Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Ni__MO_110256178378_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5196183800697343
cohesive_energy=4.450347496491574
mass=58.6934
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: 2.38418579101562e-07 eV

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

Energy: 0.020727811388324358
Energy: 0.49520472496149487
Energy: 0.49520472496301987
Energy: 0.02072781138679944
Energy: 0.49520472496301987
Energy: 0.49520472496301987
Energy: 0.02072781138679944
Energy: 0.49520472496149487
Energy: 0.49520472496301987
Energy: 0.02072781138679944
Energy: 0.49311318639807156
Energy: 0.025027163239258344
Energy: 0.4929337323033451
Energy: 0.49311318639807156
Energy: 0.02502716323773342
Energy: 0.4929337323063948
Energy: 0.49311318639807156
Energy: 0.025027163239258344
Energy: 0.4929337323063948
Energy: 0.49311318639807156
Energy: 1.5940783624857613
Energy: 0.022063615015485937
Energy: 0.2808569151188124
Energy: 1.5940783624811865
Energy: 0.022063615013961018
Energy: 0.022063615013961018
Energy: 0.926300564577398
Energy: 0.022063615015485937
Energy: 0.022063615013961018
Energy: 0.8171505800553998
Energy: 0.49311318639807156
Energy: 0.4929337323094447
Energy: 0.025027163239258344
Energy: 0.49311318639807156
Energy: 0.4929337323079198
Energy: 0.02502716323773342
Energy: 0.49311318639807156
Energy: 0.4929337323063948
Energy: 0.025027163239258344
Energy: 0.49311318639807156
Energy: 0.020727811391374196
Energy: 0.49520472496301987
Energy: 0.49520472496454476
Energy: 0.020727811391374196
Energy: 0.49520472496606976
Energy: 0.49520472496454476
Energy: 0.020727811391374196
Energy: 0.49520472496301987
Energy: 0.49520472496606976
Energy: 0.020727811391374196
Energy: 0.49311318639807156
Energy: 0.025027163239258344
Energy: 0.4929337323079198
Energy: 0.49311318639807156
Energy: 0.025027163239258344
Energy: 0.4929337323079198
Energy: 0.49311318639959645
Energy: 0.025027163239258344
Energy: 0.4929337323094447
Energy: 0.49311318639807156
Energy: 0.7749347527266404
Energy: 0.022063615013961018
Energy: 0.7530350801757439
Energy: 1.5406313077332403
Energy: 0.022063615013961018
Energy: 0.5405900259192343
Energy: 0.9404611234781023
Energy: 0.022063615013961018
Energy: 0.28085691512033734
Energy: 0.9404611054371672

minimum gb energy = 0.02072781138679944 eV
minimum distance =  2.27760304644806 Angstroms
sigma value = 3


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

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Energy: 1.3293876015381099
Energy: 1.3299312443987612
Energy: 1.2319783197737677
Energy: 1.3293876015343749
Energy: 1.329931244395026
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Energy: 1.2319783197737677
Energy: 1.1355460028394733
Energy: 1.175947877652748
Energy: 1.3162225482617924
Energy: 1.135546002846944
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Energy: 1.1355460028394733
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Energy: 1.3162225482617924
Energy: 1.1355460028432087
Energy: 1.062711054702735
Energy: 1.2895270039283557
Energy: 1.3205297323075724
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Energy: 1.2895270047945318
Energy: 1.3205297326211998
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Energy: 1.3303985113451018
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Energy: 1.0056408836257702
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Energy: 1.1783150829472184
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Energy: 1.32997995674631
Energy: 1.0053606694378676
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Energy: 1.248298593204554
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Energy: 1.1760684097133558
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Energy: 1.2769464103441832
Energy: 1.0500560433100552
Energy: 1.0391656154564202
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Energy: 1.1680109208343266
Energy: 1.2763120546931472
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Energy: 1.3291502663238313
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Energy: 1.3291502663163608
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Energy: 1.2109987113603462
Energy: 1.013078538782749
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Energy: 1.0130785383646022
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Energy: 1.2109987113603462
Energy: 1.0130785383832788
Energy: 1.3719051879146003
Energy: 0.9554016748733011
Energy: 1.2156814558579438
Energy: 1.3112596490700956
Energy: 0.9554016748769686
Energy: 1.2156814558504736
Energy: 1.3112596490663602
Energy: 0.9554016748733011
Energy: 1.2156814558579438
Energy: 1.3112596490700956
Energy: 0.9554016748769686
Energy: 1.3297693956546235
Energy: 1.0057591266555275
Energy: 1.3595306438196184
Energy: 1.3297693956471528
Energy: 1.0057591266592627
Energy: 1.3595306438233536
Energy: 1.3297693956546235
Energy: 1.0057591266517922
Energy: 1.3595306438196184
Energy: 1.3297693956471528
Energy: 1.101692728010016
Energy: 1.467888869251654
Energy: 1.1448509768818111
Energy: 1.1016927280062807
Energy: 1.467888869251654
Energy: 1.1448505882647881
Energy: 1.101692728010016
Energy: 1.4678888692479186
Energy: 1.1448506133883043
Energy: 1.101692728010016
Energy: 1.0427380320015431
Energy: 1.3145721408766782
Energy: 1.175584125569766
Energy: 1.042738032012749
Energy: 1.3145721408729427
Energy: 1.1755841255660313
Energy: 1.0427380320015431
Energy: 1.3145721408766782
Energy: 1.175584125569766
Energy: 1.0427380320090138
Energy: 1.1584260635038013
Energy: 1.3293876015306394
Energy: 1.329931244395026
Energy: 1.1584260635075365
Energy: 1.3293876015269044
Energy: 1.329931244395026
Energy: 1.1584260635038013
Energy: 1.3293876015306394
Energy: 1.329931244395026
Energy: 1.1584260635075365
Energy: 1.135546002846944
Energy: 1.1759478776490127
Energy: 1.3162225482691952
Energy: 1.135546002846944
Energy: 1.1759478776452776
Energy: 1.3162225482691952
Energy: 1.135546002846944
Energy: 1.1759478776490127
Energy: 1.3162225482691952
Energy: 1.135546002850679
Energy: 1.0557850170999836
Energy: 1.2895270045481395
Energy: 1.320529732826572
Energy: 1.0557863594279124
Energy: 1.2895270048729726
Energy: 1.3205297311389752
Energy: 1.0557863872508089
Energy: 1.289527004932669
Energy: 1.3205297316392983
Energy: 1.055784660517412
Energy: 1.3303985113451018
Energy: 1.3837340015280932
Energy: 1.0056408836257702
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Energy: 1.3837340015280932
Energy: 1.0056408836295054
Energy: 1.3303985113451018
Energy: 1.3837340015280932
Energy: 1.0056408836295054
Energy: 1.3303985113413668

minimum gb energy = 0.9554016748733011 eV
minimum distance =  2.29535440028472 Angstroms
sigma value = 75


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

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Energy: 1.0648540017177828
Energy: 1.064770239410619
Energy: 1.2737973260211242
Energy: 1.0648540017232508
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minimum gb energy = 1.0618201627654436 eV
minimum distance =  2.18585446029899 Angstroms
sigma value = 105


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

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Energy: 1.255668471682765
Energy: 1.2581213550886763
Energy: 1.2295255957613624
Energy: 1.2953469216423588
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Energy: 1.2295054321218413
Energy: 1.3039984603164125
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Energy: 1.2295255957551938
Energy: 1.337945314463359
Energy: 1.191032532563819
Energy: 1.2916981505908098
Energy: 1.3669074064569486
Energy: 1.1707304609994809
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Energy: 1.3669074064569486
Energy: 1.1707304609974247
Energy: 1.1915251913777538
Energy: 1.222766790365757
Energy: 1.3422588122748125
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Energy: 1.3422588122686439
Energy: 1.1687283913562132
Energy: 1.2614938788689856
Energy: 1.1780104494492396
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Energy: 1.2614938788751169
Energy: 1.2997414305531767
Energy: 1.2702728989735654
Energy: 1.3456026855987113
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Energy: 1.3852183444811486
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Energy: 1.1858077795411746
Energy: 1.3107486439468894
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Energy: 1.292089477321524
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Energy: 1.292089477321524
Energy: 1.310748643940721
Energy: 1.2416930926776477
Energy: 1.245158317062073
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Energy: 1.2836999207521154
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Energy: 1.3105580920094748
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Energy: 1.2540634848863723
Energy: 1.2533683584078998
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Energy: 1.2538638699011504
Energy: 1.253351528921351
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Energy: 1.2540634848863723
Energy: 1.2455457632761795
Energy: 1.3030496471716226
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Energy: 1.2455457632741231
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Energy: 1.2219323800652278
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Energy: 1.234932036559738
Energy: 1.283449796459955
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Energy: 1.2349320365638505
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Energy: 1.2653250056479977
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Energy: 1.283449796459955
Energy: 1.2653250056479977
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Energy: 1.2963477568305153
Energy: 1.3467805968281912
Energy: 1.2249553856756248
Energy: 1.2963477568264028
Energy: 1.3467805968220223
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Energy: 1.3467805968240785
Energy: 1.351915077277307
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Energy: 1.241425171081236
Energy: 1.3200910093495495
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Energy: 1.3200910093454372
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Energy: 1.2290734909923884
Energy: 1.2839524828731061
Energy: 1.2726636252207217
Energy: 1.2290734909882761
Energy: 1.2839524828648814
Energy: 1.2726636252207217
Energy: 1.2290734909965009
Energy: 1.2839524828628253
Energy: 1.2726636252268904
Energy: 1.2346934504953178
Energy: 1.2548365856411652
Energy: 1.2737823020151138
Energy: 1.23469345049943
Energy: 1.2548365856452774
Energy: 1.2737823020151138
Energy: 1.234693450497374
Energy: 1.2548365856432213
Energy: 1.2737823020212824
Energy: 1.23469345049943
Energy: 1.2564960900538407
Energy: 1.2535067353487597
Energy: 1.29161153873505
Energy: 1.2564960900579532
Energy: 1.253504232545159
Energy: 1.2916115387371059
Energy: 1.2564960900620659
Energy: 1.2535067353467035
Energy: 1.2916115387288811
Energy: 1.256496090055897
Energy: 1.3227169003217851
Energy: 1.254023964587064
Energy: 1.2351901476293632
Energy: 1.3227169003197288
Energy: 1.2540235007498122
Energy: 1.235190147623232
Energy: 1.3227169003217851
Energy: 1.2540239645891205
Energy: 1.2351901476273444
Energy: 1.3227169003217851
Energy: 1.2055757366378168
Energy: 1.2934551651504969
Energy: 1.1904057082285258
Energy: 1.2055757366337045
Energy: 1.2934551651504969
Energy: 1.1904057082264696
Energy: 1.2055757366357605
Energy: 1.2934551651525532
Energy: 1.1904057082244135
Energy: 1.2055757366316482
Energy: 1.241094843727528
Energy: 1.3247411386999572
Energy: 1.2412187562177015
Energy: 1.2410948437316403
Energy: 1.324592370665839
Energy: 1.2412187562177015
Energy: 1.241094843727528
Energy: 1.3247411386979013
Energy: 1.2412187562177015
Energy: 1.2410948437234155
Energy: 1.3484651464707096
Energy: 1.254260576399965
Energy: 1.2860036202782963
Energy: 1.348465146466597
Energy: 1.254439103789183
Energy: 1.2860036202803526
Energy: 1.348465146466597
Energy: 1.2542605763979089
Energy: 1.2860036202782963
Energy: 1.3484651464686532
Energy: 1.2377210193862112
Energy: 1.2283552662015875
Energy: 1.326282691591388
Energy: 1.2377210193903236
Energy: 1.2283553179578313
Energy: 1.3262826915831634
Energy: 1.23772101939238
Energy: 1.2283552661974753
Energy: 1.3262826915831634
Energy: 1.23772101939238

minimum gb energy = 1.1687283913562132 eV
minimum distance =  2.25570077345044 Angstroms
sigma value = 165


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

Energy: 1.1482317390305317
Energy: 1.2801967695567997
Energy: 1.2801781662309197
Energy: 1.148231739034767
Energy: 1.2801967695560936
Energy: 1.2801781662344491
Energy: 1.1482317390312373
Energy: 1.2801967695567997
Energy: 1.2801781662302139
Energy: 1.148231739034767
Energy: 1.2426790688288427
Energy: 1.1651211891291642
Energy: 1.2861567949265198
Energy: 1.2426790688274307
Energy: 1.1651211891291642
Energy: 1.2861567949293433
Energy: 1.2426790688309604
Energy: 1.1651211891291642
Energy: 1.286156794925814
Energy: 1.2426790688274307
Energy: 1.2254452858278972
Energy: 1.3025175599246208
Energy: 1.1200473231851347
Energy: 1.225445285830015
Energy: 1.3025175882673525
Energy: 1.1200472895786968
Energy: 1.2254452858271916
Energy: 1.302517566984009
Energy: 1.1200473379304938
Energy: 1.2254452858278972
Energy: 1.3194473589557139
Energy: 1.2435265186003182
Energy: 1.1630226172583638
Energy: 1.319447358962067
Energy: 1.2435265185996125
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Energy: 1.3194473589571258
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Energy: 1.1630226172583638
Energy: 1.319447358960655
Energy: 1.2175554437458984
Energy: 1.2707028430663607
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Energy: 1.2707028430663607
Energy: 1.2228963924669012
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Energy: 1.2707028430635372
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Energy: 1.2175554437430747
Energy: 1.1645763961841347
Energy: 1.393214320109637
Energy: 1.3208205313373902
Energy: 1.1645763961848408
Energy: 1.3932143201082254
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Energy: 1.3208205313380963
Energy: 1.1645763961848408
Energy: 1.242986269198222
Energy: 1.2871691449896685
Energy: 1.2794616557511371
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Energy: 1.1638710829190817
Energy: 1.1640461415546308
Energy: 1.3277242030200394
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Energy: 1.164046141552513
Energy: 1.327724203020745
Energy: 1.1638710829204937
Energy: 1.1640461415567485
Energy: 1.3277242030200394
Energy: 1.242927956742317
Energy: 1.2793838167095675
Energy: 1.2872149718354613
Energy: 1.2429279567458464
Energy: 1.2793838167102733
Energy: 1.2872149718333437
Energy: 1.242927956743023
Energy: 1.2793838167095675
Energy: 1.2872149718347554
Energy: 1.2429279567472584
Energy: 1.1645810645736232
Energy: 1.3208210155796116
Energy: 1.3934756246994922
Energy: 1.1645810645693881
Energy: 1.3208210155824354
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Energy: 1.1645810645729175
Energy: 1.3208210155796116
Energy: 1.3934756247001978
Energy: 1.164581064570094
Energy: 1.2169481593943419
Energy: 1.223715960180087
Energy: 1.2706603151879068
Energy: 1.216948159395048
Energy: 1.2237159601765575
Energy: 1.2706603151872011
Energy: 1.2169481593971654
Energy: 1.2237159601807928
Energy: 1.2706603151829656
Energy: 1.2169481593978717
Energy: 1.3193701451692574
Energy: 1.162785660199243
Energy: 1.2435728589532267
Energy: 1.319370145166434
Energy: 1.1627856602013606
Energy: 1.243572858951815
Energy: 1.319370145167846
Energy: 1.1627856601999491
Energy: 1.2435728589525208
Energy: 1.319370145167846
Energy: 1.2255427689903564
Energy: 1.1203593270356746
Energy: 1.3026937415828754
Energy: 1.2255427689938863
Energy: 1.1203593270900292
Energy: 1.3026937410889377
Energy: 1.225542768994592
Energy: 1.1203593270504988
Energy: 1.3026937411454098
Energy: 1.2255427689903564
Energy: 1.2423180881053233
Energy: 1.2862585377016096
Energy: 1.1652063923163674
Energy: 1.2423180881046172
Energy: 1.2862585376980802
Energy: 1.165206392317073
Energy: 1.2423180881053233
Energy: 1.2862585377016096
Energy: 1.1652063923149554
Energy: 1.2423180881053233
Energy: 1.14823173902912
Energy: 1.2801967695575056
Energy: 1.2801781662288023
Energy: 1.1482317390326493
Energy: 1.2801967695567997
Energy: 1.2801781662302139
Energy: 1.1482317390298258
Energy: 1.2801967695575056
Energy: 1.2801781662302139
Energy: 1.1482317390326493

minimum gb energy = 1.1200472895786968 eV
minimum distance =  2.28860689231421 Angstroms
sigma value = 41


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

Energy: 1.3257293498414169
Energy: 1.1656252579353927
Energy: 1.16592959938451
Energy: 1.244299743028689
Energy: 1.1656252579353927
Energy: 1.165929599381771
Energy: 1.3257293498414169
Energy: 1.1656252579353927
Energy: 1.165929599368077
Energy: 1.244299743028689
Energy: 1.170828323978414
Energy: 1.0340920434298935
Energy: 1.1813208038843592
Energy: 1.1708283239756754
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Energy: 1.1813208038870981
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Energy: 1.0340920434271546
Energy: 1.1813208038898368
Energy: 1.1708283239701975
Energy: 1.112711041042662
Energy: 1.022429193617694
Energy: 1.0737859037548634
Energy: 1.1097942318938305
Energy: 1.0224291936231718
Energy: 1.0736730135790722
Energy: 1.0796402523328625
Energy: 1.022429193617694
Energy: 1.073785903757602
Energy: 1.0755671523446577
Energy: 1.0507431129426625
Energy: 1.0508509073111238
Energy: 1.0762021779238453
Energy: 1.0507431129344462
Energy: 1.0508509073056462
Energy: 1.0761658425073133
Energy: 1.0507431129454017
Energy: 1.0508509073083852
Energy: 1.0762021779211066
Energy: 1.0507431129563567
Energy: 1.0799282613004162
Energy: 1.1596159272043636
Energy: 1.0731371664336158
Energy: 1.079928261289461
Energy: 1.1596159271934083
Energy: 1.0731261753902817
Energy: 1.079928261289461
Energy: 1.1596159272098414
Energy: 1.0731371664473102
Energy: 1.0799282612949386
Energy: 1.0627661587627335
Energy: 1.1535976633172893
Energy: 1.1141467184923897
Energy: 1.062766158773689
Energy: 1.1535976633145506
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Energy: 1.0627661587682111
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Energy: 1.1141467184978673
Energy: 1.0627661587599948
Energy: 1.0755763313598223
Energy: 1.022052696749905
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Energy: 1.0755763313598223
Energy: 1.0220526967581214
Energy: 1.1736241521183772
Energy: 1.0755763313570836
Energy: 1.0220526967526438
Energy: 1.173624152126594
Energy: 1.0755763313570836
Energy: 1.1672960125677974
Energy: 1.0493812094136254
Energy: 1.0999398064888948
Energy: 1.167296012573275
Energy: 1.0492112184175941
Energy: 1.0999398064971113
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Energy: 1.0493812093999808
Energy: 1.0999398064943722
Energy: 1.167296012576014
Energy: 1.1156572821652693
Energy: 1.2013542939128403
Energy: 1.2806224164993627
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Energy: 1.2013542938909294
Energy: 1.2451556468338465
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Energy: 1.201354293814292
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Energy: 1.031688827729703
Energy: 1.1770652716885177
Energy: 1.0993334080987422
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Energy: 1.1992586997589865
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Energy: 1.1770652716748236
Energy: 1.0993334080987422
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Energy: 1.040400769740248
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Energy: 1.0803955559290253
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Energy: 1.1432038348932152
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Energy: 1.0307957809130783
Energy: 1.1840901787883906
Energy: 1.0664797479983625
Energy: 1.2358079390647136
Energy: 1.1840901787746965
Energy: 1.0664768154276707
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Energy: 1.058150356607978
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Energy: 1.1654920191419889
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Energy: 1.165492019136511
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Energy: 1.0399866579610648
Energy: 1.1826238051510836
Energy: 1.0578107943640862
Energy: 1.0399866579638037
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Energy: 1.039986657955637
Energy: 1.1826238051592999
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Energy: 1.039986657955637
Energy: 1.0260189250435705
Energy: 1.1180025593323093
Energy: 1.1795361351016873
Energy: 1.0260189250380929
Energy: 1.118002559337787
Energy: 1.1795361350989482
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Energy: 1.0802220030872067
Energy: 1.074883547306484
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Energy: 1.0987137979572459
Energy: 1.1693427678881403
Energy: 1.022178450043425
Energy: 1.098713797959935
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Energy: 1.0987137979572459
Energy: 1.0597384582314429
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Energy: 1.0198904880809994
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Energy: 1.1656430637482051
Energy: 1.1657847773349936
Energy: 1.0577618772598412
Energy: 1.1656430637564215
Energy: 1.1657847773349936
Energy: 1.0577575825538172
Energy: 1.165643063750944
Energy: 1.1657847773404715
Energy: 1.0577618772571025
Energy: 1.1453805556529544
Energy: 1.0714025482454297
Energy: 1.1159781990287485
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Energy: 1.1453805556255658
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Energy: 1.022678102381962
Energy: 1.0759154835015228
Energy: 1.0409124633016218
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Energy: 1.0759154834905675
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Energy: 1.075915483496045
Energy: 1.0522007968910447
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Energy: 1.0807500397942726
Energy: 1.0802772463866748
Energy: 1.0404186147256258
Energy: 1.080750039791534
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Energy: 1.0404186147283148
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Energy: 1.040418614736531
Energy: 1.0807500397942726
Energy: 1.1203288833876857
Energy: 1.136776849445537
Energy: 1.0387549593642944
Energy: 1.1203288833931133
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Energy: 1.1203288833876857
Energy: 1.1367768494510146
Energy: 1.0387549593779886
Energy: 1.1203288833849465
Energy: 1.3179786297785354
Energy: 1.148181792168331
Energy: 1.1147175580330781
Energy: 1.244914829623567
Energy: 1.1481817921601147
Energy: 1.1147175580330781
Energy: 1.3179786297867522
Energy: 1.1481817921655926
Energy: 1.1147175580248618
Energy: 1.244914829623567
Energy: 1.2015072507497562
Energy: 1.021616812366759
Energy: 1.1373664078242924
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Energy: 1.0666582510221445
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Energy: 1.1382257909911788
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Energy: 1.1087654073175042
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Energy: 1.0706587321267658
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Energy: 1.108765407320243
Energy: 1.128198114869927
Energy: 1.0706587321130718
Energy: 1.175757769219739
Energy: 1.0287584061520665
Energy: 1.122987238563701
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Energy: 1.02875840614385
Energy: 1.1229872385609623
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Energy: 1.0287584061630217
Energy: 1.122987238563701
Energy: 1.175757769219739
Energy: 1.1670705567445436
Energy: 1.1661434014470096
Energy: 1.2847732555112399
Energy: 1.167070556750021
Energy: 1.1661434014552263
Energy: 1.2443972422402245
Energy: 1.16707055675276
Energy: 1.1661434014607037
Energy: 1.2847732555112399
Energy: 1.16707055675276
Energy: 1.0404512854636123
Energy: 1.1744620100460825
Energy: 1.1176260388841939
Energy: 1.0404512854718289
Energy: 1.194040394667682
Energy: 1.0909828488674622
Energy: 1.0404512854636123
Energy: 1.1744620100460825
Energy: 1.1176260388787163
Energy: 1.0404512854581345
Energy: 1.0254786366610156
Energy: 1.0811860973674194
Energy: 1.0822036877044359
Energy: 1.0254786366692323
Energy: 1.0811825059558056
Energy: 1.0821412230529504
Energy: 1.02547863667471
Energy: 1.0811860973646805
Energy: 1.0822036877236079
Energy: 1.0254786366719713
Energy: 1.0408285575813887
Energy: 1.0739689027872708
Energy: 1.0513502485411272
Energy: 1.040828557575911
Energy: 1.0739728223627931
Energy: 1.0513502485411272
Energy: 1.0408285575731724
Energy: 1.073968902795487
Energy: 1.051350248543866
Energy: 1.0408285575731724
Energy: 1.1609520599472016
Energy: 1.0812129213745731
Energy: 1.1220990692575812
Energy: 1.1609520599526795
Energy: 1.0812263019379642
Energy: 1.1220990692712756
Energy: 1.160952059941724
Energy: 1.081212921380051
Energy: 1.1220990692685364
Energy: 1.1609520599389853
Energy: 1.0989465124822633
Energy: 1.167796477971072
Energy: 1.059835201868286
Energy: 1.0989465124795244
Energy: 1.167796477965594
Energy: 1.0598352018628083
Energy: 1.0989465124795244
Energy: 1.167796477968333
Energy: 1.059835201849114
Energy: 1.0989465124932185

minimum gb energy = 1.0198904880809994 eV
minimum distance =  2.23854957694627 Angstroms
sigma value = 185


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

Energy: 0.9614007285029245
Energy: 0.610111031369811
Energy: 0.6093067860035726
Energy: 0.4605075577034674
Energy: 0.6101110313730622
Energy: 0.6093067860035726
Energy: 0.9614007285068258
Energy: 0.6101110313646093
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Energy: 0.46050755770382207
Energy: 0.8726469859099744
Energy: 0.5970521386634775
Energy: 0.915673629594635
Energy: 0.7510226219686301
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Energy: 0.8450466285046904
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Energy: 0.915673629594635
Energy: 0.7510226219660292
Energy: 0.6275995286240235
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Energy: 0.6101110313682151
Energy: 0.6093067860016218
Energy: 0.46050755770216695
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Energy: 0.6101110313649639
Energy: 0.6093067860058189
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Energy: 0.6007815612722492
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Energy: 0.6089590115028055
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Energy: 0.758676205616742
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Energy: 0.609412678325418
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Energy: 0.9000279826938083
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Energy: 0.9000279826980053
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Energy: 0.7586762056196975
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Energy: 0.7586762056196975
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Energy: 0.8971611810946326
Energy: 0.6094126783309745
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Energy: 0.8238173613998677
Energy: 0.9444422228172772
Energy: 0.6094126783303243
Energy: 0.7770962512486576
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Energy: 0.9000279826912075
Energy: 0.5834637830374715
Energy: 0.632788346359021
Energy: 0.9000279826944585
Energy: 0.6903873743336375
Energy: 0.6327883463664692
Energy: 0.9000279826977097
Energy: 0.5834637830426732
Energy: 0.632788346371671
Energy: 0.9000279826964093
Energy: 0.6446817623338221
Energy: 0.8126951719004477
Energy: 0.6088668300143494
Energy: 0.6166395251192293
Energy: 0.8126158117974731
Energy: 0.6088668300163
Energy: 0.6446817623354181
Energy: 0.8126951719069498
Energy: 0.6088668300143494
Energy: 0.6166395251159783
Energy: 0.6277130130308894
Energy: 0.6303127902577415
Energy: 0.5973655507119429
Energy: 0.6333209856230348
Energy: 0.63500570150734
Energy: 0.597365550717795
Energy: 0.6277130130351454
Energy: 0.6303127902567366
Energy: 0.5973655507216964
Energy: 0.6333209856243353
Energy: 0.8300670093192687
Energy: 0.8933783509928701
Energy: 0.598432688723697
Energy: 0.7472707519964916
Energy: 0.8933783509932248
Energy: 0.5984326887288989
Energy: 0.8300670093205692
Energy: 0.8933783509948209
Energy: 0.5984326887279531
Energy: 0.7472707520039988

minimum gb energy = 0.46050755770216695 eV
minimum distance =  2.32129684865514 Angstroms
sigma value = 33


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

Energy: 1.0548146607623174
Energy: 1.0578890385072799
Energy: 1.0578803551595573
Energy: 1.0019264184898213
Energy: 1.057889038509065
Energy: 1.0578803551577725
Energy: 1.0548146607552105
Energy: 1.0578890385108497
Energy: 1.0578803551542029
Energy: 1.0019264184898213
Energy: 1.0264049194015648
Energy: 0.9828708929677352
Energy: 1.0174350556397125
Energy: 1.0264049193979954
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Energy: 1.0264049194015648
Energy: 1.0422525488615035
Energy: 0.9854420744642216
Energy: 1.0064348749593675
Energy: 1.0364128816680358
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Energy: 1.0064348749557979
Energy: 1.0442450303334272
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Energy: 1.028256507447342
Energy: 1.1470666394134401
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Energy: 1.0129436113893486
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Energy: 1.1470666394045161
Energy: 0.9817735826342372
Energy: 1.012943611371501
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Energy: 1.0149006037263686
Energy: 1.0395071269867964
Energy: 1.0138574227427024
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Energy: 1.0138574227498416
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Energy: 1.0402909643915228
Energy: 1.0549644356622143
Energy: 1.0637775029296686
Energy: 1.0402909643968772
Energy: 1.0549644356657837
Energy: 1.0465790801541275
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Energy: 0.9835491082875037
Energy: 1.0465790801541275
Energy: 1.0187145448983914
Energy: 0.9835491082821494
Energy: 1.046579080150558
Energy: 1.018714544905498
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Energy: 1.046579080150558
Energy: 1.0604338418812362
Energy: 1.1441654928381104
Energy: 0.9420396729573461
Energy: 1.060433841883021
Energy: 1.1441654928363258
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Energy: 1.0604338418901604
Energy: 1.1441654928363258
Energy: 0.942039672959131
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Energy: 0.9911306934421652
Energy: 1.0188861958055764
Energy: 0.9968547365951876
Energy: 0.9911306934493043

minimum gb energy = 0.9411659377967141 eV
minimum distance =  2.18900938979407 Angstroms
sigma value = 219


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

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Energy: 1.1722702103807545
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Energy: 1.171239534740372
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Energy: 1.3000341347710838
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Energy: 1.336711341778737
Energy: 1.264647921902642
Energy: 1.263714262413611
Energy: 1.3367113417775558
Energy: 1.264647921902642

minimum gb energy = 1.1684981515892499 eV
minimum distance =  2.25341856339258 Angstroms
sigma value = 15


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

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minimum gb energy = 1.3238459298764886 eV
minimum distance =  2.19722096145876 Angstroms
sigma value = 293


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

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Energy: 1.327269271597019
Energy: 1.3517286396540182
Energy: 1.3398561675712684
Energy: 1.327269271591683
Energy: 1.35172863965135
Energy: 1.3398561675766045
Energy: 1.327269271591683
Energy: 1.351728639646014
Energy: 1.4240367797058795
Energy: 1.4065194974276616
Energy: 1.3326522444667857
Energy: 1.4093380610772785
Energy: 1.4065194974249935
Energy: 1.3326522444721218
Energy: 1.4240367797005433
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Energy: 1.3326522444721218
Energy: 1.4093380610799466
Energy: 1.366777080913767
Energy: 1.3747176404731853
Energy: 1.3804464376882444
Energy: 1.3588902544995118
Energy: 1.3747176404758534
Energy: 1.3804464376909127
Energy: 1.366777080916435
Energy: 1.3747176404758534
Energy: 1.3804464376855765
Energy: 1.3588902544995118
Energy: 1.4124676855263918
Energy: 1.3324482691950585
Energy: 1.3954695892970412
Energy: 1.4124676855263918
Energy: 1.3324482692030626
Energy: 1.3954695892997095
Energy: 1.4124676855237235
Energy: 1.3324482691950585
Energy: 1.3954695893023774
Energy: 1.4124676855263918
Energy: 1.3483062759526072
Energy: 1.3296977999497577
Energy: 1.345112227580075
Energy: 1.3483062759526072
Energy: 1.3299070144433511
Energy: 1.345112227580075
Energy: 1.3483062759526072
Energy: 1.3296977999497577
Energy: 1.345112227574739
Energy: 1.3483062759499391
Energy: 1.4073252631923678
Energy: 1.3263946358290495
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Energy: 1.396275149611818
Energy: 1.3431598560081717
Energy: 1.3562879670020622
Energy: 1.3962751496144858
Energy: 1.3431598560108398
Energy: 1.3562879669913899
Energy: 1.396275149611818
Energy: 1.3431598560135076
Energy: 1.3562879669913899
Energy: 1.396275149611818
Energy: 1.3344497256206882
Energy: 1.4525000127151801
Energy: 1.4218336833935816
Energy: 1.3344497256206882
Energy: 1.452500012717848
Energy: 1.4218373717891404
Energy: 1.3344497256260242
Energy: 1.4525000127205163
Energy: 1.4218336834015857
Energy: 1.3344497256260242
Energy: 1.3321977328804788
Energy: 1.320584021866067
Energy: 1.4123818664659291
Energy: 1.3321977328724746
Energy: 1.3205840218687348
Energy: 1.4123818664685972
Energy: 1.3321977328804788
Energy: 1.320584021866067
Energy: 1.412381866463261
Energy: 1.3321977328778107
Energy: 1.4704009124291526
Energy: 1.3690316887060325
Energy: 1.36911043124847
Energy: 1.4704009124264845
Energy: 1.3690316887113685
Energy: 1.3691104312538063
Energy: 1.4704009124291526
Energy: 1.3690316887167047
Energy: 1.36911043124847
Energy: 1.4704009124291526
Energy: 1.3323776270343406
Energy: 1.4298993921960683
Energy: 1.3322185952168721
Energy: 1.3323776270396768
Energy: 1.4298993921934005
Energy: 1.3322185952142043
Energy: 1.332377627045013
Energy: 1.4298993921960683
Energy: 1.3322185952222083
Energy: 1.3323776270423449
Energy: 1.3335580463510737
Energy: 1.4103240022904526
Energy: 1.4522737616031287
Energy: 1.3335580463510737
Energy: 1.4103240022957404
Energy: 1.4522737616057968
Energy: 1.3335580463457377
Energy: 1.4103240022984083
Energy: 1.4522737616111328
Energy: 1.333558046353742
Energy: 1.3960311602017226
Energy: 1.3589957086968107
Energy: 1.3390134150929718
Energy: 1.396031160207059
Energy: 1.3589957086968107
Energy: 1.3390313065598765
Energy: 1.3960311602017226
Energy: 1.3589957086968107
Energy: 1.3390134150929718
Energy: 1.3960311602043909
Energy: 1.4116165173194648
Energy: 1.3865581488192926
Energy: 1.3266443361685487
Energy: 1.4116165173194648
Energy: 1.3865581488192926
Energy: 1.3266443361685487
Energy: 1.4116165173141284
Energy: 1.3865581488219607
Energy: 1.3266443361658806
Energy: 1.4116165173114605

minimum gb energy = 1.320584021866067 eV
minimum distance =  2.2023578198203 Angstroms
sigma value = 293


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

Energy: 1.3552308548560414
Energy: 1.3573108402965715
Energy: 1.357355919274962
Energy: 1.3552308548560414
Energy: 1.3573108402970537
Energy: 1.3573559192764086
Energy: 1.3552308548565237
Energy: 1.3573108402965715
Energy: 1.3573559192725508
Energy: 1.3552308548555592
Energy: 1.3539011798916372
Energy: 1.3556700612664574
Energy: 1.3564876896657048
Energy: 1.353901179889708
Energy: 1.3556700612650106
Energy: 1.3564876896652225
Energy: 1.3539011798940483
Energy: 1.3556700612650106
Energy: 1.3564876896661868
Energy: 1.3539011798901905
Energy: 1.3550349326446838
Energy: 1.3559311979760786
Energy: 1.3002344931654108
Energy: 1.3550349326427549
Energy: 1.355931197976561
Energy: 1.3002429172501895
Energy: 1.3550349326456481
Energy: 1.3559311979760786
Energy: 1.3002377778260696
Energy: 1.3550349326437192
Energy: 1.3006246704904951
Energy: 1.355874238733615
Energy: 1.3550346976606726
Energy: 1.300624669047381
Energy: 1.3558742387355438
Energy: 1.3550346976572971
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Energy: 1.3558742387340972
Energy: 1.355034697659708
Energy: 1.3006240375185578
Energy: 1.3565391996389304
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Energy: 1.3565391996384484
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Energy: 1.3565391996398948
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Energy: 1.3539236613603545
Energy: 1.3565391996398948
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Energy: 1.3552308548565237
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Energy: 1.355230854855077
Energy: 1.357310840297536
Energy: 1.3573559192788198
Energy: 1.3552308548565237
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Energy: 1.3556700612654928
Energy: 1.3564876896652225
Energy: 1.3539011798921192
Energy: 1.3556700612650106
Energy: 1.3564876896661868
Energy: 1.3539011798906728
Energy: 1.3556700612640462
Energy: 1.3564876896666693
Energy: 1.3539011798877796
Energy: 1.3556700612654928
Energy: 1.3559311979760786
Energy: 1.3002430852023574
Energy: 1.3550349326470947
Energy: 1.3559311979760786
Energy: 1.300242388429024
Energy: 1.3550349326427549
Energy: 1.355931197976561
Energy: 1.3002378933855059
Energy: 1.3550349326442015
Energy: 1.3559311979760786
Energy: 1.3558742387355438
Energy: 1.3550346976577792
Energy: 1.300624226155144
Energy: 1.355874238733615
Energy: 1.355034697661637
Energy: 1.3006247319199742
Energy: 1.3558742387355438
Energy: 1.3550346976577792
Energy: 1.300624431051764
Energy: 1.3558742387340972
Energy: 1.3555214418489885
Energy: 1.3539236613574608
Energy: 1.356539199642306
Energy: 1.3555214418485062
Energy: 1.3539236613618009
Energy: 1.3565391996398948
Energy: 1.355521441850435
Energy: 1.353923661359872
Energy: 1.3565391996365193
Energy: 1.3555214418489885
Energy: 1.35735591927448
Energy: 1.3552308548555592
Energy: 1.3573108402965715
Energy: 1.3573559192783375
Energy: 1.3552308548560414
Energy: 1.3573108402951248
Energy: 1.3573559192725508
Energy: 1.3552308548555592
Energy: 1.3573108402970537
Energy: 1.3573559192773732
Energy: 1.3564876896647404
Energy: 1.3539011798882619
Energy: 1.3556700612645283
Energy: 1.3564876896652225
Energy: 1.3539011798901905
Energy: 1.3556700612645283
Energy: 1.3564876896647404
Energy: 1.353901179888744
Energy: 1.3556700612645283
Energy: 1.3564876896666693
Energy: 1.3002377317056837
Energy: 1.3550349326442015
Energy: 1.355931197976561
Energy: 1.3002394414455232
Energy: 1.3550349326432372
Energy: 1.3559311979760786
Energy: 1.3002374651911237
Energy: 1.3550349326437192
Energy: 1.355931197976561
Energy: 1.3002385155440601
Energy: 1.355034697659226
Energy: 1.300624572034192
Energy: 1.3558742387355438
Energy: 1.3550346976587437
Energy: 1.3006240649968661
Energy: 1.3558742387340972
Energy: 1.355034697659226
Energy: 1.3006243924516254
Energy: 1.3558742387355438
Energy: 1.3550346976582615
Energy: 1.3539236613589076
Energy: 1.356539199637966
Energy: 1.355521441849953
Energy: 1.3539236613589076
Energy: 1.3565391996384484
Energy: 1.3555214418489885
Energy: 1.3539236613637298
Energy: 1.3565391996365193
Energy: 1.3555214418489885
Energy: 1.353923661355532
Energy: 1.3552308548560414
Energy: 1.357310840298018
Energy: 1.3573559192773732
Energy: 1.3552308548555592
Energy: 1.3573108402970537
Energy: 1.3573559192778555
Energy: 1.3552308548555592
Energy: 1.3573108403037608
Energy: 1.3573559192725508
Energy: 1.3552308548555592
Energy: 1.3539011798901905
Energy: 1.3556700612650106
Energy: 1.3564876896637759
Energy: 1.353901179886815
Energy: 1.3556700612650106
Energy: 1.3564876896652225
Energy: 1.3539011798882619
Energy: 1.3556700612645283
Energy: 1.3564876896661868
Energy: 1.3539011798877796
Energy: 1.3550349326446838
Energy: 1.3559311979760786
Energy: 1.3002385831793817
Energy: 1.3550349326470947
Energy: 1.355931197976561
Energy: 1.3002268707740132
Energy: 1.3550349326427549
Energy: 1.3559311979760786
Energy: 1.3002375813848568
Energy: 1.3550349326432372
Energy: 1.3006242800759047
Energy: 1.3558742387340972
Energy: 1.355034697659226
Energy: 1.30062462996958
Energy: 1.3558742387355438
Energy: 1.3550346976587437
Energy: 1.3006246001814734
Energy: 1.355874238733615
Energy: 1.3550346976606726
Energy: 1.3006237920205352
Energy: 1.3565391996403773
Energy: 1.3555214418485062
Energy: 1.353923661359872
Energy: 1.356539199637966
Energy: 1.355521441850435
Energy: 1.3539236613564964
Energy: 1.3565391996389304
Energy: 1.355521441848024
Energy: 1.3539236613589076
Energy: 1.356539199637966
Energy: 1.3573108402985006
Energy: 1.3573559192759264
Energy: 1.3552308548560414
Energy: 1.3573108403003853
Energy: 1.3573559192778555
Energy: 1.3552308548560414
Energy: 1.3573108402970537
Energy: 1.3573559192778555
Energy: 1.3552308548560414
Energy: 1.3573108402989826
Energy: 1.3556700612650106
Energy: 1.3564876896652225
Energy: 1.353901179888744
Energy: 1.3556700612659751
Energy: 1.3564876896657048
Energy: 1.3539011798882619
Energy: 1.3556700612645283
Energy: 1.3564876896671516
Energy: 1.3539011798906728
Energy: 1.3556700612659751

minimum gb energy = 1.3002268707740132 eV
minimum distance =  2.26757848915351 Angstroms
sigma value = 15


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

Energy: 1.3410096587761289
Energy: 1.4138345845050468
Energy: 1.4142022191466923
Energy: 1.3192921610476969
Energy: 1.4138345845028613
Energy: 1.4142022191401347
Energy: 1.3410096587805007
Energy: 1.4138345845028613
Energy: 1.4142022191401347
Energy: 1.3192921610476969
Energy: 1.4162872602506738
Energy: 1.3291047966691365
Energy: 1.3083961189735565
Energy: 1.4162872602419698
Energy: 1.3291047966691365
Energy: 1.3083961189757425
Energy: 1.4162872602463021
Energy: 1.3291047966735083
Energy: 1.3083961189779283
Energy: 1.4162872602419698
Energy: 1.3665506997762675
Energy: 1.3248669321801232
Energy: 1.4894600816915706
Energy: 1.3665506997718957
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Energy: 1.4894600816850132
Energy: 1.36655069976971
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Energy: 1.4894600816937567
Energy: 1.366550699774082
Energy: 1.3034240641989314
Energy: 1.3253549415767194
Energy: 1.300377975640344
Energy: 1.3034240641923738
Energy: 1.3253549415745336
Energy: 1.300377975633786
Energy: 1.3034240641989314
Energy: 1.3253549415832773
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Energy: 1.3034240641923738
Energy: 1.3063017007550959
Energy: 1.3286871700527363
Energy: 1.4216290809787007
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Energy: 1.3286871700527363
Energy: 1.4216290809830725
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Energy: 1.372872493936553
Energy: 1.4278865336545876
Energy: 1.2914454508899151
Energy: 1.3728724939452968
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Energy: 1.3301887955562612
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Energy: 1.3301887955584473
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Energy: 1.4093353485885047
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Energy: 1.4093353485906905
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Energy: 1.3203400547947235
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Energy: 1.3203400547925377
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Energy: 1.3203400547925377
Energy: 1.3180079659908017
Energy: 1.2948077678831997
Energy: 1.3286133262734914
Energy: 1.422269516478265
Energy: 1.4937007215906708
Energy: 1.3286137153619484
Energy: 1.4222695164913408
Energy: 1.4937007215972284
Energy: 1.3286133262669335
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Energy: 1.4937007215994142
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Energy: 1.3393808627157708
Energy: 1.28250569717434
Energy: 1.402128789064173
Energy: 1.3393808627201425
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Energy: 1.4021287890772884
Energy: 1.3393808627179569
Energy: 1.2825056971765263
Energy: 1.402128789068545
Energy: 1.339380862711399
Energy: 1.3965150460690643
Energy: 1.2850834370094644
Energy: 1.4916134722051413
Energy: 1.39651504607125
Energy: 1.2850816126975446
Energy: 1.4916134722029553
Energy: 1.396515046079994
Energy: 1.2850834370072788
Energy: 1.4916134722073273
Energy: 1.3965150460843658
Energy: 1.450775530222474
Energy: 1.297494723761455
Energy: 1.3412879798003046
Energy: 1.450775530222474
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Energy: 1.45077553022466
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Energy: 1.4507755302290317
Energy: 1.289674991795819
Energy: 1.2901873920134546
Energy: 1.2938031563546288
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Energy: 1.290187392011269
Energy: 1.293803156352443
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Energy: 1.2901873920134546
Energy: 1.2938031563546288
Energy: 1.2896749918067483
Energy: 1.3991649571198674
Energy: 1.3200134064831914
Energy: 1.3062586715615938
Energy: 1.3991649571329827
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Energy: 1.3062586715768951
Energy: 1.3991649571220535
Energy: 1.312576288523828
Energy: 1.3247070961371332
Energy: 1.4679165783660726
Energy: 1.3125762885325716
Energy: 1.3247070961218321
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Energy: 1.3125762885303858
Energy: 1.3247070961327616
Energy: 1.4679165783551433
Energy: 1.3125762885303858
Energy: 1.3289161427444685
Energy: 1.467923488674476
Energy: 1.3661447338991353
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Energy: 1.3303928457794025
Energy: 1.3040315785599292
Energy: 1.3308716485891283
Energy: 1.3303928457859604
Energy: 1.3040315785533714
Energy: 1.3308716485891283
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Energy: 1.3149212424282029
Energy: 1.3624570214304943
Energy: 1.3131820888370263
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Energy: 1.3671606967753223
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Energy: 1.3671606967731365
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Energy: 1.3760075963166367
Energy: 1.329643537860918
Energy: 1.4896070217738417
Energy: 1.3760075963231548
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Energy: 1.3760075963231548
Energy: 1.3877746685918548
Energy: 1.3624906122444083
Energy: 1.2918273960008502
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Energy: 1.362490612253152
Energy: 1.2918273959986644
Energy: 1.387774668589669
Energy: 1.324756827977582
Energy: 1.3275816668706455
Energy: 1.4037330630805713
Energy: 1.3244796857818486
Energy: 1.327576954177972
Energy: 1.4037330630761997
Energy: 1.3247568279710242
Energy: 1.327581666872831
Energy: 1.4037330630718676
Energy: 1.324479685775291
Energy: 1.2962171707142682
Energy: 1.3070283857552767
Energy: 1.2782315897698846
Energy: 1.2962171707142682
Energy: 1.307028385746533
Energy: 1.2782315897742564
Energy: 1.296217170716454
Energy: 1.307028385748719
Energy: 1.2782315897808143
Energy: 1.2962171707055246
Energy: 1.3036391756631893
Energy: 1.344997498116636
Energy: 1.3448128875012906
Energy: 1.3036391756653751
Energy: 1.3449974981275652
Energy: 1.3448128874991048
Energy: 1.3036391756610033
Energy: 1.344997498136309
Energy: 1.3448128874969185
Energy: 1.3036391756588175
Energy: 1.3285403481229547
Energy: 1.4268112603122338
Energy: 1.3932701383919948
Energy: 1.3287992792897407
Energy: 1.4268112603122338
Energy: 1.393270138387623
Energy: 1.3285403481251405
Energy: 1.4268112603187915
Energy: 1.3932701383963266
Energy: 1.3287992792962984
Energy: 1.362975231469994
Energy: 1.2842661054678746
Energy: 1.3997633039433304
Energy: 1.3629745650807354
Energy: 1.2842661054744322
Energy: 1.399763303934587
Energy: 1.362975231469994
Energy: 1.2842661054766182
Energy: 1.3997633039389585
Energy: 1.3629745650938507
Energy: 1.3206687025018828
Energy: 1.3185040598553928
Energy: 1.4910114149398148
Energy: 1.3206687025018828
Energy: 1.3185040598488351
Energy: 1.491011414935443
Energy: 1.3206687025106263
Energy: 1.3185040598510211
Energy: 1.4910114149398148
Energy: 1.3206687025062545
Energy: 1.451375810446359
Energy: 1.2833185783047563
Energy: 1.3072795025917037
Energy: 1.4502260870299593
Energy: 1.2833658201023008
Energy: 1.3072795025895179
Energy: 1.4513758104485448
Energy: 1.2833185783047563
Energy: 1.307279502587332
Energy: 1.450226087034331
Energy: 1.3222188466548537
Energy: 1.2929799073698116
Energy: 1.429200198852939
Energy: 1.3222188466482963
Energy: 1.2929799073719577
Energy: 1.4292001988507532
Energy: 1.322218846652668
Energy: 1.2929799073698116
Energy: 1.429200198855125
Energy: 1.3222188466679692
Energy: 1.3821108420977002
Energy: 1.3735299869062219
Energy: 1.3096123153822858
Energy: 1.3821108420977002
Energy: 1.3735299869062219
Energy: 1.3096014089576171
Energy: 1.382110842099886
Energy: 1.3735299869062219
Energy: 1.3096123153866575
Energy: 1.3821108421020718
Energy: 1.2857214410047366
Energy: 1.3213596366422955
Energy: 1.4651505648526784
Energy: 1.2857214410025508
Energy: 1.3213596366444815
Energy: 1.4651505648570502
Energy: 1.2857214410025508
Energy: 1.3213596366466676
Energy: 1.4651505648570502
Energy: 1.2857214410112945
Energy: 1.3407954532163262
Energy: 1.4567539604515323
Energy: 1.3556249184605047
Energy: 1.3185713372450645
Energy: 1.456753960455904
Energy: 1.3556249184583185
Energy: 1.3407954532075828
Energy: 1.45675396045809
Energy: 1.3556249184648763
Energy: 1.3185713372472505
Energy: 1.3403429765334942
Energy: 1.3004391934376505
Energy: 1.4498874744454504
Energy: 1.318328466333577
Energy: 1.3004391934332789
Energy: 1.450483074559102
Energy: 1.3403429765226047
Energy: 1.3004391934332789
Energy: 1.4498874744476362
Energy: 1.3183284663401347
Energy: 1.284761237937939
Energy: 1.4250112854571162
Energy: 1.3209197572709344
Energy: 1.284761237937939
Energy: 1.425011285459302
Energy: 1.3209197572730809
Energy: 1.284761237937939
Energy: 1.4250112854571162
Energy: 1.3209197572796383
Energy: 1.284761237940125
Energy: 1.3770020726814536
Energy: 1.3122515254594525
Energy: 1.2953000542771738
Energy: 1.3770020726901973
Energy: 1.3122515254550806
Energy: 1.2953000542815458
Energy: 1.3770020726880114
Energy: 1.312251525461638
Energy: 1.2953000542793596
Energy: 1.3770020726858252
Energy: 1.3242219474972345
Energy: 1.465855214625967
Energy: 1.2871444199950883
Energy: 1.3242219474994201
Energy: 1.4658552146303387
Energy: 1.2863626587111467
Energy: 1.3242219474994201
Energy: 1.4658552146194093
Energy: 1.2871444199994602
Energy: 1.3242219474972345
Energy: 1.4764512684468272
Energy: 1.3982112318962279
Energy: 1.2848830891308856
Energy: 1.476451268451199
Energy: 1.3982112318940418
Energy: 1.2848830891265137
Energy: 1.4764512684490132
Energy: 1.398211231891856
Energy: 1.2848830891155845
Energy: 1.476451268453385
Energy: 1.2998976437243537
Energy: 1.4693277723183042
Energy: 1.3186111755941243
Energy: 1.2998976437199818
Energy: 1.4693277723139322
Energy: 1.3186111755984962
Energy: 1.29989764371561
Energy: 1.46932777232049
Energy: 1.31861117559631
Energy: 1.2998976437265395
Energy: 1.5106105327113661
Energy: 1.3919056599575401
Energy: 1.2863222098523084
Energy: 1.5106105327156982
Energy: 1.3919056599509827
Energy: 1.286322209843565
Energy: 1.5106105327091803
Energy: 1.3919056599444246
Energy: 1.2863222098457505
Energy: 1.5106105327069943
Energy: 1.3296225299301612
Energy: 1.3293002244599474
Energy: 1.3392767643715588
Energy: 1.3296225299279751
Energy: 1.3293002244512038
Energy: 1.3392767643650012
Energy: 1.3296225299345328
Energy: 1.3293002244555756
Energy: 1.339276764367187
Energy: 1.3296225299345328
Energy: 1.4672543875282889
Energy: 1.3243404796480294
Energy: 1.3242340829357462
Energy: 1.4672543875348465
Energy: 1.3243404796436575
Energy: 1.3242340829270025
Energy: 1.4672543875348465
Energy: 1.324340479639286
Energy: 1.3242340829357462
Energy: 1.4672543875348465
Energy: 1.2942529724795866
Energy: 1.2833975859587776
Energy: 1.3910278257607016
Energy: 1.2942529724839584
Energy: 1.2833975859456623
Energy: 1.3910278257628876
Energy: 1.294252972486144
Energy: 1.2833975859412905
Energy: 1.3910278257607016
Energy: 1.294252972486144
Energy: 1.3253063241410534
Energy: 1.429469894190213
Energy: 1.3254829258236465
Energy: 1.3253063241454253
Energy: 1.429469894196771
Energy: 1.3254829258214604
Energy: 1.3253063241454253
Energy: 1.4294698941880275
Energy: 1.3254829258192744
Energy: 1.3253063241388676
Energy: 1.405976439536035
Energy: 1.2868034981922798
Energy: 1.3828893387151882
Energy: 1.405976439546925
Energy: 1.2868031222614904
Energy: 1.3828893387151882
Energy: 1.4059764395425531
Energy: 1.2868034981922798
Energy: 1.38288933870867
Energy: 1.4059764395447387
Energy: 1.324538618032838
Energy: 1.3166078360946138
Energy: 1.4681860320953666
Energy: 1.324538618030652
Energy: 1.3166078360946138
Energy: 1.4681860320866627
Energy: 1.324538618035024
Energy: 1.316607836088056
Energy: 1.4681860320910345
Energy: 1.324538618035024
Energy: 1.4030214032414028
Energy: 1.3433833444097283
Energy: 1.3063141968199337
Energy: 1.4030214032435888
Energy: 1.3433833444097283
Energy: 1.306314713032185
Energy: 1.403021403237031
Energy: 1.3433833444140604
Energy: 1.3063141968177476
Energy: 1.4030214032435888
Energy: 1.2863395936547366
Energy: 1.3536216020611838
Energy: 1.2943268120355471
Energy: 1.2863395936460327
Energy: 1.3536216020611838
Energy: 1.2943268120289892
Energy: 1.2863395936569224
Energy: 1.3536216020677414
Energy: 1.2943268120246174
Energy: 1.2863395936504045
Energy: 1.318217621523998
Energy: 1.455119277944693
Energy: 1.3007265035594577
Energy: 1.3182176215261838
Energy: 1.4551192779403213
Energy: 1.3007265035594577
Energy: 1.3182176215196262
Energy: 1.455119277942507
Energy: 1.3007265035594577
Energy: 1.3182176215196262

minimum gb energy = 1.2782315897698846 eV
minimum distance =  2.21127938542881 Angstroms
sigma value = 437


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

Energy: 1.2509892676800838
Energy: 1.2752141369143906
Energy: 1.4164342014672293
Energy: 1.2509892676792873
Energy: 1.275214136915187
Energy: 1.4164342014680258
Energy: 1.2509892676800838
Energy: 1.2752141369143906
Energy: 1.4164342014672293
Energy: 1.2509892676800838
Energy: 1.2854369093362388
Energy: 1.2208580781120648
Energy: 1.2445213063205691
Energy: 1.2854369093505733
Energy: 1.2208580781112683
Energy: 1.2445213063165872
Energy: 1.2854369093306643
Energy: 1.2208580781112683
Energy: 1.2445213063205691
Energy: 1.285436909354555
Energy: 1.3798136649061314
Energy: 1.2070246968665415
Energy: 1.3565061100279932
Energy: 1.3798136649061314
Energy: 1.2070246968681344
Energy: 1.4387982270019068
Energy: 1.2206998521888361
Energy: 1.2070246968665415
Energy: 1.3737844384181221
Energy: 1.2087574866922925
Energy: 1.3697368699792143
Energy: 1.381016649866148
Energy: 1.2863414760765908
Energy: 1.3697368699776216
Energy: 1.3810166498693335
Energy: 1.286341476074998
Energy: 1.3697368699792143
Energy: 1.3810166498677408
Energy: 1.2863414760765908
Energy: 1.3697368699776216
Energy: 1.288733847008868
Energy: 1.240349109874177
Energy: 1.3580203686068002
Energy: 1.2887338470096643
Energy: 1.2403491098781587
Energy: 1.3580203686068002
Energy: 1.288733847008868
Energy: 1.240349109874177
Energy: 1.3580203686068002
Energy: 1.288733847008868
Energy: 1.2882378186140218
Energy: 1.4175853233004077
Energy: 1.2213148189725145
Energy: 1.2882378186140218
Energy: 1.4175853233004077
Energy: 1.2213148189701255
Energy: 1.2882378186132255
Energy: 1.4175853233004077
Energy: 1.2213148189717182
Energy: 1.2882378186132255
Energy: 1.2858051947943692
Energy: 1.258816023338401
Energy: 1.2066799310762646
Energy: 1.355242987498624
Energy: 1.258816023334419
Energy: 1.2066799310754681
Energy: 1.3965205871791928
Energy: 1.258816023338401
Energy: 1.2066799310762646
Energy: 1.355242987498624
Energy: 1.264129405863592
Energy: 1.4410033137548288
Energy: 1.2348368336521796
Energy: 1.264129405863592
Energy: 1.4410033137548288
Energy: 1.2348368336545688
Energy: 1.2641294058643884
Energy: 1.4410033137548288
Energy: 1.234836833652976
Energy: 1.2641294058627954
Energy: 1.4586372411632218
Energy: 1.2415719148995703
Energy: 1.240579469684283
Energy: 1.4586372411640183
Energy: 1.241571914901959
Energy: 1.2405794696850792
Energy: 1.4586372411632218
Energy: 1.2415719148987738
Energy: 1.2405794696850792
Energy: 1.4586372411640183
Energy: 1.3573838888685688
Energy: 1.2760431645073618
Energy: 1.3704267701447768
Energy: 1.3573838888661796
Energy: 1.2760431645065653
Energy: 1.370426665589706
Energy: 1.3573838888685688
Energy: 1.2760431645073618
Energy: 1.370426901077995
Energy: 1.3573838888669758
Energy: 1.334054900091986
Energy: 1.291580859500242
Energy: 1.2670141984183856
Energy: 1.3340549000943749
Energy: 1.333832444872372
Energy: 1.2670141984159966
Energy: 1.3340549000911894
Energy: 1.3338324448731682
Energy: 1.267014198417589
Energy: 1.3340549000959674
Energy: 1.2975220013363962
Energy: 1.220761964640934
Energy: 1.2474947530401734
Energy: 1.2975220013363962
Energy: 1.2207619646425265
Energy: 1.2474947530433589
Energy: 1.2975220013363962
Energy: 1.2207619646401375
Energy: 1.24749475304097
Energy: 1.2975220013363962
Energy: 1.2404608989901977
Energy: 1.5781878923292993
Energy: 1.240475731567187
Energy: 1.2404608989894013
Energy: 1.5781878923277066
Energy: 1.240475731569576
Energy: 1.2404608989901977
Energy: 1.5781878923292993
Energy: 1.2404757315663906
Energy: 1.2404608989894013
Energy: 1.2435566180698852
Energy: 1.2236824165301292
Energy: 1.2371390760205365
Energy: 1.2435566180714779
Energy: 1.2236824165262197
Energy: 1.2371390760213328
Energy: 1.243556618069089
Energy: 1.2236824165294051
Energy: 1.2371390760213328
Energy: 1.2435566180714779

minimum gb energy = 1.2066799310754681 eV
minimum distance =  2.21691800445569 Angstroms
sigma value = 33