Model name: model_name=EAM_Dynamo_HepburnAckland_2008_FeC__MO_143977152728_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8553125262260437
cohesive_energy=4.013297914353109
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 0.014074228722378563
Energy: 0.014545565307523175
Energy: 0.014318618625433939
Energy: 2.085568794446322
Energy: 0.014318618625644578
Energy: 0.014545565307286209
Energy: 0.014074228723089468
Energy: 0.014545565307760145
Energy: 0.014318618625433939
Energy: 1.445895194976735
Energy: 0.6817518614022802
Energy: 0.016037213189533328
Energy: 0.016397907207930537
Energy: 0.6713197196245553
Energy: 0.016397907207930537
Energy: 0.016037213189533328
Energy: 0.6817518614025171
Energy: 0.01603721319000726
Energy: 0.01639790720748293
Energy: 0.6713197196254769
Energy: 0.014074228722852501
Energy: 0.014545565307760145
Energy: 0.014318618624486065
Energy: 2.0855687944454004
Energy: 0.014318618625196972
Energy: 0.014545565306601631
Energy: 0.014074228722615531
Energy: 0.014545565307049238
Energy: 0.014318618625433939
Energy: 1.445895194977209
Energy: 0.6817518614022802
Energy: 0.016037213190691842
Energy: 0.016397907207693567
Energy: 0.6713197196254769
Energy: 0.01639790720885208
Energy: 0.016037213191165776
Energy: 0.6817518614022802
Energy: 0.016037213190454872
Energy: 0.016397907207693567
Energy: 0.6713197196247922
Energy: 0.014074228722615531
Energy: 0.014545565307523175
Energy: 0.014318618624960002
Energy: 2.017465396453766
Energy: 0.014318618625644578
Energy: 0.014545565306601631
Energy: 0.014074228722852501
Energy: 0.014545565307049238
Energy: 0.014318618625196972
Energy: 1.445895194979052
Energy: 0.6817518614022802
Energy: 0.01603721319000726
Energy: 0.016397907207930537
Energy: 0.6713197196247922
Energy: 0.016397907208167507
Energy: 0.016037213190454872
Energy: 0.6817518614025171
Energy: 0.01603721319000726
Energy: 0.016397907208167507
Energy: 0.6713197196254769
Energy: 0.014074228723089468
Energy: 0.014545565307286209
Energy: 0.014318618624723034
Energy: 1.8515580866471721
Energy: 0.014318618625881546
Energy: 0.014545565307286209
Energy: 0.014074228722378563
Energy: 0.014545565307049238
Energy: 0.014318618625196972
Energy: 1.445895194978815

minimum gb energy = 0.014074228722378563 eV
minimum distance =  2.26848699257533 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 1.379260670680844
Energy: 1.4390291356381975
Energy: 1.3627332675173993
Energy: 1.4433866806804188
Energy: 1.358381493052807
Energy: 1.480538904428594
Energy: 1.3792606706825465
Energy: 1.4390291356319542
Energy: 1.3343452750644353
Energy: 1.3854265114518292
Energy: 1.3211243050651968
Energy: 1.4156916359289176
Energy: 1.456126222177534
Energy: 1.3323597636875253
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Energy: 1.3576644627219154
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Energy: 1.3239663072597074
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Energy: 1.2729722475239498
Energy: 1.3576644627219154
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Energy: 1.3326595780736485
Energy: 1.3239663072614103
Energy: 1.4224591924097258
Energy: 1.2940207064519569
Energy: 1.2778312813068908
Energy: 1.3168809488915338
Energy: 1.3042338708102363
Energy: 1.32632641115359
Energy: 1.4224591924085908
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Energy: 1.3024801817781688
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Energy: 1.3970107183323137
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Energy: 1.3139510900755422
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Energy: 1.2485861144636559
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Energy: 1.3469430510384
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Energy: 1.3718705575577177
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Energy: 1.298190804521695
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Energy: 1.3321772295836696
Energy: 1.3776070385560608
Energy: 1.495045841353492
Energy: 1.333166177995785
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Energy: 1.3396301064672136
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Energy: 1.4465901028884252
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Energy: 1.2827793328588895
Energy: 1.3013098710655258
Energy: 1.3202484679692186
Energy: 1.5003608134134252
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Energy: 1.2827793328571868
Energy: 1.3013098710643907
Energy: 1.3202484679686508
Energy: 1.5003608134128579
Energy: 1.2922059966716317
Energy: 1.303680503432855
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Energy: 1.3035836347048069
Energy: 1.284764974368837
Energy: 1.2772604119044886
Energy: 1.2922059966704966
Energy: 1.3036805034317198
Energy: 1.3023415092899167
Energy: 1.3035836347036718
Energy: 1.3172173273592493
Energy: 1.2788749669950426
Energy: 1.2927352404445458
Energy: 1.4223954190189183
Energy: 1.326330121213327
Energy: 1.2751530860749216
Energy: 1.3172173273547092
Energy: 1.2788749669944754
Energy: 1.292735240446816
Energy: 1.4223954190194859
Energy: 1.3239663072619778
Energy: 1.2940595328833673
Energy: 1.3049304843752776
Energy: 1.3585338131895948
Energy: 1.2687363684297681
Energy: 1.4315331966589826
Energy: 1.323966307264248
Energy: 1.2940595328856375
Energy: 1.3049304843764127
Energy: 1.358533813190162
Energy: 1.455720852839502
Energy: 1.4222394325915466
Energy: 1.3216777825778945
Energy: 1.3859630934317004
Energy: 1.295455598178719
Energy: 1.3316880586099047
Energy: 1.4557208528355292
Energy: 1.4222394325926817
Energy: 1.3216777825812995
Energy: 1.385963093432268
Energy: 1.3351629227202537
Energy: 1.443386680674743
Energy: 1.358381493049402
Energy: 1.4805389044331345
Energy: 1.3792606706695443
Energy: 1.4390291356353597
Energy: 1.3351629217490677
Energy: 1.4433866806792837
Energy: 1.358381493049402
Energy: 1.4805389044331345
Energy: 1.4561262220096416
Energy: 1.3323597636880928
Energy: 1.2958760069997388
Energy: 1.3854265114512614
Energy: 1.3211243050771155
Energy: 1.4156916359243772
Energy: 1.456126221901858
Energy: 1.3323597636875253
Energy: 1.2958760069997388
Energy: 1.3854265114467208
Energy: 1.323966307264248
Energy: 1.4298578449669301
Energy: 1.2729722475103284
Energy: 1.3576644627275911
Energy: 1.2930051516384664
Energy: 1.332659578077054
Energy: 1.3239663072625454
Energy: 1.4298578449657948
Energy: 1.2729722475069232
Energy: 1.3576644627361043
Energy: 1.3168809488852906
Energy: 1.3042338707988854
Energy: 1.326326411149617
Energy: 1.4224591924034828
Energy: 1.2940207064513893
Energy: 1.2778312813017827
Energy: 1.3168809488892634
Energy: 1.3042338708028585
Energy: 1.3263264111513198
Energy: 1.4224591924040506

minimum gb energy = 1.2485861144636559 eV
minimum distance =  2.21617119269269 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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Energy: 1.5066682183248337
Energy: 1.4617482393912244
Energy: 1.4501283487565384
Energy: 1.4516152416976755
Energy: 1.5566850978179851
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minimum gb energy = 1.3275151306993882 eV
minimum distance =  2.20794170419398 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 1.3328919296559278
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Energy: 1.3455950239941263
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Energy: 1.3332865659174524
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Energy: 1.3317318776604878
Energy: 1.5821792650118618
Energy: 1.3986959803490533
Energy: 1.3329055337587505
Energy: 1.3733478730239679
Energy: 1.432176296596032
Energy: 1.369003562913637
Energy: 1.5821792650109245
Energy: 1.3986959803487409
Energy: 1.332905533754689
Energy: 1.373347873022406
Energy: 1.4458488596692876
Energy: 1.3989807662465517
Energy: 1.550331964518623
Energy: 1.4282932181065988
Energy: 1.3977552236602455
Energy: 1.4413042983283617
Energy: 1.4458488596730366
Energy: 1.3989807662059648
Energy: 1.5503319645195603
Energy: 1.4282932181353136
Energy: 1.4239713164253052
Energy: 1.3687360038720084
Energy: 1.4225160601540163
Energy: 1.3764996179593583
Energy: 1.442474632091916
Energy: 1.4085180484163768
Energy: 1.4239713164246803
Energy: 1.3687360038735708
Energy: 1.4225160601521416
Energy: 1.3764996179577962
Energy: 1.340998345201642
Energy: 1.3715576575629174
Energy: 1.421013552146455
Energy: 1.3321852404146355
Energy: 1.5061674429193341
Energy: 1.3348313637760676
Energy: 1.3409983452038288
Energy: 1.3715576575622925
Energy: 1.4210135521486424
Energy: 1.3321852404177599
Energy: 1.3343004757043395
Energy: 1.3909857793339089
Energy: 1.3738548253382372
Energy: 1.386727557943981
Energy: 1.3457067995014902
Energy: 1.3349660050982806
Energy: 1.3343004756999657
Energy: 1.3909857793348464
Energy: 1.373854825334488
Energy: 1.3867275579480425
Energy: 1.4492111467769395
Energy: 1.3924616953079203
Energy: 1.3749996865636724
Energy: 1.4129711525275581
Energy: 1.3949677767258168
Energy: 1.567780717137437
Energy: 1.4492111467806887
Energy: 1.3924616953060456
Energy: 1.3749996865680465
Energy: 1.4129711525284954

minimum gb energy = 1.3220580449735988 eV
minimum distance =  2.22882156133789 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.382047339949905
Energy: 1.6163044368270063
Energy: 1.3415036270950336
Energy: 1.4213033862044184
Energy: 1.3341330814924075
Energy: 1.616054828251913
Energy: 1.3820473399509776
Energy: 1.6163044368259338
Energy: 1.3415036270939613
Energy: 1.4130677296323935
Energy: 1.337806825294321
Energy: 1.3407258898152972
Energy: 1.3516060008283521
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Energy: 1.274130612248464
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Energy: 1.2774879003393542
Energy: 1.465217898050658
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Energy: 1.2740298310910128
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Energy: 1.276328824825047
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Energy: 1.3197551467116568
Energy: 1.3620193325982757
Energy: 1.323973796973736
Energy: 1.3367464866701386
Energy: 1.3401193444878543
Energy: 1.3578518979412773
Energy: 1.615006350817113
Energy: 1.3620193325993484
Energy: 1.3239737969887277
Energy: 1.3367464866701386
Energy: 1.3401193444674753
Energy: 1.377350890679347
Energy: 1.3038320652645017
Energy: 1.3591392939941804
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Energy: 1.2739462458479132
Energy: 1.3773508906772016
Energy: 1.3038320652870257
Energy: 1.3591392939931077
Energy: 1.464829692289725
Energy: 1.2726607536593408
Energy: 1.411884529013685
Energy: 1.3549593150543195
Energy: 1.3131733049547167
Energy: 1.2547274588331803
Energy: 1.2733415992923178
Energy: 1.2726607536571959
Energy: 1.411884529013685
Energy: 1.3549593150553922
Energy: 1.3131733049547167
Energy: 1.273973006347928
Energy: 1.3687833013727921
Energy: 1.4652389006794797
Energy: 1.2774950304355859
Energy: 1.4049998615636736
Energy: 1.3525537743409433
Energy: 1.2739730063500734
Energy: 1.3687833013738648
Energy: 1.4652389006773348
Energy: 1.2774950304345134
Energy: 1.3861364718144462
Energy: 1.3529373514548413
Energy: 1.341612652398928
Energy: 1.3379893056520142
Energy: 1.2744378219315626
Energy: 1.254649928454866
Energy: 1.3861364718155187
Energy: 1.3529373514537688
Energy: 1.3416126524053633
Energy: 1.3379893056509415
Energy: 1.413067732206522
Energy: 1.3341330814945527
Energy: 1.616054828248695
Energy: 1.3820473399456148
Energy: 1.616304436828079
Energy: 1.3415036270950336
Energy: 1.413067731567536
Energy: 1.3341330814913348
Energy: 1.616054828251913
Energy: 1.3820473399488327

minimum gb energy = 1.254649928454866 eV
minimum distance =  2.21527519642502 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 1.3920643326338331
Energy: 1.2570617684220549
Energy: 1.1743546292627887
Energy: 1.301099705678172
Energy: 1.1765272694640294
Energy: 1.2576690460469682
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Energy: 1.25706176843121
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Energy: 1.3129438452060578
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Energy: 1.1748644614319843
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Energy: 1.1838981474667556
Energy: 1.3155898340308119
Energy: 1.1749706888231142
Energy: 1.2742502182256772
Energy: 1.1489067130753154
Energy: 1.158027837835786
Energy: 1.1838981474634263
Energy: 1.31558983402665
Energy: 1.1749706888268219
Energy: 1.2742502182231803
Energy: 1.2330534013703676
Energy: 1.242038980763865
Energy: 1.3228468434329343
Energy: 1.1467291794825154
Energy: 1.1472982159294833
Energy: 1.3087849493301764
Energy: 1.233053401372032
Energy: 1.2420389807592873
Energy: 1.3228468434337668
Energy: 1.1467291794783536
Energy: 1.2585151917517525
Energy: 1.229395270407933
Energy: 1.2727282386321463
Energy: 1.1494185415463696
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Energy: 1.1757911670965027
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Energy: 1.2727282386300656
Energy: 1.1494185415405433
Energy: 1.247058391281816
Energy: 1.2334754205008975
Energy: 1.3434235730184452
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Energy: 1.3779818677199596
Energy: 1.1763478029649042
Energy: 1.247058391276822
Energy: 1.2334754208669203
Energy: 1.3434235730159483
Energy: 1.1754649939903912
Energy: 1.1501626325638359
Energy: 1.2298005185988543
Energy: 1.265391489299444
Energy: 1.1748994477927266
Energy: 1.2724715683620278
Energy: 1.150297484436299
Energy: 1.1501626325671652
Energy: 1.2298005186013512
Energy: 1.2653914893006926
Energy: 1.1748994477964723
Energy: 1.3263296843414702
Energy: 1.242323591545002
Energy: 1.253467214099813
Energy: 1.3240451397799367
Energy: 1.148165204904608
Energy: 1.1480763813142199
Energy: 1.3263296843431347
Energy: 1.2423235915412567
Energy: 1.2534672141006455
Energy: 1.324045139783266
Energy: 1.1748809959425486
Energy: 1.3324690966850432
Energy: 1.229632140099559
Energy: 1.1487757829710514
Energy: 1.1498045753265533
Energy: 1.2955035711594758
Energy: 1.1748809959442132
Energy: 1.3324690966854593
Energy: 1.229632140099559
Energy: 1.1487757829760452
Energy: 1.1750812421977446
Energy: 1.3719469620126388
Energy: 1.232305761217747
Energy: 1.2481968612838947
Energy: 1.1741914562004212
Energy: 1.3766662275749644
Energy: 1.1750812421948316
Energy: 1.3719469620130549
Energy: 1.2323057612934483
Energy: 1.2481968612818142
Energy: 1.1499555772134271
Energy: 1.275733344485137
Energy: 1.2292523749972533
Energy: 1.2652522082969888
Energy: 1.1762849461003724
Energy: 1.2744607867395858
Energy: 1.1499555772146755
Energy: 1.275733344488466
Energy: 1.2292523749993338
Energy: 1.2652522082928275
Energy: 1.1482973302089425
Energy: 1.3305189909948976
Energy: 1.2502704671522085
Energy: 1.2331004867453832
Energy: 1.3280947627787794
Energy: 1.1465986120707237
Energy: 1.1482973302072779
Energy: 1.3305189909944812
Energy: 1.2502704671472147
Energy: 1.2331004867453832
Energy: 1.301146035844332
Energy: 1.1746749181351188
Energy: 1.3283125444441957
Energy: 1.2006788041868526
Energy: 1.1459147622779662
Energy: 1.1500351947749843
Energy: 1.301146035843916
Energy: 1.1746749181392806
Energy: 1.3283125444471084
Energy: 1.2006788041922627
Energy: 1.3285325973280224
Energy: 1.1751016668078424
Energy: 1.3691478320988848
Energy: 1.2344826090296774
Energy: 1.2474276904555288
Energy: 1.2737249820957428
Energy: 1.3285325973230284
Energy: 1.1751016668074263
Energy: 1.3691478321001331
Energy: 1.234482610024654
Energy: 1.3066378690499032
Energy: 1.1487875341835647
Energy: 1.342213056438008
Energy: 1.2285525448218535
Energy: 1.2649499348883504
Energy: 1.181206061516102
Energy: 1.3066378690503195
Energy: 1.1487875341843967
Energy: 1.3422130564342625
Energy: 1.2285525448156491

minimum gb energy = 1.1457415939378734 eV
minimum distance =  2.25808690293792 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 1.538833701354094
Energy: 1.2474828534135587
Energy: 1.4549989792833493
Energy: 1.4613872882755659
Energy: 1.4550573473995978
Energy: 1.1311771470690264
Energy: 1.5388337013575522
Energy: 1.2474828534145468
Energy: 1.4549989792813733
Energy: 1.5620923634564652
Energy: 1.4911570572984483
Energy: 1.2091878204014028
Energy: 1.1837476347664986
Energy: 1.2456300512484828
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Energy: 1.30056234758714
Energy: 1.4911570572964723
Energy: 1.2091877750469417
Energy: 1.1837476347585947
Energy: 1.2456300512460128
Energy: 1.4773835235745283
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Energy: 1.1979895159367109
Energy: 1.2641484715765332
Energy: 1.4773835235745283
Energy: 1.1944232932354302
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Energy: 1.4555775701886302
Energy: 1.4142817773721683
Energy: 1.1977368571990112
Energy: 1.2454092949669455
Energy: 1.18473919132694
Energy: 1.2714006224541308
Energy: 1.1310857980176565
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Energy: 1.2454092949748496
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Energy: 1.6015816437819816
Energy: 1.183942260908393
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Energy: 1.463685964070883
Energy: 1.130253616859558
Energy: 1.6015816437775356
Energy: 1.183942260910369
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Energy: 1.4376210533447658
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Energy: 1.3584801093499783
Energy: 1.234168423300514
Energy: 1.1954682326833892
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Energy: 1.1838924972897777
Energy: 1.1880138607232016
Energy: 1.1851560969347779
Energy: 1.4795659056457477
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Energy: 1.1838924972917535
Energy: 1.1880138609947621
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Energy: 1.2450642539097174
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Energy: 1.4947627115212345
Energy: 1.185296828156559
Energy: 1.2317167166305698
Energy: 1.1847258435334298
Energy: 1.2450642539077417
Energy: 1.1971008536384686
Energy: 1.4947627115222226
Energy: 1.4546819550752481
Energy: 1.5290086229528006
Energy: 1.1945279552303936
Energy: 1.2476050024330334
Energy: 1.2499481263076933
Energy: 1.1983288528262546
Energy: 1.4546819550752481
Energy: 1.5290086229483546
Energy: 1.1945279552279238
Energy: 1.2476050024409373
Energy: 1.2459370002418513
Energy: 1.1837443452069056
Energy: 1.3330822777343867
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Energy: 1.3313384755242361
Energy: 1.1945141327200737
Energy: 1.2459370002403694
Energy: 1.1837443452039418
Energy: 1.3330822777250007
Energy: 1.4368022632780635
Energy: 1.6184350760521276
Energy: 1.4557654116165726
Energy: 1.2460852008862209
Energy: 1.3857591701773704
Energy: 1.2012655485926447
Energy: 1.4549989792833493
Energy: 1.5262255454647558
Energy: 1.4557654116190426
Energy: 1.3494789833041523
Energy: 1.3857591701768763
Energy: 1.245630051243543
Energy: 1.1944234375249814
Energy: 1.331338475534116
Energy: 1.4375480240860574
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Energy: 1.1837476347640286
Energy: 1.245630051245025
Energy: 1.1944234375284393
Energy: 1.3313384755272
Energy: 1.4375480240973744
Energy: 1.4543032131560074
Energy: 1.1979895159406628
Energy: 1.2156626586722128
Energy: 1.4773835235740342
Energy: 1.1944055966052132
Energy: 1.5290086229473667
Energy: 1.4543032131594655
Energy: 1.1979895159367109
Energy: 1.2156626586781405
Energy: 1.4773835235646482
Energy: 1.1847431777419661
Energy: 1.1792295615402404
Energy: 1.1853881698220854
Energy: 1.415116437227798
Energy: 1.1975586125400315
Energy: 1.245491367421487
Energy: 1.184743177746367
Energy: 1.1792295615550603
Energy: 1.1853881696473023
Energy: 1.415116437227798
Energy: 1.4376210533393319
Energy: 1.457747926679064
Energy: 1.1848872089095064
Energy: 1.601581643782476
Energy: 1.183942260904441
Energy: 1.2458167381728835
Energy: 1.437621053335874
Energy: 1.4577479266810403
Energy: 1.1848872085697753
Energy: 1.6015816437814878
Energy: 1.1954682326833892
Energy: 1.2443648212698997
Energy: 1.4131007388727683
Energy: 1.2888393319255829
Energy: 1.3584801093549181
Energy: 1.328530812007862
Energy: 1.1954682326794372
Energy: 1.2443648212713816
Energy: 1.4131007388688166
Energy: 1.2148223310609052
Energy: 1.254534247529691
Energy: 1.2985681943187046
Energy: 1.1990223908807403
Energy: 1.195087041580216
Energy: 1.2949999743225151
Energy: 1.4553937557716916
Energy: 1.254534247534631
Energy: 1.2985681943231506
Energy: 1.1990223908841986
Energy: 1.195087041578734
Energy: 1.3263265893848875
Energy: 1.130260853047042
Energy: 1.4573641355447626
Energy: 1.4382387783924893
Energy: 1.2453012863911117
Energy: 1.183725684934803
Energy: 1.3263265893883456
Energy: 1.1302608531991012
Energy: 1.4573641355422926
Energy: 1.4382387784003932
Energy: 1.4918205886187674
Energy: 1.1306386668645987
Energy: 1.231716716632546
Energy: 1.184725843529478
Energy: 1.2450642539126813
Energy: 1.1971008536443963
Energy: 1.4918205886197553
Energy: 1.130638666860647
Energy: 1.2317167166241478
Energy: 1.18472584353096
Energy: 1.239839132879841
Energy: 1.2499481263160912
Energy: 1.198017704437745
Energy: 1.454681955078706
Energy: 1.5147377489827054
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Energy: 1.1980177044332991
Energy: 1.4546819550708021
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Energy: 1.3005623475851642
Energy: 1.1943282091646505
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Energy: 1.2456397103052539
Energy: 1.4914395120428894
Energy: 1.3005623475866461
Energy: 1.1943282091606986
Energy: 1.2455809383516803
Energy: 1.5388337013550821
Energy: 1.2474828534214626
Energy: 1.4549989792828553
Energy: 1.5665558125981272
Energy: 1.4550573474020676
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Energy: 1.5388337013585398
Energy: 1.2474828534214626
Energy: 1.4549989792803852
Energy: 1.472862070052495
Energy: 1.4911570572984483
Energy: 1.2091877793787962
Energy: 1.1837476347635347
Energy: 1.2456300512504586
Energy: 1.1944234375264633
Energy: 1.30056234758714
Energy: 1.4911570572954844
Energy: 1.209187769830259
Energy: 1.183747634756125
Energy: 1.2456300512460128
Energy: 1.4773835235760102
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Energy: 1.5147377489871512
Energy: 1.455577570190606
Energy: 1.1979895159381928
Energy: 1.2641484715765332
Energy: 1.4773835235710704
Energy: 1.1944232932388883
Energy: 1.5147377489836933
Energy: 1.455577570189124
Energy: 1.4142817773761198
Energy: 1.1977368571970355
Energy: 1.2454092949684274
Energy: 1.184739191326446
Energy: 1.2714006224561065
Energy: 1.1310857980191384
Energy: 1.414281777378096
Energy: 1.1977368571985174
Energy: 1.2454092949733677
Energy: 1.184739191333362
Energy: 1.6015816437829697
Energy: 1.183942260905923
Energy: 1.2458167381718952
Energy: 1.4376210533398261
Energy: 1.463685964071377
Energy: 1.130253616850217
Energy: 1.601581643779512
Energy: 1.183942260906417
Energy: 1.2458167381723895
Energy: 1.4376210533432838
Energy: 1.2876190268758918
Energy: 1.3584801093524483
Energy: 1.2783197296032507
Energy: 1.1954682326828951
Energy: 1.2222852021697432
Energy: 1.4165998676221694
Energy: 1.28761902687688
Energy: 1.3584801093499783
Energy: 1.2783197296002868
Energy: 1.1954682326809192
Energy: 1.1954734205423547
Energy: 1.327316093435893
Energy: 1.4547668059820769
Energy: 1.1979513087760736
Energy: 1.2942173030055695
Energy: 1.1990223908812345
Energy: 1.1954734205443305
Energy: 1.3273160934452786
Energy: 1.454766805980595
Energy: 1.2545342475237633
Energy: 1.4382387783969355
Energy: 1.2456225960810452
Energy: 1.1838924972882958
Energy: 1.1880138634922919
Energy: 1.1851560969347779
Energy: 1.4795659056462418
Energy: 1.4382387783998993
Energy: 1.2456225960820333
Energy: 1.1838924972887896
Energy: 1.1880138586424207
Energy: 1.1847258435289838
Energy: 1.2450642539092236
Energy: 1.1971008536419265
Energy: 1.4947627115197526
Energy: 1.1852968281555707
Energy: 1.231716716628594
Energy: 1.1847258435304657
Energy: 1.2450642539102115
Energy: 1.1971008536399506
Energy: 1.4947627115217286
Energy: 1.4546819550752481
Energy: 1.5290086229513187
Energy: 1.1945279552289116
Energy: 1.2476050024325394
Energy: 1.2499481263081873
Energy: 1.1983288528262546
Energy: 1.4546819550752481
Energy: 1.5290086229473667
Energy: 1.1945279552264416
Energy: 1.2476050024374794
Energy: 1.2459370002423453
Energy: 1.1837443452069056
Energy: 1.3330822777363625
Energy: 1.4368022632844852
Energy: 1.331338475526212
Energy: 1.194514132720568
Energy: 1.2459370002383934
Energy: 1.1837443452054237
Energy: 1.3330822777294467
Energy: 1.4368022632785573

minimum gb energy = 1.130253616850217 eV
minimum distance =  2.18111684437439 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 1.4962571571742027
Energy: 1.4756058781730275
Energy: 1.427641748680233
Energy: 1.4197983293963488
Energy: 1.4274190385273544
Energy: 1.488440494507799
Energy: 1.4962571571793555
Energy: 1.4756058781773664
Energy: 1.427641748680504
Energy: 1.5842065788164656
Energy: 1.5044192173506328
Energy: 1.4493565889171123
Energy: 1.2328972082446574
Energy: 1.3469797358844404
Energy: 1.271720653787308
Energy: 1.2590112315680027
Energy: 1.5044192173476494
Energy: 1.44935658892118
Energy: 1.2328972082424878
Energy: 1.3469797358776607
Energy: 1.3976505822878245
Energy: 1.2544986102666997
Energy: 1.4166419485057884
Energy: 1.5283014927200471
Energy: 1.2546943885902184
Energy: 1.2637736413461294
Energy: 1.3976505822889094
Energy: 1.2544986102713098
Energy: 1.4166419485038901
Energy: 1.5283014927154368
Energy: 1.3114087964045116
Energy: 1.2525228252632876
Energy: 1.3542419388189562
Energy: 1.4731767775698443
Energy: 1.46773332642502
Energy: 1.4658101028943016
Energy: 1.3114087964074947
Energy: 1.2525228252641012
Energy: 1.3542419388173292
Energy: 1.4731767775674038
Energy: 1.3542232238746479
Energy: 1.2391157326316156
Energy: 1.3271942537796908
Energy: 1.4656320349512226
Energy: 1.3739887129775
Energy: 1.4715545617462706
Energy: 1.3542232238735628
Energy: 1.2391157326370392
Energy: 1.3271942537799621
Energy: 1.4656320349514935
Energy: 1.5365375650025577
Energy: 1.2520079615798354
Energy: 1.2899390669490596
Energy: 1.2644829298686378
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Energy: 1.536537565001744
Energy: 1.2520079615817337
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Energy: 1.232812644985698
Energy: 1.415787096052931
Energy: 1.497915937549046
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Energy: 1.3468551073945436
Energy: 1.2328126449650876
Energy: 1.4157870964218688
Energy: 1.4979159375531141
Energy: 1.2824322972102307
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Energy: 1.470578194598133
Energy: 1.4639859425084585
Energy: 1.5067998955221185
Energy: 1.3557997575409102
Energy: 1.3470185064526272
Energy: 1.427548659538822
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Energy: 1.5067998955161523
Energy: 1.2715303296755016
Energy: 1.264148350807375
Energy: 1.511061707076291
Energy: 1.4350591942516047
Energy: 1.2330755399156603
Energy: 1.3611549428260004
Energy: 1.2715303296773999
Energy: 1.2641483508038494
Energy: 1.5110617070809012
Energy: 1.4350591942502486
Energy: 1.2542045724068391
Energy: 1.263898227061127
Energy: 1.4141183392318757
Energy: 1.2526728791537036
Energy: 1.4272342688469795
Energy: 1.526690743657434
Energy: 1.2542045724043984
Energy: 1.2638982270657373
Energy: 1.4141183392329606
Energy: 1.2526728791482797
Energy: 1.4878792219903658
Energy: 1.4205630832861664
Energy: 1.3868164295862062
Energy: 1.2397688764003607
Energy: 1.3541195352784172
Energy: 1.4727895608132524
Energy: 1.4878792219865693
Energy: 1.4205630832872511
Energy: 1.3868164295848504
Energy: 1.2397688764041577
Energy: 1.3748837032661207
Energy: 1.4690341106389448
Energy: 1.3540458452322324
Energy: 1.252498057314147
Energy: 1.3287982756921541
Energy: 1.4657125592845226
Energy: 1.374883703266934
Energy: 1.4690341106351483
Energy: 1.3540458452300628
Energy: 1.2524980573138762
Energy: 1.2550222347642188
Energy: 1.3457092574596574
Energy: 1.432113693500544
Energy: 1.2485913231230874
Energy: 1.2466212836999924
Energy: 1.263109392971938
Energy: 1.2550222347593372
Energy: 1.3457092574596574
Energy: 1.4321136935013576
Energy: 1.2485913231255281
Energy: 1.2556319583684428
Energy: 1.3590483883119342
Energy: 1.2324898438139575
Energy: 1.3810265915017055
Energy: 1.506061903196778
Energy: 1.2599598014814148
Energy: 1.2556319583735953
Energy: 1.3590483883094933
Energy: 1.2324898430089013
Energy: 1.3810265915071291
Energy: 1.3460108180176302
Energy: 1.3474581145780165
Energy: 1.4275756642113808
Energy: 1.4637823581861156
Energy: 1.431050781170741
Energy: 1.5058847164510099
Energy: 1.3460108180154609
Energy: 1.3474581145837112
Energy: 1.4275756642078554
Energy: 1.4637823581777087
Energy: 1.2317248542843071
Energy: 1.3212985854637573
Energy: 1.2716908235087718
Energy: 1.2639997122290947
Energy: 1.36831179303363
Energy: 1.4815447122462624
Energy: 1.2317248542878327
Energy: 1.3212985854664694
Energy: 1.2716908235063311
Energy: 1.2639997122274675
Energy: 1.270977135673205
Energy: 1.463931095059549
Energy: 1.2529300646323618
Energy: 1.265086838864259
Energy: 1.2758559412844717
Energy: 1.252672537493531
Energy: 1.27097713566534
Energy: 1.4639310950584643
Energy: 1.2529300646356158
Energy: 1.265086838862632
Energy: 1.3544442832738446
Energy: 1.4717347185496248
Energy: 1.4878168108956797
Energy: 1.4090175824105737
Energy: 1.3870393736776125
Energy: 1.2388876995280638
Energy: 1.3544442832768278
Energy: 1.4717347185498961
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Energy: 1.4687135633925201
Energy: 1.4886417432705759
Energy: 1.2419073524634026

minimum gb energy = 1.221746884778768 eV
minimum distance =  2.2361720398442 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

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Energy: 1.5294214698340904
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Energy: 1.2346371932963407
Energy: 1.1978754628388177
Energy: 1.222648955179432
Energy: 1.1976732873778098
Energy: 1.3168307660615282

minimum gb energy = 1.195291538271182 eV
minimum distance =  2.22406440466547 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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minimum gb energy = 1.3224249449749985 eV
minimum distance =  2.22410918161779 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.4038530511668894
Energy: 1.3739663440918677
Energy: 1.392388311835491
Energy: 1.524065922339795
Energy: 1.3318746095454645
Energy: 1.4375060618903748
Energy: 1.4038530511652676
Energy: 1.3739663440926786
Energy: 1.5365151802966854
Energy: 1.4614137152234945
Energy: 1.3923868166125462
Energy: 1.60295972955496
Energy: 1.393191703339239
Energy: 1.47190153875142
Energy: 1.5365151802857397
Energy: 1.461413715209748
Energy: 1.3923868166101507
Energy: 1.6029597295537439
Energy: 1.3316085201930674
Energy: 1.5244040802774699
Energy: 1.3922768800339254
Energy: 1.3739388501942145
Energy: 1.403651506505875
Energy: 1.4372574720842224
Energy: 1.3316085201938783
Energy: 1.5244040802758483
Energy: 1.3922768800343308
Energy: 1.3739388501929986
Energy: 1.4559605288047668
Energy: 1.4117321789933825
Energy: 1.4404077083151405
Energy: 1.3957920492237297
Energy: 1.3747546415587268
Energy: 1.3172420821057007
Energy: 1.5057610871450677
Energy: 1.411732178992977
Energy: 1.4404077083159514
Energy: 1.3957920492265674
Energy: 1.4162209469864646
Energy: 1.4144103760620925
Energy: 1.5265738283481385
Energy: 1.4359371729550505
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Energy: 1.4067723113959265
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Energy: 1.4144103760633089
Energy: 1.5265738283493548
Energy: 1.435937172931943
Energy: 1.356856249518997
Energy: 1.4955183332698736
Energy: 1.4319368928610796
Energy: 1.4060440238814107
Energy: 1.5958640904028212
Energy: 1.3303235477501976
Energy: 1.356856249519808
Energy: 1.4955183332698736
Energy: 1.431936892860269
Energy: 1.4060440238814107
Energy: 1.363928559913836
Energy: 1.3817255642393098
Energy: 1.3708885536796775
Energy: 1.5407096662015727
Energy: 1.4039426543962057
Energy: 1.4313673741562425
Energy: 1.3639285599122144
Energy: 1.3817255642393098
Energy: 1.3708885534624966
Energy: 1.540709666199546
Energy: 1.3976761725739424
Energy: 1.3845481256032757
Energy: 1.4418261099830831
Energy: 1.48213758805406
Energy: 1.4237360352568573
Energy: 1.4974744858832076
Energy: 1.3976761725743478
Energy: 1.3845481256032757
Energy: 1.4418261099842993
Energy: 1.4821375880524383
Energy: 1.4067665629528998
Energy: 1.4192483250815466
Energy: 1.419241083663342
Energy: 1.406664710628013
Energy: 1.361766756717184
Energy: 1.3612622884467154
Energy: 1.4067665629496566
Energy: 1.4192483250819519
Energy: 1.4192410836617204
Energy: 1.406664710628013
Energy: 1.4819798538560252
Energy: 1.441695747590273
Energy: 1.3845913821160387
Energy: 1.3976875347552185
Energy: 1.5006451278799935
Energy: 1.4243124042069837
Energy: 1.481979853492128
Energy: 1.4416957475886514
Energy: 1.3845913821127958
Energy: 1.3976875347560291
Energy: 1.5406790513172834
Energy: 1.3744989185943217
Energy: 1.3816519939812932
Energy: 1.3639813562039578
Energy: 1.4318144494243632
Energy: 1.4038555520375289
Energy: 1.5406790513160675
Energy: 1.3744989185594947
Energy: 1.3816519939849417
Energy: 1.3639813562035525
Energy: 1.406214728032474
Energy: 1.4311306599094105
Energy: 1.4955183332654143
Energy: 1.3561296903524493
Energy: 1.3303350572870396
Energy: 1.5958640903999837
Energy: 1.406214728031258
Energy: 1.4311306599094105
Energy: 1.4955183332654143
Energy: 1.3561296903516384
Energy: 1.4559631315541122
Energy: 1.5264385498548123
Energy: 1.4157338058163096
Energy: 1.416123706314447
Energy: 1.406202683005917
Energy: 1.3969924974306005
Energy: 1.4559631315533015
Energy: 1.5264385498576503
Energy: 1.4157338058187419
Energy: 1.4161237064153533

minimum gb energy = 1.3172420821024575 eV
minimum distance =  2.21349903035029 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.1392451119115823
Energy: 1.403812021825042
Energy: 1.16982396811515
Energy: 1.6007222161586436
Energy: 1.169834049766459
Energy: 1.348789119883831
Energy: 1.139245111910117
Energy: 1.4038120218265076
Energy: 1.1698239681166154
Energy: 1.482103556237381
Energy: 1.2459793574448288
Energy: 1.771199244048532
Energy: 1.1698935120314784
Energy: 1.4236292377712887
Energy: 1.5872913229252716
Energy: 1.1708908714051072
Energy: 1.2459793574433633
Energy: 1.8226548985385034
Energy: 1.1698935120292804
Energy: 1.2815732559693165
Energy: 1.2141360345934995
Energy: 1.1362278896090183
Energy: 1.5284755508391947
Energy: 1.1360581096079734
Energy: 1.2916193137284129
Energy: 1.1726005270686002
Energy: 1.2141360345971628
Energy: 1.1362278896082856
Energy: 1.5284755508399273
Energy: 1.1360581096087061
Energy: 1.5286249489684542
Energy: 1.1362092727899467
Energy: 1.2141346818169914
Energy: 1.172612177782735
Energy: 1.2916667528263097
Energy: 1.1361126633972203
Energy: 1.5286249489684542
Energy: 1.1362092727892137
Energy: 1.2141346818169914
Energy: 1.172612177782002
Energy: 1.1698744826681302
Energy: 1.7986492632823334
Energy: 1.2460577735016156
Energy: 1.1709057577433775
Energy: 1.5873965126019896
Energy: 1.5652313807972829
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Energy: 1.688431982477856
Energy: 1.246057773497952
Energy: 1.1709057577404465
Energy: 1.1698340497679245
Energy: 1.32569996181261
Energy: 1.1392451119108495
Energy: 1.4038120218228438
Energy: 1.16982396811515
Energy: 1.6048371534128496
Energy: 1.1698340497679245
Energy: 1.2142525620484577
Energy: 1.139245111909384
Energy: 1.4038120218191805
Energy: 1.587291322924539
Energy: 1.1708908714051072
Energy: 1.2459793574477596
Energy: 1.6255684806552249
Energy: 1.1698935120314784
Energy: 1.2815732559641875
Energy: 1.5872913229260042
Energy: 1.1708908714029092
Energy: 1.2459793574418978
Energy: 1.7348859732457036
Energy: 1.2916193137276801
Energy: 1.1726005270678677
Energy: 1.2141360345927665
Energy: 1.1362278896090183
Energy: 1.5284755508391947
Energy: 1.1360581096094389
Energy: 1.2916193137262146
Energy: 1.1726005270686002
Energy: 1.214136034594232
Energy: 1.1362278896090183
Energy: 1.2916667528248442
Energy: 1.1361126633972203
Energy: 1.5286249489684542
Energy: 1.1362092727899467
Energy: 1.2141346818118621
Energy: 1.172612177782002
Energy: 1.2916667528248442
Energy: 1.1361126633935568
Energy: 1.5286249489691872
Energy: 1.1362092727884812
Energy: 1.5873965126027225
Energy: 1.5805241972726924
Energy: 1.1698744826673977
Energy: 1.798649263283799
Energy: 1.2460577734994176
Energy: 1.17090575774411
Energy: 1.5873965126019896
Energy: 1.5652313807965499
Energy: 1.1698744826666647
Energy: 1.7489064020786358
Energy: 1.1698239681166154
Energy: 1.5354571091551217
Energy: 1.1698340497693898
Energy: 1.214252562047725
Energy: 1.1392451119115823
Energy: 1.4038120218316363
Energy: 1.16982396811515
Energy: 1.4566715470600826
Energy: 1.1698340497671915
Energy: 1.2142525620565177
Energy: 1.1698935120307459
Energy: 1.2815732559744453
Energy: 1.587291322924539
Energy: 1.1708908714043746
Energy: 1.245979357447027
Energy: 1.6255684806566904
Energy: 1.1698935120300131
Energy: 1.2815732559766435
Energy: 1.5872913229252716
Energy: 1.17089087140584
Energy: 1.5284755508391947
Energy: 1.1360581096079734
Energy: 1.2916193137269474
Energy: 1.1726005270678677
Energy: 1.2141360345913013
Energy: 1.1362278896090183
Energy: 1.5284755508384618
Energy: 1.1360581096094389
Energy: 1.2916193137276801
Energy: 1.1726005270686002
Energy: 1.2141346818169914
Energy: 1.1726121777812695
Energy: 1.2916667528241115
Energy: 1.1361126633942897
Energy: 1.5286249489684542
Energy: 1.1362092727899467
Energy: 1.2141346818147931
Energy: 1.172612177782002
Energy: 1.2916667528241115
Energy: 1.136112663400884
Energy: 1.2460577735001501
Energy: 1.1709057577397137
Energy: 1.5873965126027225
Energy: 1.5652313807980154
Energy: 1.1698744826666647
Energy: 1.8226548985363054
Energy: 1.2460577735008829
Energy: 1.170905757741179
Energy: 1.5873965126019896
Energy: 1.5652313807980154
Energy: 1.139245111909384
Energy: 1.403812021820646
Energy: 1.1698239681158829
Energy: 1.457910867664357
Energy: 1.1698340497693898
Energy: 1.214252562050656
Energy: 1.1392451119108495
Energy: 1.4038120218294383
Energy: 1.16982396811515
Energy: 1.457910867664357
Energy: 1.2459793574477596
Energy: 1.496608516336737
Energy: 1.1698935120285476
Energy: 1.2815732559759108
Energy: 1.587291322924539
Energy: 1.1708908714065727
Energy: 1.245979357444096
Energy: 1.49660851633747
Energy: 1.1698935120300131
Energy: 1.2815732559737127
Energy: 1.2141360345927665
Energy: 1.1362278896082856
Energy: 1.5284755508384618
Energy: 1.1360581096072406
Energy: 1.2916193137276801
Energy: 1.1726005270678677
Energy: 1.2141360345956975
Energy: 1.1362278896090183
Energy: 1.5284755508391947
Energy: 1.1360581096094389
Energy: 1.5286249489684542
Energy: 1.1362092727884812
Energy: 1.2141346818140606
Energy: 1.172612177782002
Energy: 1.2916667528248442
Energy: 1.1361126633972203
Energy: 1.5286249489684542
Energy: 1.1362092727899467
Energy: 1.2141346818155259
Energy: 1.172612177782002
Energy: 1.1698744826644667
Energy: 1.8226548985363054
Energy: 1.2460577735016156
Energy: 1.170905757741179
Energy: 1.587396512603455
Energy: 1.5652313807965499
Energy: 1.1698744826681302
Energy: 1.822654898537038
Energy: 1.2460577734994176
Energy: 1.170905757741179
Energy: 1.1698340497671915
Energy: 1.2142525620469922
Energy: 1.139245111909384
Energy: 1.4038120218221113
Energy: 1.1698239681158829
Energy: 1.4579108676658226
Energy: 1.1698340497693898
Energy: 1.214252562047725
Energy: 1.1392451119115823
Energy: 1.403812021827973
Energy: 1.5872913229267371
Energy: 1.1708908714095034
Energy: 1.2459793574396998
Energy: 1.4966085163382026
Energy: 1.1698935120307459
Energy: 1.2815732559788415
Energy: 1.587291322924539
Energy: 1.1708908714051072
Energy: 1.2459793574418978
Energy: 1.49660851633747

minimum gb energy = 1.1360581096072406 eV
minimum distance =  2.27001192510482 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.5812667674958745
Energy: 1.3504777534543153
Energy: 1.4000849494345213
Energy: 1.7433773409384399
Energy: 1.3997198458700306
Energy: 1.3814677661345776
Energy: 1.5812667674928853
Energy: 1.3504777534085108
Energy: 1.4000849494351855
Energy: 1.373851624574518
Energy: 1.4167290685235283
Energy: 1.4493225641271994
Energy: 1.3991064434341587
Energy: 1.3780490943532042
Energy: 1.3921215418865218
Energy: 1.3426640837325683
Energy: 1.4167290685208713
Energy: 1.4493225641278635
Energy: 1.3991064434338265
Energy: 1.3780490943478902
Energy: 1.446245312115405
Energy: 1.3880783055100838
Energy: 1.4722314402303576
Energy: 1.389067836861458
Energy: 1.4454606225944457
Energy: 1.4223331260879213
Energy: 1.446245312115073
Energy: 1.3880783055070947
Energy: 1.47223144022604
Energy: 1.3890678368604614
Energy: 1.4852333252877667
Energy: 1.3541827164891402
Energy: 1.391772714369762
Energy: 1.3453137433780398
Energy: 1.420733831736774
Energy: 1.343104180018402
Energy: 1.4852333252844452
Energy: 1.3541827164911329
Energy: 1.3917727143717549
Energy: 1.3453137433780398
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Energy: 1.4697186460932894
Energy: 1.3405916353194671
Energy: 1.410779420500266
Energy: 1.332463775896124
Energy: 1.3460931356971109
Energy: 1.400305724520558
Energy: 1.437626974731365
Energy: 1.340591635318803
Energy: 1.4107794204996016
Energy: 1.4008759635982238
Energy: 1.4568301300120496
Energy: 1.4142993913512307
Energy: 1.3738904522566662
Energy: 1.3520389821110235
Energy: 1.4884584202265014
Energy: 1.4008759635978916
Energy: 1.456830130013046
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Energy: 1.3738904522550055
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Energy: 1.2990925002183302
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Energy: 1.4030075249846798
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Energy: 1.3502327209566412
Energy: 1.5335371777880609
Energy: 1.4041614864317575
Energy: 1.3633990606156197
Energy: 1.3328976820983884
Energy: 1.4007289544505142
Energy: 1.3502327209496663
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Energy: 1.3633990606222621
Energy: 1.3606339225257396
Energy: 1.4673244961589809
Energy: 1.478958886995156
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Energy: 1.360633922523747
Energy: 1.4673244961579843
Energy: 1.4789588869941594
Energy: 1.388725174309944
Energy: 1.3643846514417326
Energy: 1.4089774998873594
Energy: 1.3533674601349193
Energy: 1.5030969228834112
Energy: 1.3938474913152965
Energy: 1.3798624777723032
Energy: 1.3643846514437254
Energy: 1.4089774998883557
Energy: 1.353367460139237
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Energy: 1.3464254890715686
Energy: 1.4059070874993842
Energy: 1.3028923459804533
Energy: 1.487495331428612
Energy: 1.335313748701074
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Energy: 1.3464254890712364
Energy: 1.4059070874990522
Energy: 1.3028923459837745
Energy: 1.4874953314236299
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Energy: 1.4542972539561843
Energy: 1.4879088886955727
Energy: 1.344747392483373
Energy: 1.3925991237141024
Energy: 1.3341360495210035
Energy: 1.3854770227200113
Energy: 1.4542972539551877
Energy: 1.4879088887390826
Energy: 1.344747392484037
Energy: 1.4255622363179805
Energy: 1.368083661727876
Energy: 1.5240677466608554
Energy: 1.4547367250809993
Energy: 1.3752733085435562
Energy: 1.327500069291489
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Energy: 1.3680836617269099
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Energy: 1.3392690722707659
Energy: 1.4838740044715157
Energy: 1.3567295271321849
Energy: 1.4130935701433835
Energy: 1.3843483926376603
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Energy: 1.3392690722720946
Energy: 1.483874004469221
Energy: 1.3567295271295277
Energy: 1.4130935701457084
Energy: 1.3871079565612456
Energy: 1.5348653169056774
Energy: 1.4592245269608413
Energy: 1.4114414173598246
Energy: 1.4110652594442155
Energy: 1.3251958405311977
Energy: 1.3871079565632385
Energy: 1.534865316907338
Energy: 1.4592245269190225
Energy: 1.4114414173611531
Energy: 1.3302291126508332
Energy: 1.3955312658728247
Energy: 1.479367757694985
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Energy: 1.3684917226456905
Energy: 1.3941699931696365
Energy: 1.3302291126528258
Energy: 1.3955312658721604
Energy: 1.47936775769731
Energy: 1.4821469422703322
Energy: 1.4544415783451494
Energy: 1.3648302278996183
Energy: 1.3703701254752014
Energy: 1.3650572287117921
Energy: 1.5108166941540706
Energy: 1.392463001028607
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Energy: 1.365057228684557
Energy: 1.3823961094881296
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Energy: 1.4074784992812237
Energy: 1.3823961094911188
Energy: 1.384279155061384
Energy: 1.4334513004105442
Energy: 1.3067484396238738
Energy: 1.317536967371784
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Energy: 1.4115815823536033
Energy: 1.4897532917392429
Energy: 1.358174650767121
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Energy: 1.4115815823469604
Energy: 1.4897532917412357
Energy: 1.3458967413687624
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Energy: 1.3777389156577855
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Energy: 1.5102091689581925
Energy: 1.3914529455776057
Energy: 1.3298633784942502
Energy: 1.4014208938684525
Energy: 1.35025606509495
Energy: 1.4789922318484727
Energy: 1.3024901468262224
Energy: 1.3914529455809268
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Energy: 1.4014208938701131
Energy: 1.3502560650936215
Energy: 1.4233125705897216
Energy: 1.3937417803782701
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Energy: 1.4037965003562647
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Energy: 1.555403979670229
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Energy: 1.3613476569763805
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Energy: 1.4178545681083525
Energy: 1.402141249659145
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Energy: 1.3846234266403628
Energy: 1.4178545681066919
Energy: 1.39255427650521
Energy: 1.4142272520278902
Energy: 1.3333616382084585
Energy: 1.3541426256172857
Energy: 1.5337683265674065
Energy: 1.4464709995057552
Energy: 1.3925542765058743
Energy: 1.4142272520229084
Energy: 1.333361638209123
Energy: 1.3541426256089824
Energy: 1.392579255913947
Energy: 1.4025799834256718
Energy: 1.3256431084549634
Energy: 1.3867110597834778
Energy: 1.3176313927102676
Energy: 1.4725929645552829
Energy: 1.3925792559132826
Energy: 1.4025799834273325
Energy: 1.3256431084556277
Energy: 1.386711059781153
Energy: 1.4525235560968002
Energy: 1.3505729884904207
Energy: 1.3831985948592012
Energy: 1.3703423641338277
Energy: 1.4592769296969688
Energy: 1.3538508766042607
Energy: 1.452523556093811
Energy: 1.350572988491055
Energy: 1.3831985948601975
Energy: 1.3703423641368169
Energy: 1.408523704946688
Energy: 1.344025303149204
Energy: 1.4012360187322135
Energy: 1.379267277242998
Energy: 1.474471219110945
Energy: 1.3535826375245479
Energy: 1.4085237049483488
Energy: 1.3440253031515288
Energy: 1.401236018731217
Energy: 1.3792672772413372
Energy: 1.3146253401488392
Energy: 1.4343638992572767
Energy: 1.3346304661309412
Energy: 1.3473434116637344
Energy: 1.3961376370828835
Energy: 1.4807262013606222
Energy: 1.3146253401495036
Energy: 1.4343638992596015
Energy: 1.3346304661279516
Energy: 1.34734341166307
Energy: 1.4851226636635924
Energy: 1.3729123513223909
Energy: 1.3960539439514952
Energy: 1.5750528888878035
Energy: 1.3976614827303755
Energy: 1.4461239108657162
Energy: 1.485122663665253
Energy: 1.372912351322723
Energy: 1.3960539439498345
Energy: 1.575052888884482
Energy: 1.299316686857178
Energy: 1.485977841865405
Energy: 1.390812234901219
Energy: 1.3831314899610387
Energy: 1.48442154844673
Energy: 1.3985511416922123
Energy: 1.2993166868558494
Energy: 1.4859778418667333
Energy: 1.3908122349022154
Energy: 1.3831314899617029
Energy: 1.350309684047275
Energy: 1.394118160012498
Energy: 1.3703100036337772
Energy: 1.3848520196527676
Energy: 1.3703140264056304
Energy: 1.4958875892020531
Energy: 1.3503096840608924
Energy: 1.3941181600115016
Energy: 1.7155563122083093
Energy: 1.3848520196544285
Energy: 1.4847861447283726
Energy: 1.3940666273543474
Energy: 1.3748118245905705
Energy: 1.321948051356099
Energy: 1.4105327523452267
Energy: 1.3840893467056479
Energy: 1.4847861446636366
Energy: 1.394066627352687
Energy: 1.374811824586585
Energy: 1.3219480513574278
Energy: 1.305193855516096
Energy: 1.4482073739697705
Energy: 1.3847025921253613
Energy: 1.3952594675889642
Energy: 1.3764218675463846
Energy: 1.4209544597701622
Energy: 1.3051938555134386
Energy: 1.4482073739674455
Energy: 1.384702592125029
Energy: 1.3952594675916212
Energy: 1.3089964776997076
Energy: 1.4586647122659517
Energy: 1.3745576078302335
Energy: 1.3934522898406871
Energy: 1.3464580574092837
Energy: 1.3781928561940886
Energy: 1.3089964777000394
Energy: 1.458664712263627
Energy: 1.3745576078338873
Energy: 1.3934522898410193
Energy: 1.449993055165858
Energy: 1.313099660088764
Energy: 1.402241887065524
Energy: 1.3125019260546607
Energy: 1.3889105648236477
Energy: 1.394021839494833
Energy: 1.5519804547606961
Energy: 1.313099660088764
Energy: 1.4022418870638633
Energy: 1.3125019260529998
Energy: 1.4466980565751284
Energy: 1.476170103439936
Energy: 1.3709114082256457
Energy: 1.3370275065608135
Energy: 1.4046210525512282
Energy: 1.3942002424517301
Energy: 1.4466980565601824
Energy: 1.476170103437943
Energy: 1.3709114082269742
Energy: 1.3370275065614778
Energy: 1.365253092256739
Energy: 1.3989012007327644
Energy: 1.472921767162308
Energy: 1.4013277300468316
Energy: 1.3944788025825712
Energy: 1.484155342826343
Energy: 1.3652530922554105
Energy: 1.3989012007394068
Energy: 1.4729217671633046
Energy: 1.401327730047496
Energy: 1.4673463473921171
Energy: 1.404610049317518
Energy: 1.4546146060344527
Energy: 1.5635953818185708
Energy: 1.3973795601703543
Energy: 1.3738328089474485
Energy: 1.4673463473921171
Energy: 1.4046100493185145
Energy: 1.4546146060364455
Energy: 1.5635953818169102
Energy: 1.3720333237166888
Energy: 1.4756853606699292
Energy: 1.3686097998737023
Energy: 1.3478167618747932
Energy: 1.3375668264897072
Energy: 1.4082000863681052
Energy: 1.372033323719014
Energy: 1.4756853606702613
Energy: 1.368609799875695
Energy: 1.3478167618757897
Energy: 1.389261576443366
Energy: 1.3529345072367813
Energy: 1.4974299876494799
Energy: 1.3925097599217737
Energy: 1.400769176089042
Energy: 1.3396163776116463
Energy: 1.3892615764470195
Energy: 1.3529345072288101
Energy: 1.4974299876491477
Energy: 1.3925097599211096
Energy: 1.3964170656011645
Energy: 1.3022834361498088
Energy: 1.5077852803148901
Energy: 1.3642898532545407
Energy: 1.3925274679172523
Energy: 1.34497131429838
Energy: 1.3964170656018289
Energy: 1.3022834361511375
Energy: 1.507785280322831
Energy: 1.3642898532548728
Energy: 1.3631930700569337
Energy: 1.5398422552958404
Energy: 1.3003814674699226
Energy: 1.3263596013230137
Energy: 1.327074531245567
Energy: 1.3913864135532128
Energy: 1.3631930700519517
Energy: 1.539842255297501
Energy: 1.3003814674659369
Energy: 1.3263596013243422
Energy: 1.3885382236787833
Energy: 1.5180574216169886
Energy: 1.353735188809946
Energy: 1.3892668597346802
Energy: 1.3341597884460294
Energy: 1.4245246616817362
Energy: 1.3885382236797799
Energy: 1.5180574216166565
Energy: 1.353735188931447
Energy: 1.3892668597356768
Energy: 1.4212022065077106
Energy: 1.3721228263830192
Energy: 1.4726197575856081
Energy: 1.4446145579247949
Energy: 1.377889951021801
Energy: 1.3341802871836372
Energy: 1.42120220650605
Energy: 1.3721228263836835
Energy: 1.47261975758594
Energy: 1.4446145579204772
Energy: 1.3600039447833712
Energy: 1.4253842933060101
Energy: 1.4111837895001014
Energy: 1.4552108561287378
Energy: 1.390874425893663
Energy: 1.3841977956114595
Energy: 1.360003945291961
Energy: 1.425384293305678
Energy: 1.4111837894997694
Energy: 1.4552108561310628
Energy: 1.384334444674886
Energy: 1.3775955459002494
Energy: 1.407951967191311
Energy: 1.3543059637700123
Energy: 1.4823844573249254
Energy: 1.3272320243113356
Energy: 1.3843344446755503
Energy: 1.3775955458999172
Energy: 1.407951967191311
Energy: 1.354305963769016
Energy: 1.3430497439594262
Energy: 1.3703581534891558
Energy: 1.4648160056073163
Energy: 1.5642909955087225
Energy: 1.3785711356158725
Energy: 1.4677281998622869
Energy: 1.3430497439587619
Energy: 1.3703581534928095
Energy: 1.4648160056106376
Energy: 1.5642909955090547
Energy: 1.3128397746244878
Energy: 1.3442845196396114
Energy: 1.3482972824189163
Energy: 1.5275653641169062
Energy: 1.429880695377413
Energy: 1.3956000812109928
Energy: 1.312839774627809
Energy: 1.3442845196406077
Energy: 1.3482972824202446
Energy: 1.5275653641145814
Energy: 1.3929477790599514
Energy: 1.3656979978760884
Energy: 1.4795126525620292
Energy: 1.3053566598944535
Energy: 1.3979022194412996
Energy: 1.3118456617555228
Energy: 1.3929477790622462
Energy: 1.3656979978750918
Energy: 1.4795126525603686
Energy: 1.3053566598961142

minimum gb energy = 1.2990925002156732 eV
minimum distance =  2.25091203062582 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.488824718998623
Energy: 1.5683410261011714
Energy: 1.390892585664638
Energy: 1.8206526857979202
Energy: 1.4108192631234842
Energy: 1.3780795539919726
Energy: 1.488824718994993
Energy: 1.5683410261035915
Energy: 1.3908925856718983
Energy: 1.65140138811711
Energy: 1.4042319138994754
Energy: 1.5345035232130035
Energy: 1.3798772177037866
Energy: 1.3751268944505775
Energy: 1.4635888210176038
Energy: 1.4080608851370426
Energy: 1.4042319139031056
Energy: 1.5345035232142132
Energy: 1.3798772177049963
Energy: 1.3751268944457373
Energy: 1.3428159074294477
Energy: 1.426127485295709
Energy: 1.5389756090832412
Energy: 1.3590462873361544
Energy: 1.4905146533505071
Energy: 1.4433024176668194
Energy: 1.3428159074330777
Energy: 1.4261274852992842
Energy: 1.5389756090312101
Energy: 1.3590462873409945
Energy: 1.61691007008089
Energy: 1.4144255581535787
Energy: 1.390514327614184
Energy: 1.3519755070678763
Energy: 1.377466988008686
Energy: 1.4371392777403031
Energy: 1.61691007008452
Energy: 1.4144255581584186
Energy: 1.3905143276166039
Energy: 1.3519755070702966
Energy: 1.355432697978405
Energy: 1.4897026860014926
Energy: 1.3754894817537384
Energy: 1.6415797592762587
Energy: 1.3468583752120535
Energy: 1.3686563278864654
Energy: 1.3554326979771953
Energy: 1.427580372628972
Energy: 1.3754894817488983
Energy: 1.6415797592762587
Energy: 1.3453200809668573
Energy: 1.5045970892738472
Energy: 1.3630293276256131
Energy: 1.3485080888922059
Energy: 1.3385108608767429
Energy: 1.517542707625036
Energy: 1.345320080959597
Energy: 1.5045970889702958
Energy: 1.363029327623193
Energy: 1.3485080888922059
Energy: 1.5311037162819907
Energy: 1.3553161597489876
Energy: 1.4455624397222846
Energy: 1.3485776485406475
Energy: 1.3697661084621584
Energy: 1.4262878877138034
Energy: 1.5311037162795709
Energy: 1.3553161597501977
Energy: 1.445562439729545
Energy: 1.3485776485394374
Energy: 1.363459146869874
Energy: 1.4452210760321085
Energy: 1.3794820825008771
Energy: 1.3471436343243224
Energy: 1.5317309951473022
Energy: 1.4138167435567588
Energy: 1.3634591468650339
Energy: 1.4452210760321085
Energy: 1.3794820825020873
Energy: 1.3471436343243224
Energy: 1.4191774037437774
Energy: 1.3918229267733773
Energy: 1.6017206693170523
Energy: 1.3748709395306054
Energy: 1.3914699436912017
Energy: 1.5953413195809603
Energy: 1.4191774037425673
Energy: 1.3918229267733773
Energy: 1.6017206693182626
Energy: 1.3748709395318153
Energy: 1.4010538530711514
Energy: 1.4027756113932683
Energy: 1.3649606009549617
Energy: 1.3540733494740744
Energy: 1.3742978792575373
Energy: 1.6109612745974673
Energy: 1.4010538503473813
Energy: 1.4027756114210992
Energy: 1.3649606009549617
Energy: 1.3540733494752843
Energy: 1.578695786411058
Energy: 1.4168743539353297
Energy: 1.375291207694397
Energy: 1.3755469644020648
Energy: 1.4405625014998862
Energy: 1.362270094217469
Energy: 1.5786957864098483
Energy: 1.4168743539316992
Energy: 1.375291207690822
Energy: 1.3755469644008549
Energy: 1.3231290253681256
Energy: 1.4358966540370188
Energy: 1.5675825047119212
Energy: 1.3267801022646535
Energy: 1.5569349662180494
Energy: 1.4460828645011423
Energy: 1.3231290253705457
Energy: 1.4358966540382287
Energy: 1.5675825047107113
Energy: 1.3267801022646535
Energy: 1.3212745279834508
Energy: 1.4157256122174668
Energy: 1.4881236422969115
Energy: 1.3758627110777821
Energy: 1.375919223909188
Energy: 1.43531391365626
Energy: 1.3212745279798208
Energy: 1.415725612218677
Energy: 1.4881236422896513
Energy: 1.3758627110741521
Energy: 1.5135317900136855
Energy: 1.4875752317817428
Energy: 1.3769521314536168
Energy: 1.561284545836038
Energy: 1.3641341155491424
Energy: 1.453568019246437
Energy: 1.5135317900100558
Energy: 1.487575231707986
Energy: 1.3769521314487767
Energy: 1.5612845458420883

minimum gb energy = 1.3212745279798208 eV
minimum distance =  2.22314143321816 Angstroms
sigma value = 33