy: 1.0807044450843653
Energy: 1.2148887842454612
Energy: 1.1121026780899586
Energy: 1.2148887842454612
Energy: 1.0807044450852168
Energy: 1.2148887842446094
Energy: 1.0809587803965615
Energy: 1.1102385457044885
Energy: 1.0587140428143271
Energy: 1.1102385457044885
Energy: 1.0809587803965615
Energy: 1.1102385457044885
Energy: 1.4585696022310408
Energy: 1.1988062911503712
Energy: 1.0587258234992505
Energy: 1.1988062911503712
Energy: 1.4585696022310408
Energy: 1.1988062911495196
Energy: 1.4580341119850069
Energy: 1.0578530240782795
Energy: 1.101951425247177
Energy: 1.0578530240782795
Energy: 1.4580341119850069
Energy: 1.057853024079983
Energy: 1.0808036721647425
Energy: 1.1101490836489178
Energy: 1.0587828445310083
Energy: 1.1101490836489178
Energy: 1.0808036721647425
Energy: 1.1101490836489178
Energy: 1.0810018094831642
Energy: 1.0799074363844166
Energy: 1.4633149006942654
Energy: 1.0799074363835648
Energy: 1.0810018094831642
Energy: 1.0799074363835648
Energy: 1.0770841941475162
Energy: 1.2354489498155572
Energy: 1.1120277523930033
Energy: 1.235448949816409
Energy: 1.0770841941475162
Energy: 1.235448949816409
Energy: 1.0854280929309577
Energy: 1.1059069117780922
Energy: 1.1561646169356505
Energy: 1.1059069117772404
Energy: 1.0854280929309577
Energy: 1.1059069117772404
Energy: 1.0748788325435414
Energy: 1.1100764035381838
Energy: 1.0605624320541445
Energy: 1.110076403537332
Energy: 1.0748788325435414
Energy: 1.110076403537332
Energy: 1.085356222333725
Energy: 1.2047760959165286
Energy: 1.0565340642680294
Energy: 1.2047760959165286
Energy: 1.085356222333725
Energy: 1.2047760959165286
Energy: 1.1822592723615504
Energy: 1.370311349793355
Energy: 1.1121297493612252
Energy: 1.3703113497958717
Energy: 1.1822592723615504
Energy: 1.3703113497958717
Energy: 1.0818393962377726
Energy: 1.0809133966413338
Energy: 1.2690626330971726
Energy: 1.0809133966396303
Energy: 1.0818393962377726
Energy: 1.0809133966396303
Energy: 1.2802764041340815
Energy: 1.1099974699038988
Energy: 1.0589050796357384
Energy: 1.1099974699056026
Energy: 1.2802764041340815
Energy: 1.1099974699056026
Energy: 1.4558445519692704
Energy: 1.2027757514090789
Energy: 1.1011293021842197
Energy: 1.2027757514090789
Energy: 1.4558445519709742
Energy: 1.2027757514073751
Energy: 1.2606144283911698
Energy: 1.1107728363017866
Energy: 1.0594079492292572
Energy: 1.1107728363017866
Energy: 1.2606144283979839
Energy: 1.1107728363017866

minimum gb energy = 1.0565340642680294 eV
minimum distance =  2.22980223862737 Angstroms
sigma value = 67


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

Energy: 1.060938915730496
Energy: 1.066625465043878
Energy: 1.0561201788034722
Energy: 1.066625465043878
Energy: 1.060938915730496
Energy: 1.0666254650426643
Energy: 1.2611423072182568
Energy: 1.017890232129035
Energy: 1.0085399953255576
Energy: 1.0178902321278214
Energy: 1.2611423072182568
Energy: 1.017890232129035
Energy: 1.0219800697105208
Energy: 1.1104016251936135
Energy: 1.2623061672678535
Energy: 1.1104016251936135
Energy: 1.0219800697093069
Energy: 1.1104016251936135
Energy: 1.586098720005629
Energy: 1.3566354185081342
Energy: 1.0042411254186145
Energy: 1.3566354185069207
Energy: 1.5860987200044152
Energy: 1.3566354185081342
Energy: 1.007845583138632
Energy: 1.3570094987314203
Energy: 1.5778854948672958
Energy: 1.3570094987277792
Energy: 1.007845583138632
Energy: 1.3570094987277792
Energy: 1.0022078418507263
Energy: 1.019040748642282
Energy: 1.008674297332093
Energy: 1.019040748642282
Energy: 1.0022078418507263
Energy: 1.019040748642282
Energy: 1.0211306102011952
Energy: 1.0183314587207275
Energy: 1.022261869501243
Energy: 1.0183314587207275
Energy: 1.0211306102011952
Energy: 1.0183314587207275
Energy: 1.0178081235020935
Energy: 1.3214107529948815
Energy: 1.619106768592471
Energy: 1.3214107529936678
Energy: 1.0178081235020935
Energy: 1.3214107529948815
Energy: 1.0180077197386592
Energy: 1.0917571817676324
Energy: 1.493959240361171
Energy: 1.0917571817676324
Energy: 1.0180077197374457
Energy: 1.0917571817676324
Energy: 1.018231072074943
Energy: 1.0206539712123905
Energy: 1.02482245728751
Energy: 1.0206539712123905
Energy: 1.018231072074943
Energy: 1.0206539712123905
Energy: 1.0015827640509485
Energy: 1.020758451429126
Energy: 1.0184065801031323
Energy: 1.020758451429126
Energy: 1.0015827640509485
Energy: 1.020758451429126
Energy: 1.0017618221171907
Energy: 1.1017849903865042
Energy: 1.0017732767542606
Energy: 1.1017849903865042
Energy: 1.0017618221171907
Energy: 1.1017849903865042
Energy: 1.018465884000428
Energy: 1.019794630559362
Energy: 1.001753622585335
Energy: 1.019794630559362
Energy: 1.0184658839992142
Energy: 1.019794630559362
Energy: 1.0248243566381499
Energy: 1.0208504793193995
Energy: 1.018229381497954
Energy: 1.0208504793193995
Energy: 1.0248243566381499
Energy: 1.0208504793206135
Energy: 1.4937626632343723
Energy: 1.0917389451620974
Energy: 1.0180599137285187
Energy: 1.0917389451620974
Energy: 1.4937626632343723
Energy: 1.0917389451620974
Energy: 1.6187916564274356
Energy: 1.3214276567197598
Energy: 1.0177927822164046
Energy: 1.3214276567209733
Energy: 1.6187916564274356
Energy: 1.3214276567209733
Energy: 1.0223830401296745
Energy: 1.0183338480594637
Energy: 1.002833836063547
Energy: 1.0183338480594637
Energy: 1.0223830401296745
Energy: 1.0183338480594637
Energy: 1.008696583291647
Energy: 1.0190041500083815
Energy: 1.002411216139457
Energy: 1.0190041500083815
Energy: 1.008696583291647
Energy: 1.0190041500083815
Energy: 1.5778829956777023
Energy: 1.3568565115239841
Energy: 1.0078139720941046
Energy: 1.3568565115239841
Energy: 1.5778829956764886
Energy: 1.3568565115239841
Energy: 1.0042540127665336
Energy: 1.3564667557032826
Energy: 1.5860215310194077
Energy: 1.3564667557020686
Energy: 1.0042540127665336
Energy: 1.3564667557032826
Energy: 1.2624849759648331
Energy: 1.1104016251936135
Energy: 1.0026602460151453
Energy: 1.1104016251936135
Energy: 1.2624849759636194
Energy: 1.1104016251923998
Energy: 1.0082638345856991
Energy: 1.0179350211293907
Energy: 1.2620552531865006
Energy: 1.0179350211306042
Energy: 1.0082638345856991
Energy: 1.0179350211306042
Energy: 1.3568469488870059
Energy: 1.0666254650450917
Energy: 1.0609389157317097
Energy: 1.066625465043878
Energy: 1.3568469488870059
Energy: 1.066625465043878

minimum gb energy = 1.0015827640509485 eV
minimum distance =  2.26173080278558 Angstroms
sigma value = 33


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

Energy: 1.3431282248226444
Energy: 0.971039312524929
Energy: 1.532332936798443
Energy: 0.9710393125241591
Energy: 1.3431282248226444
Energy: 0.9710393125241591
Energy: 1.459434067822754
Energy: 0.9512639191913657
Energy: 0.9253588613602806
Energy: 0.9512639191913657
Energy: 1.459434067822754
Energy: 0.9512639191913657
Energy: 0.9334252312723437
Energy: 1.016650079932429
Energy: 1.4515185318046617
Energy: 1.016650079932429
Energy: 0.9334252312723437
Energy: 1.016650079932429
Energy: 1.02283960467577
Energy: 1.1000947778239516
Energy: 0.9342368334819212
Energy: 1.1000947778231815
Energy: 1.02283960467577
Energy: 1.1000947778239516
Energy: 1.2790678502061403
Energy: 0.9423508637818846
Energy: 1.2882943081382379
Energy: 0.9423508637826546
Energy: 1.2790678502061403
Energy: 0.9423508637811148
Energy: 1.2839227655608638
Energy: 1.153263830404664
Energy: 0.9300737234949952
Energy: 1.153263830403894
Energy: 1.2839227655608638
Energy: 1.153263830403894
Energy: 0.9341016085515997
Energy: 0.9526562994559876
Energy: 0.9505264928048782
Energy: 0.9526562994567574
Energy: 0.9341016085515997
Energy: 0.9526562994567574
Energy: 0.9503139755880208
Energy: 0.9251131512772397
Energy: 1.285335760474949
Energy: 0.9251131512780096
Energy: 0.9503139755880208
Energy: 0.9251131512772397
Energy: 1.2892603898945143
Energy: 1.1976710817692084
Energy: 1.2823788538061411
Energy: 1.1976710817692084
Energy: 1.2892603898945143
Energy: 1.1976710817699783
Energy: 0.9328655388818099
Energy: 0.9535456629685898
Energy: 0.9302966042512476
Energy: 1.0981906937890433
Energy: 0.9328655388818099
Energy: 0.9535456629693598
Energy: 0.9215991310043653
Energy: 1.0575441584996919
Energy: 0.9573993535904514
Energy: 1.0575441585004266
Energy: 0.9215991310051352
Energy: 1.0575441585004266
Energy: 0.9242004567073102
Energy: 1.023871895963936
Energy: 1.4830331075546968
Energy: 1.023871895964706
Energy: 0.9242004567065403
Energy: 1.023871895964706
Energy: 1.335271327438057
Energy: 0.9510717648133363
Energy: 1.3060650715412485
Energy: 0.9510717648133363
Energy: 1.3352713274387917
Energy: 0.9510717648125663
Energy: 0.9256652450135174
Energy: 1.1238508662683946
Energy: 0.9398598236390954
Energy: 1.1238508662691646
Energy: 0.9256652450135174
Energy: 1.1238508662699342
Energy: 1.2883422624441114
Energy: 1.0189810234704135
Energy: 0.9290948495471
Energy: 1.0189810234704135
Energy: 1.2883422624433416
Energy: 1.0189810234704135
Energy: 0.9346020264691318
Energy: 0.9260657221357523
Energy: 1.4814338378808634
Energy: 0.9260657221357523
Energy: 0.9346020264691318
Energy: 0.9260657221357523
Energy: 1.5320215344118215
Energy: 0.9632278958217705
Energy: 1.3147138261933629
Energy: 0.9632278958202307
Energy: 1.5320215344118215
Energy: 0.9632278958202307
Energy: 0.9299597107630017
Energy: 0.9504972864002761
Energy: 1.2134473526554683
Energy: 0.9504972864002761
Energy: 0.9299597107630017
Energy: 0.9504972864002761
Energy: 1.197822216601375
Energy: 0.9499606404197537
Energy: 0.929024214190952
Energy: 0.9499606404197537
Energy: 1.197822216601375
Energy: 0.9499606404197537
Energy: 1.278698622592775
Energy: 0.9443159759227115
Energy: 0.9537280358572692
Energy: 0.9443159759227115
Energy: 1.278698622592005
Energy: 0.9443159759234815
Energy: 1.4467033339107624
Energy: 1.1844574613747212
Energy: 0.9312881801083159
Energy: 1.1844574613747212
Energy: 1.446703333911532
Energy: 1.1844574613739514
Energy: 0.9305570047622269
Energy: 0.9513274863813613
Energy: 1.2909706210771645
Energy: 0.9513274863821313
Energy: 0.9305570047622269
Energy: 0.9513274863821313
Energy: 0.954937044956081
Energy: 0.9554166754443134
Energy: 0.9294182672813229
Energy: 0.9554166754443134
Energy: 0.954937044956081
Energy: 0.9554166754450834
Energy: 1.3066569228845415
Energy: 1.1907499365402294
Energy: 0.9216550381274957
Energy: 1.1907499365409997
Energy: 1.3066569228845415
Energy: 1.1907499365409997
Energy: 1.532814272540695
Energy: 1.0228827410547405
Energy: 0.9214596546386251
Energy: 1.0228827410547405
Energy: 1.5328142725391551
Energy: 1.0228827410547405
Energy: 0.9596834786594945
Energy: 1.1822687212461396
Energy: 0.9249565462428341
Energy: 1.1822687212461396
Energy: 0.9596834786594945
Energy: 1.1822687212461396
Energy: 0.928329695365007
Energy: 0.9530288888767295
Energy: 1.2898399915332377
Energy: 0.9530288888774994
Energy: 0.928329695365007
Energy: 0.9530288888774994
Energy: 1.2834509777840355
Energy: 1.1904107580532293
Energy: 0.9323827089440379
Energy: 1.1904107580532293
Energy: 1.2834509777840355
Energy: 1.1904107580532293
Energy: 1.2791885071040099
Energy: 0.9256330162565899
Energy: 0.9511571189224204
Energy: 0.9256330162573598
Energy: 1.2791885071040099
Energy: 0.9256330162573598
Energy: 0.9508224263064462
Energy: 0.9505493617729865
Energy: 0.9304222470560402
Energy: 0.9505493617729865
Energy: 0.9508224263056764
Energy: 0.9505493617729865
Energy: 0.9333894646574561
Energy: 1.154071858173275
Energy: 1.4465284992944016
Energy: 1.1540718581725051
Energy: 0.933389464656686
Energy: 1.1540718581725051
Energy: 1.2585974039590864
Energy: 0.9626637260911991
Energy: 1.2785962472063441
Energy: 0.962663726090429
Energy: 1.2585974039590864
Energy: 0.9626637260919688
Energy: 0.9330941810445451
Energy: 1.1208213857793838
Energy: 1.3394179285395917
Energy: 1.1208213857793838
Energy: 0.933094181045315
Energy: 1.120821385780154
Energy: 1.4521481364624458
Energy: 1.017158518123309
Energy: 0.9299055634591293
Energy: 1.017158518123309
Energy: 1.4521481364632156
Energy: 1.017158518123309
Energy: 0.9244803342068637
Energy: 0.9518219899366814
Energy: 1.3575292450685859
Energy: 0.9518219899359115
Energy: 0.9244803342068637
Energy: 0.9518219899359115
Energy: 1.3047761917406853
Energy: 0.9709565136155354
Energy: 1.3055977769881437
Energy: 0.9709565136155354
Energy: 1.3047761917399154
Energy: 0.9709565136155354
Energy: 0.9289045503338405
Energy: 1.1203929955795695
Energy: 1.4329388108436176
Energy: 1.12039299557572
Energy: 0.9289045503338405
Energy: 1.1203929955818797

minimum gb energy = 0.9214596546386251 eV
minimum distance =  2.19901419185798 Angstroms
sigma value = 41


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

Energy: 0.7527738412668907
Energy: 0.7582313814699186
Energy: 1.4846998673108667
Energy: 0.7582313814699186
Energy: 0.7527738412668907
Energy: 0.7582313814699186
Energy: 1.557444017804283
Energy: 0.758155325058312
Energy: 0.76239787515909
Energy: 0.758155325058312
Energy: 1.557444017804283
Energy: 0.758155325058312
Energy: 0.7505723300973238
Energy: 1.0188541899330021
Energy: 0.9836808319793409
Energy: 1.0188541899330021
Energy: 0.7505723300973238
Energy: 1.0188541899330021
Energy: 1.550419587292511
Energy: 0.758243397583705
Energy: 0.7630037578001311
Energy: 0.758243397583705
Energy: 1.550419587292511
Energy: 0.758243397583705
Energy: 0.749421791977995
Energy: 1.1919139864402108
Energy: 0.7651514254990709
Energy: 1.1919139864402108
Energy: 0.749421791977995
Energy: 1.1919139864402108
Energy: 0.7495192609852381
Energy: 0.7946068712790435
Energy: 0.7636842320367876
Energy: 0.7946068712790435
Energy: 0.7495192609852381
Energy: 0.7946068712790435
Energy: 1.5397141122761926
Energy: 0.7586712219850341
Energy: 0.7638162522628743
Energy: 0.7586712219850341
Energy: 1.5397141122761926
Energy: 0.7586712219850341
Energy: 0.75017533054121
Energy: 0.758176782584784
Energy: 0.7651994735015138
Energy: 0.758176782584784
Energy: 0.75017533054121
Energy: 0.758176782584784
Energy: 1.4796227339434365
Energy: 0.7947432212243883
Energy: 0.7628167162999279
Energy: 0.7947432212243883
Energy: 1.4796227339434365
Energy: 0.7947432212243883
Energy: 0.7530156866240016
Energy: 0.7584483965192528
Energy: 0.7608498469933961
Energy: 0.7584483965192528
Energy: 0.7530156866240016
Energy: 0.7584483965192528
Energy: 1.4865007057141604
Energy: 0.7582347201375476
Energy: 0.7625036813756524
Energy: 0.7582347201375476
Energy: 1.4865007057141604
Energy: 0.7582347201375476
Energy: 0.7523199522877393
Energy: 1.0186694894172084
Energy: 1.4065210709053022
Energy: 1.0186694894172084
Energy: 0.7523199522877393
Energy: 1.0186694894172084
Energy: 1.4864910084840213
Energy: 0.7582930965614734
Energy: 0.7624941234702557
Energy: 0.7582930965614734
Energy: 1.4864910084840213
Energy: 0.7582930965614734
Energy: 0.7529724870023319
Energy: 0.758558199396056
Energy: 0.7608528709226813
Energy: 0.758558199396056
Energy: 0.7529724870044339
Energy: 0.758558199396056

minimum gb energy = 0.749421791977995 eV
minimum distance =  2.37434276613711 Angstroms
sigma value = 11


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

Energy: 1.5833944412060923
Energy: 1.0905200372037556
Energy: 1.5020540118961112
Energy: 1.0905200372028319
Energy: 1.5833944412060923
Energy: 1.0905200372028319
Energy: 1.073853370973313
Energy: 1.1071555045340344
Energy: 1.0739921653899567
Energy: 1.107155504533111
Energy: 1.0738533709723892
Energy: 1.1071555045340344
Energy: 1.0748270542761356
Energy: 1.2020842000140912
Energy: 1.0741806584455116
Energy: 1.202084200015015
Energy: 1.0748270542761356
Energy: 1.202084200015015
Energy: 1.106644130021447
Energy: 1.1072663393612134
Energy: 1.0735733475864204
Energy: 1.1072663393612134
Energy: 1.106644130021447
Energy: 1.1072663393612134
Energy: 1.0739917030927166
Energy: 1.1908849927620184
Energy: 1.109648203926696
Energy: 1.1908849927620184
Energy: 1.073991703091793
Energy: 1.1908849927620184
Energy: 1.097334505075888
Energy: 1.1746678898400638
Energy: 1.0738439782454983
Energy: 1.1746678898400638
Energy: 1.0973345050768117
Energy: 1.1746678898400638
Energy: 1.1067817656433099
Energy: 1.1901711070040628
Energy: 1.0960160166185642
Energy: 1.1901711070031602
Energy: 1.1067817656433099
Energy: 1.1901711070031602
Energy: 1.0752165652562673
Energy: 1.1087014929036796
Energy: 1.073592864253461
Energy: 1.1087014929036796
Energy: 1.0752165652562673
Energy: 1.1087014929036796
Energy: 1.0751990684417914
Energy: 1.1991394049065593
Energy: 1.073387033914781
Energy: 1.1991394049074826
Energy: 1.0751990684417914
Energy: 1.1991394049074826
Energy: 1.0739663381807651
Energy: 1.1073056956672103
Energy: 1.1078789224863996
Energy: 1.107305695668134
Energy: 1.0739663381798414
Energy: 1.107305695668134
Energy: 1.1071255913301101
Energy: 1.0786215388339393
Energy: 1.0972984698782768
Energy: 1.0786215388339393
Energy: 1.1071255913301101
Energy: 1.0786215388339393
Energy: 1.075613381914069
Energy: 1.1759272072495066
Energy: 1.097132031700382
Energy: 1.1759272072495066
Energy: 1.075613381914069
Energy: 1.17592720725043
Energy: 1.0741340692745374
Energy: 1.3981832420619293
Energy: 1.146465282010946
Energy: 1.3981832420628528
Energy: 1.0741340692745374
Energy: 1.3981832420628528
Energy: 1.1083187139235662
Energy: 1.1989354259888487
Energy: 1.108244524503936
Energy: 1.1989354259888487
Energy: 1.1083187139235662
Energy: 1.1989354259888487
Energy: 1.0733565859318446
Energy: 1.2955303452296252
Energy: 1.0737584886901268
Energy: 1.2955303452296252
Energy: 1.0733565859318446
Energy: 1.2955303452296252
Energy: 1.1070633954989868
Energy: 1.0735417377745482
Energy: 1.0978049662080984
Energy: 1.073541737772701
Energy: 1.1070633954962164
Energy: 1.0735417377736245
Energy: 1.0960489914408125
Energy: 1.6088138893604902
Energy: 1.075169571725441
Energy: 1.6088138893604902
Energy: 1.0960489914408125
Energy: 1.6088138893604902
Energy: 1.073812370373919
Energy: 1.296649131573135
Energy: 1.0737946840227928
Energy: 1.2966491315740583
Energy: 1.073812370373919
Energy: 1.296649131573135
Energy: 1.107383222225237
Energy: 1.10714341965808
Energy: 1.1082057656981321
Energy: 1.10714341965808
Energy: 1.107383222225237
Energy: 1.10714341965808
Energy: 1.073825219257046
Energy: 1.400881426232938
Energy: 1.0747224069274839
Energy: 1.400881426232938
Energy: 1.073825219257046
Energy: 1.400881426232938
Energy: 1.0969074627749293
Energy: 1.1758219719526102
Energy: 1.07513458637179
Energy: 1.1758219719526102
Energy: 1.0969074627749293
Energy: 1.1758219719526102
Energy: 1.0972441994224857
Energy: 1.078755799397718
Energy: 1.1083247143161894
Energy: 1.078755799397718
Energy: 1.0972441994215623
Energy: 1.078755799397718
Energy: 1.2273184899853848
Energy: 1.1071891328471064
Energy: 1.130051870344225
Energy: 1.1071891328471064
Energy: 1.2273184899853848
Energy: 1.1071891328471064
Energy: 1.0733722728570194
Energy: 1.198715508952904
Energy: 1.0744304756438339
Energy: 1.198715508952904
Energy: 1.073372272857943
Energy: 1.198715508952904
Energy: 1.0762392067715436
Energy: 1.1083677878677203
Energy: 1.0746976932531076
Energy: 1.1083677878677203
Energy: 1.0762392067715436
Energy: 1.1083677878677203
Energy: 1.0957234848513786
Energy: 1.1907072119216642
Energy: 1.1066689596444363
Energy: 1.1907072119216642
Energy: 1.0957234848513786
Energy: 1.1907072119216642
Energy: 1.073839312181334
Energy: 1.1747429688458608
Energy: 1.0740499400505013
Energy: 1.1747429688449373
Energy: 1.073839312181334
Energy: 1.1747429688458608
Energy: 1.10666075516102
Energy: 1.1906950050722112
Energy: 1.0975194358914335
Energy: 1.1906950050722112
Energy: 1.1066607551619436
Energy: 1.1906950050722112
Energy: 1.0743008992299168
Energy: 1.1076101712006963
Energy: 1.106732518689159
Energy: 1.1076101712006963
Energy: 1.0743008992299168
Energy: 1.1076101712006963
Energy: 1.0738998754904872
Energy: 1.1074885367732
Energy: 1.0756631249516535
Energy: 1.1074885367732
Energy: 1.0738998754904872
Energy: 1.1074885367741234
Energy: 1.0734755193451042
Energy: 1.1071066579105517
Energy: 1.0739192170087726
Energy: 1.1071066579096283
Energy: 1.0734755193451042
Energy: 1.1071066579096283

minimum gb energy = 1.0733565859318446 eV
minimum distance =  2.2193769633446 Angstroms
sigma value = 57


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

Energy: 1.301719871771299
Energy: 1.2563212149009824
Energy: 1.480864811049026
Energy: 1.256321214899339
Energy: 1.301719871771299
Energy: 1.2563212149009824
Energy: 1.1975426898086379
Energy: 1.3186908425492652
Energy: 1.189508110552355
Energy: 1.2628417637655216
Energy: 1.1975426898086379
Energy: 1.1903503649844676
Energy: 1.1899621742324016
Energy: 1.2967660264084395
Energy: 1.1897590443722061
Energy: 1.2967660264084395
Energy: 1.1899621742324016
Energy: 1.2967660264084395
Energy: 1.1897412098197273
Energy: 1.3398982190119841
Energy: 1.1897316034446166
Energy: 1.2659427081248233
Energy: 1.1897412098197273
Energy: 1.2658810791916622
Energy: 1.1896289999855176
Energy: 1.2968247812625182
Energy: 1.1900256732277719
Energy: 1.2968247812625182
Energy: 1.1896289999855176
Energy: 1.2968247812625182
Energy: 1.1895182142930636
Energy: 1.1903549486538922
Energy: 1.1975515501280316
Energy: 1.1903549486538922
Energy: 1.1895182142930636
Energy: 1.1903549486538922
Energy: 1.480864811049026
Energy: 1.2563212149009824
Energy: 1.301719871771299
Energy: 1.2563212149009824
Energy: 1.480864811049026
Energy: 1.256321214899339
Energy: 1.1895081105539984
Energy: 1.3186908425509085
Energy: 1.1975426898086379
Energy: 1.3186908425492652
Energy: 1.1895081105539984
Energy: 1.2628417637655216
Energy: 1.1897590443722061
Energy: 1.2967660264084395
Energy: 1.1899621742324016
Energy: 1.2967660264084395
Energy: 1.1897590443722061
Energy: 1.2967660264084395
Energy: 1.1897316034446166
Energy: 1.2659427081264294
Energy: 1.1897412098197273
Energy: 1.264370059734558
Energy: 1.1897316034446166
Energy: 1.2659427081264294
Energy: 1.1900256732277719
Energy: 1.2968247812625182
Energy: 1.1896289999871608
Energy: 1.2968247812625182
Energy: 1.1900256732277719
Energy: 1.2968247812625182
Energy: 1.1975515501280316
Energy: 1.1903549486538922
Energy: 1.1895182142930636
Energy: 1.1903549486538922
Energy: 1.1975515501280316
Energy: 1.1903549486538922
Energy: 1.301719871771299
Energy: 1.2563212149009824
Energy: 1.4449669180300824
Energy: 1.2563212149009824
Energy: 1.301719871771299
Energy: 1.2563212149009824
Energy: 1.1975426898086379
Energy: 1.2628417637655216
Energy: 1.189508110552355
Energy: 1.2628417637655216
Energy: 1.1975426898086379
Energy: 1.1903503649844676
Energy: 1.1899621742324016
Energy: 1.2967660264084395
Energy: 1.1897590443722061
Energy: 1.2967660264084395
Energy: 1.1899621742324016
Energy: 1.2967660264084395
Energy: 1.1897412098197273
Energy: 1.264414866011649
Energy: 1.1897316034446166
Energy: 1.2659427081248233
Energy: 1.1897412098197273
Energy: 1.2658810791933055
Energy: 1.1896289999871608
Energy: 1.2968247812625182
Energy: 1.1900256732277719
Energy: 1.2968247812625182
Energy: 1.1896289999855176
Energy: 1.2968247812625182

minimum gb energy = 1.189508110552355 eV
minimum distance =  2.23513162836796 Angstroms
sigma value = 9


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

Energy: 1.3705418584217288
Energy: 1.347657812204117
Energy: 1.3508066143333797
Energy: 1.3476578122027751
Energy: 1.3705418584230709
Energy: 1.3476578122027751
Energy: 1.2668664471761142
Energy: 1.3565263610802394
Energy: 1.3464547373789744
Energy: 1.3565263610815812
Energy: 1.2668664471761142
Energy: 1.3565263610815812
Energy: 1.370351378475074
Energy: 1.3697128903957831
Energy: 1.3479185589060565
Energy: 1.3697128903971247
Energy: 1.3703513784737322
Energy: 1.3697128903971247
Energy: 1.3510759233925642
Energy: 1.3531821844247673
Energy: 1.2726434562841904
Energy: 1.3531821844234255
Energy: 1.3510759233925642
Energy: 1.3531821844234255
Energy: 1.2666528574256708
Energy: 1.445033004510398
Energy: 1.3474153194802956
Energy: 1.4450330045090563
Energy: 1.2666528574256708
Energy: 1.445033004510398
Energy: 1.3507499540169154
Energy: 1.3697569087758918
Energy: 1.3480203950393466
Energy: 1.3697569087758918
Energy: 1.3507499540155736
Energy: 1.3697569087758918
Energy: 1.3526350599760153
Energy: 1.5177539388246568
Energy: 1.349449198551748
Energy: 1.5177539388246568
Energy: 1.3526350599760153
Energy: 1.5177539388246568
Energy: 1.28966771981063
Energy: 1.3554803623789604
Energy: 1.353799549256025
Energy: 1.3554803623789604
Energy: 1.28966771981063
Energy: 1.3554803623789604
Energy: 1.286504013538551
Energy: 1.3693274058422051
Energy: 1.2700001137714174
Energy: 1.3693274058422051
Energy: 1.2865040135398929
Energy: 1.3693274058422051
Energy: 1.3555129011801825
Energy: 1.3531812847967704
Energy: 1.3547590660080175
Energy: 1.3531812847981122
Energy: 1.3555129011801825
Energy: 1.3531812847981122
Energy: 1.3531366503870967
Energy: 1.4064563558460237
Energy: 1.2932104285578205
Energy: 1.4064563558460237
Energy: 1.3531366503870967
Energy: 1.4064563558460237
Energy: 1.350384505080853
Energy: 1.3540856133642845
Energy: 1.2841363392225245
Energy: 1.3540856133642845
Energy: 1.350384505080853
Energy: 1.3540856133642845
Energy: 1.352189383299137
Energy: 1.3522722921358115
Energy: 1.280839493578188
Energy: 1.3522722921371535
Energy: 1.352189383299137
Energy: 1.3522722921371535
Energy: 1.3505791700011256
Energy: 1.3524186544568835
Energy: 1.2703863997566718
Energy: 1.352418654459567
Energy: 1.3505791700011256
Energy: 1.352418654459567
Energy: 1.3507604400375377
Energy: 1.5126441752205837
Energy: 1.353462781093148
Energy: 1.5126441752205837
Energy: 1.3507604400375377
Energy: 1.5126441752205837
Energy: 1.2864581380019364
Energy: 1.3667152415628852
Energy: 1.269856465732566
Energy: 1.3667152415615431
Energy: 1.2864581380019364
Energy: 1.3667152415615431
Energy: 1.2865501342619299
Energy: 1.3916390196251414
Energy: 1.3121470438816685
Energy: 1.3916390196224582
Energy: 1.2865501342619299
Energy: 1.3916390196197745
Energy: 1.3636927981279496
Energy: 1.5161852888857659
Energy: 1.3547730782492298
Energy: 1.5161852888844243
Energy: 1.3636927981279496
Energy: 1.5161852888844243
Energy: 1.3532855432663011
Energy: 1.3522400902639942
Energy: 1.2920917481367202
Energy: 1.3522400902639942
Energy: 1.3532855432676427
Energy: 1.352240090265336
Energy: 1.3591952404272756
Energy: 1.445401440002115
Energy: 1.3535671211485574
Energy: 1.4454014400034567
Energy: 1.3591952404272756
Energy: 1.4454014400034567
Energy: 1.3531899501049802
Energy: 1.353025731483035
Energy: 1.2808401978553186
Energy: 1.353025731483035
Energy: 1.3531899501036688
Energy: 1.353025731483035

minimum gb energy = 1.2666528574256708 eV
minimum distance =  2.22012428264498 Angstroms
sigma value = 27


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

Energy: 1.4543991632193722
Energy: 1.3185980081435555
Energy: 1.3715518917788916
Energy: 1.3185980081435555
Energy: 1.4543991632193722
Energy: 1.3185980081435555
Energy: 1.3044722893654956
Energy: 1.2669075458326657
Energy: 1.3090264168378025
Energy: 1.2669075458326657
Energy: 1.3044722893654956
Energy: 1.2669075458326657
Energy: 1.3336723441532525
Energy: 1.287211534785746
Energy: 1.3087113473903023
Energy: 1.287211534785746
Energy: 1.3336723441532525
Energy: 1.287211534785746
Energy: 1.3673707814029612
Energy: 1.5347889234593681
Energy: 1.3349090202828058
Energy: 1.5347889234593681
Energy: 1.3673707814029612
Energy: 1.5347889234593681
Energy: 1.266740144625014
Energy: 1.3459307216384035
Energy: 1.2690854801681661
Energy: 1.3459307216384035
Energy: 1.266740144625014
Energy: 1.3459307216384035
Energy: 1.3584823070603325
Energy: 1.3753252306814234
Energy: 1.3113699203428524
Energy: 1.3753252306814234
Energy: 1.3584823070603325
Energy: 1.3753252306814234
Energy: 1.3503882356081973
Energy: 1.489496929591325
Energy: 1.3186417504871564
Energy: 1.489496929592456
Energy: 1.3503882356081973
Energy: 1.489496929591325
Energy: 1.290445679824116
Energy: 1.299824901836566
Energy: 1.3184768865737684
Energy: 1.299824901836566
Energy: 1.290445679824116
Energy: 1.299824901836566
Energy: 1.383672309098295
Energy: 1.5513755919494663
Energy: 1.3662597847886642
Energy: 1.5513755919505972
Energy: 1.383672309098295
Energy: 1.5513755919494663
Energy: 1.3103383138719444
Energy: 1.2899321190296265
Energy: 1.3195403462391968
Energy: 1.2899321190284954
Energy: 1.3103383138719444
Energy: 1.2899321190284954
Energy: 1.33120414359948
Energy: 1.2721951208680617
Energy: 1.3194643346088268
Energy: 1.2721951208680617
Energy: 1.33120414359948
Energy: 1.2721951208680617
Energy: 1.383710218978828
Energy: 1.5514339648331956
Energy: 1.3287061423164823
Energy: 1.5514339648331956
Energy: 1.383710218978828
Energy: 1.5514339648331956
Energy: 1.290029941911175
Energy: 1.299203014801631
Energy: 1.3189594776626432
Energy: 1.2992030148004998
Energy: 1.2900299419100436
Energy: 1.299203014801631
Energy: 1.2935983390609904
Energy: 1.4756522085229922
Energy: 1.3185466677353042
Energy: 1.4756522085229922
Energy: 1.2935983390609904
Energy: 1.4756522085229922
Energy: 1.3655095755463833
Energy: 1.3759600712784186
Energy: 1.3116740961647149
Energy: 1.3759600712784186
Energy: 1.3655095755475142
Energy: 1.3759600712795494
Energy: 1.2670972192653596
Energy: 1.3459307216384035
Energy: 1.2697143526787056
Energy: 1.3459307216384035
Energy: 1.2670972192653596
Energy: 1.3459307216384035
Energy: 1.366992179368135
Energy: 1.4897798615181028
Energy: 1.2657524818021393
Energy: 1.4897798615192337
Energy: 1.366992179368135
Energy: 1.4897798615181028
Energy: 1.3098239335045752
Energy: 1.2874021796036605
Energy: 1.3088535066383826
Energy: 1.2874021796036605
Energy: 1.3098239335045752
Energy: 1.2874021796036605
Energy: 1.3488424758646707
Energy: 1.2988013170705421
Energy: 1.3089854456318997
Energy: 1.298801317069411
Energy: 1.3488424758646707
Energy: 1.298801317069411
Energy: 1.4543991632193722
Energy: 1.3185980081435555
Energy: 1.3715518917788916
Energy: 1.3185980081435555
Energy: 1.4543991632193722
Energy: 1.3185980081435555
Energy: 1.3044722893654956
Energy: 1.2669075458326657
Energy: 1.3090264168366714
Energy: 1.2669075458326657
Energy: 1.3044722893654956
Energy: 1.2669075458326657
Energy: 1.3336723441521214
Energy: 1.287211534785746
Energy: 1.308711347389171
Energy: 1.287211534785746
Energy: 1.3336723441521214
Energy: 1.287211534784615
Energy: 1.3673707814029612
Energy: 1.5347889234593681
Energy: 1.316589200849896
Energy: 1.5347889234593681
Energy: 1.3673707814029612
Energy: 1.5347889234593681
Energy: 1.266740144625014
Energy: 1.345930721637273
Energy: 1.269085480167035
Energy: 1.345930721637273
Energy: 1.266740144625014
Energy: 1.3459307216384035
Energy: 1.3584823070614636
Energy: 1.3753252306814234
Energy: 1.3113699203428524
Energy: 1.3753252306814234
Energy: 1.3584823070614636
Energy: 1.3753252306814234

minimum gb energy = 1.2657524818021393 eV
minimum distance =  2.23633516847822 Angstroms
sigma value = 19


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

Energy: 1.469199960097234
Energy: 1.2888559982043146
Energy: 1.3462072595699943
Energy: 1.2888559982043146
Energy: 1.4691999600962578
Energy: 1.2888559982043146
Energy: 1.2760636670773842
Energy: 1.268829268422513
Energy: 1.2732733814702435
Energy: 1.268829268422513
Energy: 1.2760636670783603
Energy: 1.268829268422513
Energy: 1.2650923371250566
Energy: 1.2677785738021983
Energy: 1.2732441876869993
Energy: 1.267778573801222
Energy: 1.2650923371250566
Energy: 1.2677785738021983
Energy: 1.28463018860146
Energy: 1.4112468997379306
Energy: 1.2988579690991549
Energy: 1.4112468997369543
Energy: 1.28463018860146
Energy: 1.4112468997369543
Energy: 1.2683912076935777
Energy: 1.2657812258701235
Energy: 1.2953622317208433
Energy: 1.2657812258701235
Energy: 1.2683912076935777
Energy: 1.2657812258701235
Energy: 1.2901728167410682
Energy: 1.461173091968664
Energy: 1.2814257130745197
Energy: 1.4611730919696404
Energy: 1.2901728167410682
Energy: 1.4611730919696404
Energy: 1.2537616687896855
Energy: 1.4841790536160595
Energy: 1.2951103810056377
Energy: 1.4841790536160595
Energy: 1.2537616687896855
Energy: 1.4841790536160595
Energy: 1.253902857249117
Energy: 1.4583518442449095
Energy: 1.2821337624137552
Energy: 1.4583518442458636
Energy: 1.253902857249117
Energy: 1.4583518442458636
Energy: 1.2845901207583563
Energy: 1.4589071088057572
Energy: 1.310961194072883
Energy: 1.4589071088057572
Energy: 1.2845901207583563
Energy: 1.4589071088057572
Energy: 1.267831500665411
Energy: 1.3814816020016978
Energy: 1.2739829309009085
Energy: 1.3814816020016978
Energy: 1.267831500665411
Energy: 1.3814816020016978
Energy: 1.2537643425566598
Energy: 1.2683623607850345
Energy: 1.2729898375731528
Energy: 1.2683623607840582
Energy: 1.2537643425576361
Energy: 1.2683623607850345
Energy: 1.2908130408420353
Energy: 1.2495811530265595
Energy: 1.2639219475056374
Energy: 1.2495811530265595
Energy: 1.2908130408420353
Energy: 1.2495811530265595
Energy: 1.2907334107080561
Energy: 1.247187912120783
Energy: 1.2637306428980124
Energy: 1.247187912120783
Energy: 1.2907334107080561
Energy: 1.247187912120783
Energy: 1.2825856985236768
Energy: 1.5467777444079378
Energy: 1.3471750446845923
Energy: 1.5467777444079378
Energy: 1.2825856985236768
Energy: 1.5467777444079378
Energy: 1.2845564226930353
Energy: 1.296343773018987
Energy: 1.263897941074061
Energy: 1.296343773018987
Energy: 1.2845564226930353
Energy: 1.296343773018987
Energy: 1.3058919718096091
Energy: 1.3692564785794814
Energy: 1.2491316665153
Energy: 1.3692564785794814
Energy: 1.3058919718096091
Energy: 1.3692564785794814
Energy: 1.2655333012926353
Energy: 1.4578962916371339
Energy: 1.2927995455926742
Energy: 1.4578962916361575
Energy: 1.2655333012926353
Energy: 1.4578962916371339
Energy: 1.2977243243792207
Energy: 1.3144336874890008
Energy: 1.2468818713678873
Energy: 1.3144336874890008
Energy: 1.2977243243792207
Energy: 1.3144336874890008
Energy: 1.2659673297968133
Energy: 1.4582137209828916
Energy: 1.267818855411935
Energy: 1.458213720983868
Energy: 1.2659673297977896
Energy: 1.458213720983868
Energy: 1.3060954689173194
Energy: 1.3701006360732375
Energy: 1.2609061351383786
Energy: 1.3701006360732375
Energy: 1.3060954689182958
Energy: 1.3701006360722612
Energy: 1.2846329424200347
Energy: 1.3803120737478682
Energy: 1.2640437531327835
Energy: 1.3803120737468921
Energy: 1.2846329424200347
Energy: 1.3803120737468921
Energy: 1.2837500582774122
Energy: 1.4653200905692565
Energy: 1.3472658544167597
Energy: 1.4653200905692565
Energy: 1.2837500582774122
Energy: 1.4653200905692565
Energy: 1.329877416605209
Energy: 1.2630358536469235
Energy: 1.2638631030227396
Energy: 1.2630358536469235
Energy: 1.3298774166042326
Energy: 1.2630358536469235
Energy: 1.3301394424129258
Energy: 1.274133501934871
Energy: 1.2640078826428343
Energy: 1.274133501934871
Energy: 1.3301394424129258
Energy: 1.2741335019338946
Energy: 1.4074155306453444
Energy: 1.4658777681194433
Energy: 1.3026806481412543
Energy: 1.4658777681194433
Energy: 1.4074155306453444
Energy: 1.4658777681194433
Energy: 1.2678436037163991
Energy: 1.267751148238564
Energy: 1.2731254122122526
Energy: 1.2677511482405166
Energy: 1.2678436037173533
Energy: 1.2677511482395403
Energy: 1.2847118596407145
Energy: 1.3710432897772395
Energy: 1.2876643060145099
Energy: 1.3710432897772395
Energy: 1.2847118596407145
Energy: 1.3710432897772395
Energy: 1.2539142206687393
Energy: 1.4578090133118902
Energy: 1.2813621118549967
Energy: 1.4578090133128665
Energy: 1.253914220667763
Energy: 1.4578090133128665
Energy: 1.2541981671054714
Energy: 1.4925407793454888
Energy: 1.2950989830952684
Energy: 1.4925407793464651
Energy: 1.2541981671054714
Energy: 1.4925407793464651

minimum gb energy = 1.2468818713678873 eV
minimum distance =  2.21601357836679 Angstroms
sigma value = 101


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

Energy: 1.4058871633389067
Energy: 1.3639663558578314
Energy: 1.2725264721952279
Energy: 1.3639663558578314
Energy: 1.4058871633380488
Energy: 1.3639663558578314
Energy: 1.2455339910655239
Energy: 1.2336236336642983
Energy: 1.243724776868438
Energy: 1.23362363366344
Energy: 1.2455339910655239
Energy: 1.23362363366344
Energy: 1.2290056950332013
Energy: 1.3483323588281906
Energy: 1.2484416823961972
Energy: 1.3483323588290488
Energy: 1.2290056950332013
Energy: 1.3483323588290488
Energy: 1.2278381829402425
Energy: 1.4354290908616991
Energy: 1.2384541027344023
Energy: 1.4451950085287373
Energy: 1.2278381829402425
Energy: 1.4354290908616991
Energy: 1.216048763968504
Energy: 1.388534186589552
Energy: 1.2305657495615439
Energy: 1.3885341865904102
Energy: 1.216048763968504
Energy: 1.388534186589552
Energy: 1.230238850283539
Energy: 1.42293864630308
Energy: 1.2156276824635377
Energy: 1.42293864630308
Energy: 1.230238850283539
Energy: 1.42293864630308
Energy: 1.2302989375068567
Energy: 1.468478265254743
Energy: 1.2158493214640829
Energy: 1.468478265254743
Energy: 1.2302989375068567
Energy: 1.468478265254743
Energy: 1.2287331627951463
Energy: 1.4520598276796084
Energy: 1.2287164928965164
Energy: 1.469706813938589
Energy: 1.2287331627951463
Energy: 1.4241998467036643
Energy: 1.2156753738011856
Energy: 1.422966368365561
Energy: 1.2292807130422787
Energy: 1.422966368365561
Energy: 1.2156753738011856
Energy: 1.422966368365561
Energy: 1.215464034416564
Energy: 1.3532763696717929
Energy: 1.2155416730741082
Energy: 1.3532763696717929
Energy: 1.215464034416564
Energy: 1.3532763696717929
Energy: 1.2546877410810053
Energy: 1.4186112670565536
Energy: 1.2802525945597543
Energy: 1.4186112670565536
Energy: 1.2546877410810053
Energy: 1.4186112670565536
Energy: 1.2438340615439518
Energy: 1.347880933733401
Energy: 1.2167195715120103
Energy: 1.3478809337325428
Energy: 1.24383406154481
Energy: 1.3478809337325428
Energy: 1.2440777897487334
Energy: 1.2801950313772337
Energy: 1.2227138698568742
Energy: 1.2801950313849577
Energy: 1.2440777897478752
Energy: 1.2801950313729427
Energy: 1.2370611039590322
Energy: 1.2938799354210544
Energy: 1.2436053154718976
Energy: 1.2781538631352374
Energy: 1.2370611039581738
Energy: 1.2938799354219126
Energy: 1.225566605681471
Energy: 1.3510972468239129
Energy: 1.243612187868465
Energy: 1.3510972468239129
Energy: 1.225566605681471
Energy: 1.3510972468239129
Energy: 1.2523247467720329
Energy: 1.2803029464498599
Energy: 1.2298652295021653
Energy: 1.2803029464490019
Energy: 1.2523247467720329
Energy: 1.2803029464490019
Energy: 1.2156830560330805
Energy: 1.4351008915990622
Energy: 1.2157914232253395
Energy: 1.4351008915999202
Energy: 1.2156830560330805
Energy: 1.4351008915990622
Energy: 1.2285464787015286
Energy: 1.316056958074264
Energy: 1.2154404040619682
Energy: 1.316056958074264
Energy: 1.2285464787015286
Energy: 1.316056958074264
Energy: 1.2306329595006904
Energy: 1.4231382109089064
Energy: 1.2297165299816877
Energy: 1.4231382109089064
Energy: 1.2306329595006904
Energy: 1.4231382109089064
Energy: 1.2156533750977558
Energy: 1.2849846960772313
Energy: 1.2153483261957854
Energy: 1.2849846960772313
Energy: 1.2156533750977558
Energy: 1.2849846960772313
Energy: 1.2451075983744644
Energy: 1.2925317576232631
Energy: 1.2289439281165235
Energy: 1.2925317576232631
Energy: 1.2451075983744644
Energy: 1.2925317576232631
Energy: 1.2161393126690125
Energy: 1.4218579349760243
Energy: 1.215324407290382
Energy: 1.4218579349760243
Energy: 1.2161393126681543
Energy: 1.4218579349760243
Energy: 1.2289228404437913
Energy: 1.422098028995132
Energy: 1.215752997909952
Energy: 1.4220980289959901
Energy: 1.2289228404437913
Energy: 1.4220980289959901
Energy: 1.2277949802898325
Energy: 1.447840685553481
Energy: 1.2836875422191631
Energy: 1.447840685553481
Energy: 1.227794980290691
Energy: 1.447840685553481
Energy: 1.2157786451591062
Energy: 1.3345117163466944
Energy: 1.2274910491155955
Energy: 1.3345117163466944
Energy: 1.2157786451591062
Energy: 1.3345117163466944
Energy: 1.2226498182302383
Energy: 1.4241466711847701
Energy: 1.252260209023196
Energy: 1.4241466711847701
Energy: 1.2226498182293801
Energy: 1.4241466711856283
Energy: 1.2438218076926304
Energy: 1.2158362928985207
Energy: 1.2154842310708478
Energy: 1.2158362928976625
Energy: 1.2438218076934886
Energy: 1.2158362928976625
Energy: 1.2438577792794154
Energy: 1.2160435894482364
Energy: 1.2152375770819621
Energy: 1.2160435894482364
Energy: 1.2438577792794154
Energy: 1.2160435894482364
Energy: 1.2723486854100012
Energy: 1.2806604339404737
Energy: 1.305219078300333
Energy: 1.2806604339404737
Energy: 1.2723486854100012
Energy: 1.2806604339404737
Energy: 1.2154714638784663
Energy: 1.2247684278873523
Energy: 1.215374408143839
Energy: 1.2247684278882105
Energy: 1.2154714638784663
Energy: 1.2247684278882105
Energy: 1.2155043059522643
Energy: 1.2924466967524397
Energy: 1.228643042763843
Energy: 1.2924466967524397
Energy: 1.2155043059531228
Energy: 1.2924466967532977
Energy: 1.222752056320498
Energy: 1.4192009798640293
Energy: 1.2155036651397941
Energy: 1.4192009798640293
Energy: 1.222752056320498
Energy: 1.4192009798640293
Energy: 1.215816611454475
Energy: 1.283857737828289
Energy: 1.2290267519794202
Energy: 1.283857737828289
Energy: 1.215816611454475
Energy: 1.283857737828289

minimum gb energy = 1.2152375770819621 eV
minimum distance =  2.22905113422997 Angstroms
sigma value = 33


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

Energy: 0.015084776044600106
Energy: 0.01586306923517507
Energy: 1.5081584178291287
Energy: 0.015863069226776837
Energy: 0.015084776044600106
Energy: 0.015863069230975954
Energy: 0.01549027991600406
Energy: 0.7831445065991467
Energy: 0.01549027991600406
Energy: 0.7831445065991467
Energy: 0.01549027991600406
Energy: 0.7831445065991467
Energy: 1.676273427325952
Energy: 0.01586306922329078
Energy: 0.015084776044600106
Energy: 0.01586306922329078
Energy: 1.676273427325952
Energy: 0.015863069224003837
Energy: 0.01549027991600406
Energy: 0.7831445065991467
Energy: 0.01549027991600406
Energy: 0.7831445065991467
Energy: 0.01549027991600406
Energy: 0.7831445065991467

minimum gb energy = 0.015084776044600106 eV
minimum distance =  2.44288442124933 Angstroms
sigma value = 1