Model name: model_name=EAM_Dynamo_StollerTammBeland_2016_Ni__MO_103383163946_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000256299973
cohesive_energy=4.423116541956746
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -0.0272313164 eV

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

Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 1.2956717514830938
Energy: 1.175210555662089
Energy: 1.2956717514830938
Energy: 1.1752105556627506
Energy: 1.2956717514834246
Energy: 1.1752105556627506
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 1.2956717514830938
Energy: 1.17521055566242
Energy: 1.2956717514830938
Energy: 1.17521055566242
Energy: 1.2956717514830938
Energy: 1.1752105556627506
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 0.018050633975874454
Energy: 1.2956717514830938
Energy: 0.01805063397558044
Energy: 1.2956717514830938
Energy: 1.2956717514830938
Energy: 1.1752105556633754
Energy: 1.2956717514830938
Energy: 1.17521055566242
Energy: 1.2956717514830938
Energy: 1.17521055566242

minimum gb energy = 0.01805063397558044 eV
minimum distance =  2.2569605509803 Angstroms
sigma value = 1


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

Energy: 1.420561564775111
Energy: 1.3550963745693294
Energy: 1.4205615647759073
Energy: 1.3550963745693294
Energy: 1.420561564775111
Energy: 1.3550963745709217
Energy: 1.5152495449813101
Energy: 1.2624501499212546
Energy: 1.515187129947805
Energy: 1.2624501499220508
Energy: 1.2763001541636056
Energy: 1.2624501499220508
Energy: 1.3327749686414256
Energy: 1.4174834641156546
Energy: 1.3327749686398331
Energy: 1.4174834641164509
Energy: 1.3327749686358525
Energy: 1.4174834641156546
Energy: 1.544054751130285
Energy: 1.3229071371441836
Energy: 1.5440547511334695
Energy: 1.3229071371433874
Energy: 1.544054751131081
Energy: 1.3229071371425913
Energy: 1.3549308754392653
Energy: 1.4752670264075107
Energy: 1.3549308754408576
Energy: 1.4752670264122876
Energy: 1.3549308754448386
Energy: 1.475267026405122
Energy: 1.4572171995339758
Energy: 1.2770531202734077
Energy: 1.4572171995331795
Energy: 1.2770531202765922
Energy: 1.4572171995315872
Energy: 1.2770531202797772
Energy: 1.3405510955931923
Energy: 1.3860192506519704
Energy: 1.3405510955947848
Energy: 1.3860192506519704
Energy: 1.3405510955979696
Energy: 1.3860192506503781
Energy: 1.3101356721930804
Energy: 1.4879050990284646
Energy: 1.3101356721970612
Energy: 1.4879050990173903
Energy: 1.3101356721946724
Energy: 1.4879050990284646
Energy: 1.4699913687019157
Energy: 1.394521614871523
Energy: 1.4699913687027122
Energy: 1.394521614873115
Energy: 1.4699913687003234
Energy: 1.394521614873115
Energy: 1.2500352747516934
Energy: 1.4657371109906125
Energy: 1.2500352747540822
Energy: 1.4657371109890203
Energy: 1.250035274754878
Energy: 1.4657371109985746
Energy: 1.6355153073615731
Energy: 1.2766879451415976
Energy: 1.6355153073623694
Energy: 1.2766879451423936
Energy: 1.6355153073623694
Energy: 1.2766879451423936
Energy: 1.2413163935959461
Energy: 1.530431840135106
Energy: 1.2413163935951501
Energy: 1.5304318401271442
Energy: 1.2413163935959461
Energy: 1.530431840119182
Energy: 1.5658556944745843
Energy: 1.21704659910018
Energy: 1.5658556944753803
Energy: 1.21704659910018
Energy: 1.5658556944745843
Energy: 1.21704659910018
Energy: 1.3064453853711075
Energy: 1.3410108993218928
Energy: 1.3064453853703113
Energy: 1.3410108993258736
Energy: 1.3064453853711075
Energy: 1.341010899327466
Energy: 1.5628949940629366
Energy: 1.258952437617377
Energy: 1.5628949940637331
Energy: 1.2589524376157848
Energy: 1.5628949940645291
Energy: 1.258952437617377
Energy: 1.5747893699333029
Energy: 1.4177444891863962
Energy: 1.5747893699333029
Energy: 1.4177444891848037
Energy: 1.5747893699333029
Energy: 1.417744489178434
Energy: 1.3647608685688792
Energy: 1.3768494549825787
Energy: 1.3647608685696755
Energy: 1.376849454984967
Energy: 1.3647608685688792
Energy: 1.3768494549857633
Energy: 1.3647956255817093
Energy: 1.3382256650299102
Energy: 1.3647956255801168
Energy: 1.3382256650227444
Energy: 1.364795625580913
Energy: 1.3382256650259294
Energy: 1.3663477659256487
Energy: 1.3219244780552184
Energy: 1.3663477659248524
Energy: 1.3219244780528299
Energy: 1.3663477659256487
Energy: 1.3219244780599957
Energy: 1.4394374107389876
Energy: 1.2768187030019744
Energy: 1.4394374107405798
Energy: 1.2768187030027704
Energy: 1.4394374107405798
Energy: 1.2768187030019744
Energy: 1.284672581332706
Energy: 1.729337782784092
Energy: 1.284672581333502
Energy: 1.7293377827872767
Energy: 1.284672581332706
Energy: 1.7293377827904615
Energy: 1.4205347097199268
Energy: 1.3892411395886035
Energy: 1.420534709721519
Energy: 1.3892411395878073
Energy: 1.420534709721519
Energy: 1.3892411395886035
Energy: 1.2878112240374122
Energy: 1.5145444348109223
Energy: 1.2202036571797619
Energy: 1.5145444348037567
Energy: 1.2202036571781694
Energy: 1.514544434804553

minimum gb energy = 1.21704659910018 eV
minimum distance =  2.19369493342754 Angstroms
sigma value = 33


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

Energy: 1.4031384520593233
Energy: 1.4712969928407713
Energy: 1.4031384520593233
Energy: 1.4712969928448472
Energy: 1.4031384520602288
Energy: 1.4712969928453001
Energy: 1.4619374638763554
Energy: 1.3306094250706217
Energy: 1.4619374638768083
Energy: 1.3306094250719802
Energy: 1.4619374638808842
Energy: 1.3306094250719802
Energy: 1.2307874270846249
Energy: 1.3281893061485004
Energy: 1.2307874270846249
Energy: 1.3281893061403487
Energy: 1.2307874270859838
Energy: 1.328189306146689
Energy: 1.4350865678378708
Energy: 1.5121874505619541
Energy: 1.4350865678365123
Energy: 1.512187450562407
Energy: 1.4350865678369653
Energy: 1.5121874505615014
Energy: 1.3306126522317967
Energy: 1.4196682178365077
Energy: 1.3306126522313437
Energy: 1.4196682178337905
Energy: 1.3306126522286266
Energy: 1.4196682178306204
Energy: 1.327330223281864
Energy: 1.231078711228903
Energy: 1.3273302232800526
Energy: 1.2310787112298087
Energy: 1.3273302232782411
Energy: 1.2310787112329786
Energy: 1.4714469260464267
Energy: 1.4030853504893301
Energy: 1.4714469260355578
Energy: 1.4030853504884242
Energy: 1.47144692605322
Energy: 1.4030853504838956
Energy: 1.2152602858044024
Energy: 1.4035208854739953
Energy: 1.2152602858039494
Energy: 1.403520885478524
Energy: 1.215260285802138
Energy: 1.4035208854739953
Energy: 1.314216495265734
Energy: 1.2347026353507282
Energy: 1.3142164952652813
Energy: 1.2347026353507282
Energy: 1.314216495265734
Energy: 1.2347026353511812
Energy: 1.1872804325780608
Energy: 1.4554073866711663
Energy: 1.1872804325753437
Energy: 1.455407386661656
Energy: 1.1872804325753437
Energy: 1.4554073866734305
Energy: 1.4560659043964623
Energy: 1.1914170258827013
Energy: 1.4560659043995912
Energy: 1.1914170258827013
Energy: 1.4560659044004969
Energy: 1.1914170258827013
Energy: 1.2310166820822952
Energy: 1.3130151571748874
Energy: 1.2310166820822952
Energy: 1.3130151571739814
Energy: 1.2310166820818425
Energy: 1.3130151571739814
Energy: 1.4040415159858017
Energy: 1.215150377080407
Energy: 1.4040415159921418
Energy: 1.2151503770776901
Energy: 1.404041515995312
Energy: 1.215150377080407
Energy: 1.4032303409204947
Energy: 1.4761399205220267
Energy: 1.4032303409232119
Energy: 1.4761399205224797
Energy: 1.4032303409168716
Energy: 1.4761399205229326
Energy: 1.3533917405589346
Energy: 1.32761656926117
Energy: 1.3533917405525944
Energy: 1.3276165692570943
Energy: 1.3533917405584817
Energy: 1.3276165692557358
Energy: 1.2309786683913768
Energy: 1.328812565601219
Energy: 1.2309786683904709
Energy: 1.328812565602125
Energy: 1.2309786683913768
Energy: 1.3288125655971432
Energy: 1.5171860085309326
Energy: 1.437633560783486
Energy: 1.5171860085304798
Energy: 1.4376335607852975
Energy: 1.517186008529574
Energy: 1.4376335607871091
Energy: 1.328834999584407
Energy: 1.230633405967439
Energy: 1.3288349995803312
Energy: 1.2306334059624575
Energy: 1.3288349995762554
Energy: 1.2306334059633632
Energy: 1.3304586690124778
Energy: 1.3537406877047558
Energy: 1.3304586690097606
Energy: 1.353740687703397
Energy: 1.3304586690070435
Energy: 1.3537406877015856
Energy: 1.4734068605374446
Energy: 1.4067743327286484
Energy: 1.4734068605324633
Energy: 1.4067743327281959
Energy: 1.4734068605338217
Energy: 1.4067743327281959
Energy: 1.214163517912547
Energy: 1.4044289266914556
Energy: 1.2141635179111885
Energy: 1.4044289266968901
Energy: 1.2141635179111885
Energy: 1.4044289267036831
Energy: 1.3287364219051447
Energy: 1.2347019775586443
Energy: 1.32873642189654
Energy: 1.2347019775586443
Energy: 1.3287364219060502
Energy: 1.234701977560003
Energy: 1.1873386260005832
Energy: 1.4558469224217536
Energy: 1.187338626001489
Energy: 1.4558469224118316
Energy: 1.1873386260010361
Energy: 1.4558469224100201
Energy: 1.4554385470784137
Energy: 1.329038007905601
Energy: 1.455438547081131
Energy: 1.329038007906054
Energy: 1.4554385470820368
Energy: 1.329038007909224
Energy: 1.2307251853279289
Energy: 1.3277366233649293
Energy: 1.2307251853288346
Energy: 1.3277366233708165
Energy: 1.230725185331552
Energy: 1.327736623362212
Energy: 1.4035143845991405
Energy: 1.4443817332778517
Energy: 1.403514384597329
Energy: 1.4443817332801159
Energy: 1.4035143846000464
Energy: 1.4443817332728703
Energy: 1.4035374919960466
Energy: 1.4446827423446766
Energy: 1.4035374920078212
Energy: 1.4446827423473938
Energy: 1.4035374920096326
Energy: 1.444682742344224
Energy: 1.2308137639522205
Energy: 1.3277689818049896
Energy: 1.2308137639576548
Energy: 1.3277689818081595
Energy: 1.2308137639549375
Energy: 1.327768981806801
Energy: 1.4555276222704014
Energy: 1.3288458067709907
Energy: 1.4555276222604383
Energy: 1.3288458067705378
Energy: 1.4555276222581741
Energy: 1.3288458067700848
Energy: 1.187343975677145
Energy: 1.455878975599874
Energy: 1.187343975677145
Energy: 1.4558789755930812
Energy: 1.1873439756775979
Energy: 1.4558789755930812
Energy: 1.32854029529659
Energy: 1.2346887742553019
Energy: 1.3285402952938725
Energy: 1.2346887742557549
Energy: 1.328540295292514
Energy: 1.2346887742557549
Energy: 1.2141958558045687
Energy: 1.404462540607127
Energy: 1.2141958558009456
Energy: 1.4044625406093911
Energy: 1.2141958558063801
Energy: 1.4044625406044096
Energy: 1.47337032532008
Energy: 1.4069327837747858
Energy: 1.4733703253187214
Energy: 1.4069327837747858
Energy: 1.473370325320533
Energy: 1.4069327837752388
Energy: 1.330475358412371
Energy: 1.3536784118669827
Energy: 1.3304753584146352
Energy: 1.3536784118751344
Energy: 1.3304753584137294
Energy: 1.3536784118710585
Energy: 1.3285213630668289
Energy: 1.23080972180236
Energy: 1.328521363062753
Energy: 1.2308097218019072
Energy: 1.3285213630641115
Energy: 1.230809721798284
Energy: 1.51721940247791
Energy: 1.43760845117707
Energy: 1.5172194024797214
Energy: 1.43760845117707
Energy: 1.5172194024783627
Energy: 1.437608451173447
Energy: 1.2305949389587116
Energy: 1.3287484133027363
Energy: 1.2305949389600703
Energy: 1.3287484133018308
Energy: 1.2305949389569002
Energy: 1.3287484133040948
Energy: 1.3531829650974747
Energy: 1.3276359215094817
Energy: 1.3531829651069849
Energy: 1.327635921511252
Energy: 1.3531829651024563
Energy: 1.3276359215099347
Energy: 1.403230444488906
Energy: 1.4761773349378269
Energy: 1.403230444499322
Energy: 1.4761773349450724
Energy: 1.403230444492982
Energy: 1.476177334943714
Energy: 1.4040005470832975
Energy: 1.2150855660790774
Energy: 1.404000547081486
Energy: 1.2150855660722841
Energy: 1.4040005470832975
Energy: 1.2150855660790774
Energy: 1.2310162612067905
Energy: 1.3130979319805434
Energy: 1.2310162612067905
Energy: 1.3130979319796376
Energy: 1.2310162612063378
Energy: 1.3130979319791847

minimum gb energy = 1.1872804325753437 eV
minimum distance =  2.32905921282337 Angstroms
sigma value = 51


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

Energy: 1.4133464008600642
Energy: 1.4253707772762716
Energy: 1.4133464008590149
Energy: 1.4253707772783701
Energy: 1.4133464008600642
Energy: 1.4253707772783701
Energy: 1.5149565845105364
Energy: 1.329300316896344
Energy: 1.5149572060217498
Energy: 1.329300316896344
Energy: 1.5149567820069145
Energy: 1.329300316896344
Energy: 1.324368889342898
Energy: 1.636543212494473
Energy: 1.324368889342898
Energy: 1.6365432124955226
Energy: 1.3243688893407992
Energy: 1.636543212490276
Energy: 1.4025747537836593
Energy: 1.2355066657208753
Energy: 1.4025747537857578
Energy: 1.2355066657219247
Energy: 1.4025747537836593
Energy: 1.2355066657219247
Energy: 1.4194570594843048
Energy: 1.354772033187148
Energy: 1.4194570594853542
Energy: 1.3547720331892465
Energy: 1.419457059482206
Energy: 1.3547720331850495
Energy: 1.4190743808405102
Energy: 1.3546125382057077
Energy: 1.4190743808405102
Energy: 1.354612538200509
Energy: 1.4190743808384116
Energy: 1.3546125381994598
Energy: 1.3800608647282988
Energy: 1.3541762610351855
Energy: 1.380060864729348
Energy: 1.3541762610351855
Energy: 1.3800608647282988
Energy: 1.3541762610341364
Energy: 1.3019213019352427
Energy: 1.3561012223493973
Energy: 1.3019213019331441
Energy: 1.3561012223504465
Energy: 1.3019213019352427
Energy: 1.3561012223493973
Energy: 1.5913693889408436
Energy: 1.2349176279147953
Energy: 1.591369388942942
Energy: 1.2349176279147953
Energy: 1.591369388942942
Energy: 1.2349176279147953
Energy: 1.280611349846701
Energy: 1.6036920116928812
Energy: 1.2806113498446026
Energy: 1.6036920116886841
Energy: 1.280611349846701
Energy: 1.603692011691832
Energy: 1.4672073732541326
Energy: 1.2464857771101987
Energy: 1.4672079920058945
Energy: 1.2464857771091495
Energy: 1.467461619643817
Energy: 1.2464857771101987
Energy: 1.410635614618189
Energy: 1.4273368612007369
Energy: 1.4106356146192383
Energy: 1.4273368612017863
Energy: 1.410635614618189
Energy: 1.4273368612007369
Energy: 1.5985434741477713
Energy: 1.3303979436572326
Energy: 1.5985434741582643
Energy: 1.330397943656183
Energy: 1.5985434741551163
Energy: 1.330397943656183
Energy: 1.3243203861966388
Energy: 1.3396010993336567
Energy: 1.3243203861924417
Energy: 1.3396010993388554
Energy: 1.3243203861913926
Energy: 1.3396010993347058
Energy: 1.4535729702604583
Energy: 1.4293789241326427
Energy: 1.4535729702594091
Energy: 1.4293789241336918
Energy: 1.4535729702594091
Energy: 1.4293789241326427
Energy: 1.4192336299410209
Energy: 1.3545255964802083
Energy: 1.419233629948366
Energy: 1.3545255964812575
Energy: 1.419233629947317
Energy: 1.3545255964812575
Energy: 1.4194241582479157
Energy: 1.464243585117493
Energy: 1.4194241582458171
Energy: 1.4642435851132956
Energy: 1.4194241582426692
Energy: 1.4642435851132956
Energy: 1.3806550581983406
Energy: 1.3609001317744474
Energy: 1.3806550581962418
Energy: 1.360900131773398
Energy: 1.3806550581983406
Energy: 1.3609001317744474

minimum gb energy = 1.2349176279147953 eV
minimum distance =  2.19662830150074 Angstroms
sigma value = 19


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

Energy: 1.3274791224929143
Energy: 1.3170359611974578
Energy: 1.2027690723815363
Energy: 1.3170359611949682
Energy: 1.3274791224935367
Energy: 1.3170359611955904
Energy: 1.4581032882134828
Energy: 1.4144716635067203
Energy: 1.4581032882109932
Energy: 1.4144716635073427
Energy: 1.4581032882103706
Energy: 1.4144716635054753
Energy: 1.2263774321413652
Energy: 1.2683455920236812
Energy: 1.226377432143855
Energy: 1.2683455920205693
Energy: 1.226377432145722
Energy: 1.2683455920243034
Energy: 1.4148369947009145
Energy: 1.22665090841149
Energy: 1.4148369947021593
Energy: 1.226773562670235
Energy: 1.4148369946978028
Energy: 1.22665090841149
Energy: 1.2931237202599792
Energy: 1.2630325348535738
Energy: 1.2931237202624688
Energy: 1.200181371193166
Energy: 1.2931237202630912
Energy: 1.263032534850462
Energy: 1.1649310230272378
Energy: 1.2625788703064087
Energy: 1.16493102303035
Energy: 1.1999986959961073
Energy: 1.1649310230284828
Energy: 1.2625788703076535
Energy: 1.2672107491319262
Energy: 1.226865214867742
Energy: 1.2672107491325484
Energy: 1.2268652148652524
Energy: 1.2672107491344158
Energy: 1.226865214868336
Energy: 1.2264626519437212
Energy: 1.5456491571355653
Energy: 1.2264608554763643
Energy: 1.5456491571368103
Energy: 1.2264626519393642
Energy: 1.545649157136188
Energy: 1.313991280766375
Energy: 1.3355485491399617
Energy: 1.3139912807701093
Energy: 1.3355485491281642
Energy: 1.313991280758906
Energy: 1.335548549131248
Energy: 1.2027690723821587
Energy: 1.3170359611974578
Energy: 1.2027690723815363
Energy: 1.3170359611962128
Energy: 1.2027690723821587
Energy: 1.3170359611962128
Energy: 1.4581032882134828
Energy: 1.4144716635060979
Energy: 1.4581032882103706
Energy: 1.4144716635073427
Energy: 1.4581032882085032
Energy: 1.4144716635060979
Energy: 1.226377432140743
Energy: 1.2683455920230589
Energy: 1.22637743214261
Energy: 1.268345592018702
Energy: 1.2263774321451
Energy: 1.268345592021814
Energy: 1.4148369946996697
Energy: 1.2267617366232213
Energy: 1.4148369947009145
Energy: 1.2268075794197513
Energy: 1.4148369946959354
Energy: 1.2267617366232213
Energy: 1.2931237202606014
Energy: 1.200181371194411
Energy: 1.2931237202624688
Energy: 1.263171766945289
Energy: 1.2931237202630912
Energy: 1.200181371188809
Energy: 1.1649310230259933
Energy: 1.1999986959985969
Energy: 1.1649310230284828
Energy: 1.2625445414109764
Energy: 1.1649310230272378
Energy: 1.1999986959936177
Energy: 1.2672107491325484
Energy: 1.226865214868336
Energy: 1.2672107491344158
Energy: 1.2268652148652524
Energy: 1.2672107491356603
Energy: 1.226865214868336
Energy: 1.2264696525993812
Energy: 1.5456491571336983
Energy: 1.2264788633813284
Energy: 1.545649157138055
Energy: 1.2264696525981367
Energy: 1.545649157136188
Energy: 1.2416103649992012
Energy: 1.3355485490814836
Energy: 1.3139912807682421
Energy: 1.3355485491362271
Energy: 1.2416103649954666
Energy: 1.3355485491461858
Energy: 1.3274791224929143
Energy: 1.3170359611980802
Energy: 1.2027690723821587
Energy: 1.3170359611962128
Energy: 1.3274791224929143
Energy: 1.3170359611974578
Energy: 1.4581032882134828
Energy: 1.414471663508559
Energy: 1.4581032882091258
Energy: 1.414471663508559
Energy: 1.4581032882103706
Energy: 1.4144716635067203
Energy: 1.2263774321401204
Energy: 1.2683455920230589
Energy: 1.2263774321419876
Energy: 1.2683455920267932
Energy: 1.2263774321451
Energy: 1.2683455920224362
Energy: 1.4148369947009145
Energy: 1.226650908410245
Energy: 1.4148369947009145
Energy: 1.2267735626714797
Energy: 1.4148369946965578
Energy: 1.2266509084108674
Energy: 1.2931237202606014
Energy: 1.2630325348529516
Energy: 1.2931237202624688
Energy: 1.2001813711950333
Energy: 1.2931237202630912
Energy: 1.2630325348485945
Energy: 1.1649310230259933
Energy: 1.262578870305164
Energy: 1.1649310230297276
Energy: 1.199998695997352
Energy: 1.1649310230284828
Energy: 1.2625788703076535
Energy: 1.2672107491313036
Energy: 1.2268652148671197
Energy: 1.2672107491325484
Energy: 1.2268652148652524
Energy: 1.2672107491344158
Energy: 1.226865214868336
Energy: 1.2264626519443436
Energy: 1.545649157134943
Energy: 1.2264608554769865
Energy: 1.5456491571368103
Energy: 1.2264626519399868
Energy: 1.545649157134943
Energy: 1.313991280762018
Energy: 1.3355485491511652
Energy: 1.31399128076513
Energy: 1.3355485491225623
Energy: 1.3139912807645078
Energy: 1.3355485491468082
Energy: 1.2027690723821587
Energy: 1.3170359611974578
Energy: 1.2027690723821587
Energy: 1.3170359611955904
Energy: 1.202769072382781
Energy: 1.3170359611962128
Energy: 1.4581032882128602
Energy: 1.4144716635073427
Energy: 1.4581032882097482
Energy: 1.4144716635073427
Energy: 1.4581032882097482
Energy: 1.4144716635067203
Energy: 1.226377432139498
Energy: 1.268345592021814
Energy: 1.22637743214261
Energy: 1.268345592021814
Energy: 1.2263774321451
Energy: 1.268345592018702

minimum gb energy = 1.1649310230259933 eV
minimum distance =  2.26838543651227 Angstroms
sigma value = 27


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

Energy: 1.1793523723955712
Energy: 1.1263139202189805
Energy: 1.1793523723940467
Energy: 1.1263139202189805
Energy: 1.1793523723940467
Energy: 1.1263139202189805
Energy: 1.3336793599241519
Energy: 1.1992619810616207
Energy: 1.3336793599226273
Energy: 1.1992619810600964
Energy: 1.333679359919578
Energy: 1.1992619810600964
Energy: 1.1535638203040448
Energy: 1.3276168113568263
Energy: 1.1535638203009955
Energy: 1.3276168113568263
Energy: 1.15356382030252
Energy: 1.3276168113568263
Energy: 1.2888813365676874
Energy: 1.0911675551136495
Energy: 1.2888813365661629
Energy: 1.0911675551136495
Energy: 1.2888813365661629
Energy: 1.0911675551106004
Energy: 1.2884824126614929
Energy: 1.091274543896649
Energy: 1.2884824126614929
Energy: 1.0912745438981732
Energy: 1.2884824126614929
Energy: 1.0912745439012226
Energy: 1.2958856279609487
Energy: 1.3712568037896626
Energy: 1.2958856279624733
Energy: 1.3712568037911874
Energy: 1.2958856279609487
Energy: 1.3712568037911874
Energy: 1.0915338200223164
Energy: 1.20124798488963
Energy: 1.0915338200268903
Energy: 1.2012479848911544
Energy: 1.0915338200253655
Energy: 1.2012479848911544
Energy: 1.1747691633033785
Energy: 1.126589761478184
Energy: 1.1747691633033785
Energy: 1.1265897614766591
Energy: 1.1747691633018542
Energy: 1.1265897614766591
Energy: 1.3336184382763807
Energy: 1.153472239603528
Energy: 1.3336184382763807
Energy: 1.153472239603528
Energy: 1.3336184382763807
Energy: 1.1534722396020034
Energy: 1.2765858043068021
Energy: 1.3470150348138534
Energy: 1.2765858043068021
Energy: 1.3470150348153782
Energy: 1.2765858043068021
Energy: 1.347015034810804
Energy: 1.2062114956391616
Energy: 1.0915564599239924
Energy: 1.2062114956406862
Energy: 1.0915564599239924
Energy: 1.2062114956391616
Energy: 1.0915564599239924
Energy: 1.365422262347223
Energy: 1.2422407306844103
Energy: 1.365422262347223
Energy: 1.242240730685935
Energy: 1.365422262347223
Energy: 1.2422407306874597

minimum gb energy = 1.0911675551106004 eV
minimum distance =  2.19184620987929 Angstroms
sigma value = 9


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

Energy: 1.1429906975179351
Energy: 1.1305797677352036
Energy: 1.1429906975170783
Energy: 1.1305797677352036
Energy: 1.1429906975192203
Energy: 1.1305797677347755
Energy: 1.494878633032632
Energy: 1.067133345199006
Energy: 1.4948786330313468
Energy: 1.067133345199006
Energy: 1.4948786330343455
Energy: 1.0671333451985778
Energy: 1.0079651182577551
Energy: 1.4458413349610426
Energy: 1.007965118258612
Energy: 1.4458413349584727
Energy: 1.007965118258612
Energy: 1.4458413349537607
Energy: 1.0678176351481776
Energy: 1.0111219955742126
Energy: 1.0678176351468924
Energy: 1.01112199558021
Energy: 1.067817635148606
Energy: 1.011121995578068
Energy: 1.1138181485757204
Energy: 1.0721682743667742
Energy: 1.1138181485722933
Energy: 1.0721682743667742
Energy: 1.1138181485727217
Energy: 1.0721682743667742
Energy: 1.1242062725116364
Energy: 1.134651379378819
Energy: 1.124206272508638
Energy: 1.1120737877852758
Energy: 1.1242062725082094
Energy: 1.1120737877869893
Energy: 1.0567514482337015
Energy: 1.172957480181261
Energy: 1.0567514482311313
Energy: 1.172957480185545
Energy: 1.0567514482409839
Energy: 1.1729574801872582
Energy: 0.9790803185319579
Energy: 1.1847548363979246
Energy: 0.9790803185319579
Energy: 1.1847548363983529
Energy: 0.9790803185319579
Energy: 1.184754836399638
Energy: 1.3402189210125166
Energy: 1.0724165624599251
Energy: 1.3402189210078044
Energy: 1.0724165624599251
Energy: 1.3402189210138018
Energy: 1.0724165624603534
Energy: 1.1553292006976907
Energy: 1.4658735477366107
Energy: 1.1553292007032594
Energy: 1.4658735477378957
Energy: 1.1553292007024027
Energy: 1.4658735477378957
Energy: 1.0673184454113038
Energy: 1.017804178487631
Energy: 1.0673184454134457
Energy: 1.0178041784872025
Energy: 1.0673184454121605
Energy: 1.0178041784867742
Energy: 1.0451330881874856
Energy: 1.249646582358627
Energy: 1.0451330881870573
Energy: 1.249646582360769
Energy: 1.0451330881874856
Energy: 1.249646582359912
Energy: 1.0986968748546448
Energy: 1.0825087870260104
Energy: 1.09869687485336
Energy: 1.0825087870242966
Energy: 1.0986968748563586
Energy: 1.0825087870285803
Energy: 1.1396780006917162
Energy: 1.4798232610511146
Energy: 1.1396780006942866
Energy: 1.479823261050686
Energy: 1.1396780006942866
Energy: 1.479823261050258
Energy: 1.0363118778482374
Energy: 1.149925950772899
Energy: 1.0363118778482374
Energy: 1.1499259507724704
Energy: 1.0363118778503795
Energy: 1.1499259507724704
Energy: 1.0297742206955702
Energy: 1.0868645258511247
Energy: 1.029774220689573
Energy: 1.0868645258519813
Energy: 1.029774220695142
Energy: 1.086864525856265
Energy: 1.3123797191331488
Energy: 1.2883085617787604
Energy: 1.3123797191361475
Energy: 1.2883085617817591
Energy: 1.312379719135719
Energy: 1.2883085617817591
Energy: 1.05381973813948
Energy: 1.0722907973941096
Energy: 1.0538197381399086
Energy: 1.0722907973949665
Energy: 1.05381973813691
Energy: 1.0722907973945381
Energy: 0.9749190223109123
Energy: 1.4074581873734902
Energy: 0.9749190223096272
Energy: 1.4074581873726337
Energy: 0.9749190223104841
Energy: 1.4074581873730618
Energy: 1.459026429448609
Energy: 1.002334461567404
Energy: 1.4590264294468958
Energy: 1.0023344615669754
Energy: 1.4590264294464674
Energy: 1.0023344615669754
Energy: 0.9750006689995175
Energy: 1.4074293465818841
Energy: 0.9750006689926637
Energy: 1.407429346579742
Energy: 0.9750006689969473
Energy: 1.4074293465767436
Energy: 1.0538242872767645
Energy: 1.072326375093088
Energy: 1.0538242872776211
Energy: 1.0723263750926595
Energy: 1.0538242872780497
Energy: 1.072326375093088
Energy: 1.312300728042625
Energy: 1.288173044719456
Energy: 1.3123007280421968
Energy: 1.2881730447224544
Energy: 1.3123007280421968
Energy: 1.288173044718599
Energy: 1.0299895252226645
Energy: 1.111513541096289
Energy: 1.0299895252183806
Energy: 1.111513541094147
Energy: 1.0299895252260916
Energy: 1.1115135410954322
Energy: 1.0362996194849583
Energy: 1.1499117494423639
Energy: 1.0362996194841017
Energy: 1.1499117494423639
Energy: 1.0362996194875287
Energy: 1.1499117494427924
Energy: 1.1396927734527165
Energy: 1.2438326342622377
Energy: 1.139692773452288
Energy: 1.2438326342630943
Energy: 1.139692773452288
Energy: 1.2438326342618091
Energy: 1.0981541281957146
Energy: 1.082504422429229
Energy: 1.098154128197428
Energy: 1.0825044224313707
Energy: 1.098154128188043
Energy: 1.0825044224317992
Energy: 1.045133685608196
Energy: 1.0902306521274783
Energy: 1.0451336856077678
Energy: 1.0902306521231946
Energy: 1.0451336856073392
Energy: 1.09023065212705
Energy: 1.067333534397694
Energy: 1.0178279725981212
Energy: 1.067333534399407
Energy: 1.0178279725981212
Energy: 1.067333534397694
Energy: 1.0178279725989778
Energy: 1.1553602562464131
Energy: 1.4587750343569557
Energy: 1.1553602562429863
Energy: 1.4587750343565273
Energy: 1.1553602562395593
Energy: 1.4587750343565273
Energy: 1.3402313995500226
Energy: 1.0723448327202458
Energy: 1.3402313995474522
Energy: 1.0723448327198175
Energy: 1.340231399550451
Energy: 1.0723448327206742
Energy: 0.979091178724202
Energy: 1.1844625066497103
Energy: 0.9790911787233454
Energy: 1.1844625066492818
Energy: 0.9790911787233454
Energy: 1.1844625066497103
Energy: 1.0568879243627736
Energy: 1.173137889021784
Energy: 1.0568879243649154
Energy: 1.1731378890183572
Energy: 1.0568879243632021
Energy: 1.173137889017072
Energy: 1.124166281085426
Energy: 1.0885190848297697
Energy: 1.1241662810965636
Energy: 1.088519084825914
Energy: 1.1241662810918516
Energy: 1.0885190848254855
Energy: 1.1136273417766764
Energy: 1.0722830217013966
Energy: 1.1136273417749634
Energy: 1.0722830217009682
Energy: 1.1136273417745348
Energy: 1.0722830217013966
Energy: 1.0677543369555298
Energy: 1.011387319787592
Energy: 1.067754336954673
Energy: 1.011387319791876
Energy: 1.067754336953816
Energy: 1.0113873197897336
Energy: 1.0078832610199822
Energy: 1.4458963418436106
Energy: 1.0078832610225523
Energy: 1.445896341846609
Energy: 1.0078832610229809
Energy: 1.4458963418491793
Energy: 1.4947971249850966
Energy: 1.0673984627698174
Energy: 1.4947971249842398
Energy: 1.0673984627693889
Energy: 1.4947971249863818
Energy: 1.0673984627698174
Energy: 1.1429906975170783
Energy: 1.1305797677369172
Energy: 1.142990697515793
Energy: 1.1305797677364888
Energy: 1.1429906975170783
Energy: 1.1305797677373453
Energy: 1.494878633029205
Energy: 1.0671333451960074
Energy: 1.4948786330309185
Energy: 1.0671333451964358
Energy: 1.4948786330296333
Energy: 1.0671333451964358
Energy: 1.0079651182603255
Energy: 1.4458413349657548
Energy: 1.0079651182577551
Energy: 1.4458413349618995
Energy: 1.0079651182577551
Energy: 1.4458413349546173
Energy: 1.0678176351451791
Energy: 1.011121995580638
Energy: 1.0678176351451791
Energy: 1.0111219955857786
Energy: 1.0678176351473208
Energy: 1.0111219955844934
Energy: 1.1138181485744352
Energy: 1.0721682743680594
Energy: 1.1138181485710084
Energy: 1.072168274368916
Energy: 1.1138181485727217
Energy: 1.072168274368916

minimum gb energy = 0.9749190223096272 eV
minimum distance =  2.26403296175705 Angstroms
sigma value = 57


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

Energy: 0.49983842577899085
Energy: 0.5123490458683865
Energy: 0.49983842577899085
Energy: 0.5123490458693616
Energy: 0.4998384257780157
Energy: 0.5123490458683865
Energy: 0.6610402355897207
Energy: 0.4993081781835802
Energy: 0.6610402355897207
Energy: 0.4993081781835802
Energy: 0.6610402355897207
Energy: 0.4993081781835802
Energy: 0.5717454164954217
Energy: 0.635574364053068
Energy: 0.5717454164954217
Energy: 0.635574364052093
Energy: 0.5717454164954217
Energy: 0.6355743640540432
Energy: 0.5131811363878921
Energy: 0.4991817206372265
Energy: 0.5131811363869169
Energy: 0.4991817206382016
Energy: 0.5131811363810661
Energy: 0.4991817206372265
Energy: 0.6605124088454198
Energy: 0.6678186721811317
Energy: 0.6605124088454198
Energy: 0.6678186721811317
Energy: 0.6605124088463951
Energy: 0.6678186721811317
Energy: 0.4993486213874696
Energy: 0.5715408811219312
Energy: 0.4993486213864945
Energy: 0.5715408811219312
Energy: 0.49934862138844477
Energy: 0.5715408811219312
Energy: 0.4993599534743072
Energy: 0.5715998304644335
Energy: 0.4993599534752823
Energy: 0.5715998304644335
Energy: 0.4993599534743072
Energy: 0.5715998304644335
Energy: 0.6606129225361299
Energy: 0.6678929277826089
Energy: 0.6606129225351548
Energy: 0.6678929277826089
Energy: 0.6606129225361299
Energy: 0.6678929277816338
Energy: 0.5131716336786686
Energy: 0.4991686461108405
Energy: 0.5131716336786686
Energy: 0.4991686461108405
Energy: 0.5131716336767184
Energy: 0.4991686461098654
Energy: 0.5716296986520817
Energy: 0.6356312230613016
Energy: 0.5716296986520817
Energy: 0.6356312230613016
Energy: 0.5716296986520817
Energy: 0.6356312230613016
Energy: 0.6607946280023261
Energy: 0.6985395525879222
Energy: 0.6607946280033012
Energy: 0.6985395525888973
Energy: 0.6607946280042764
Energy: 0.6985395525879222
Energy: 0.49983842577899085
Energy: 0.5123490458683865
Energy: 0.4998384257780157
Energy: 0.5123490458693616
Energy: 0.4998384257780157
Energy: 0.5123490458683865
Energy: 0.6610402355897207
Energy: 0.49930817818455536
Energy: 0.6610402355897207
Energy: 0.4993081781835802
Energy: 0.6610402355897207
Energy: 0.49930817818455536
Energy: 0.5717454164954217
Energy: 0.635574364053068
Energy: 0.5717454164954217
Energy: 0.635574364053068
Energy: 0.5717454164963968
Energy: 0.635574364052093
Energy: 0.5131811363869169
Energy: 0.4991817206372265
Energy: 0.5131811363908174
Energy: 0.4991817206372265
Energy: 0.5131811363849667
Energy: 0.4991817206372265
Energy: 0.6605124088463951
Energy: 0.6678186721811317
Energy: 0.6605124088463951
Energy: 0.6678186721811317
Energy: 0.6605124088463951
Energy: 0.6678186721811317
Energy: 0.4993486213864945
Energy: 0.5715408811219312
Energy: 0.49934862138844477
Energy: 0.5715408811229064
Energy: 0.49934862138844477
Energy: 0.5715408811229064
Energy: 0.4993599534733321
Energy: 0.5715998304644335
Energy: 0.4993599534752823
Energy: 0.5715998304644335
Energy: 0.4993599534752823
Energy: 0.5715998304644335
Energy: 0.6606129225351548
Energy: 0.6678929277816338
Energy: 0.6606129225351548
Energy: 0.6678929277826089
Energy: 0.6606129225341797
Energy: 0.6678929277826089

minimum gb energy = 0.4991686461098654 eV
minimum distance =  2.41331144107521 Angstroms
sigma value = 11


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

Energy: 1.0228970093682055
Energy: 1.1003589613252711
Energy: 1.0228970093674914
Energy: 1.1003589613252711
Energy: 1.022897009366777
Energy: 1.1003589613259854
Energy: 1.145898436024903
Energy: 1.0563761350792675
Energy: 1.145898436024903
Energy: 1.056376135078553
Energy: 1.1458984360256173
Energy: 1.0563761350792675
Energy: 1.1087657201481156
Energy: 1.4421116762557595
Energy: 1.108765720147401
Energy: 1.4421116762586168
Energy: 1.1087657201481156
Energy: 1.4421116762571882
Energy: 1.232093298167702
Energy: 0.9014481004372978
Energy: 1.2320932981669874
Energy: 0.9014481004365835
Energy: 1.2320932981691304
Energy: 0.9014481004372978
Energy: 1.0417821367305753
Energy: 0.8632398526199686
Energy: 1.0417821367312894
Energy: 0.8632398526199686
Energy: 1.0417821367291464
Energy: 0.8632398526206829
Energy: 1.0378624572644999
Energy: 1.1663490082912318
Energy: 1.0378624572644999
Energy: 1.1663490082905175
Energy: 1.0378624572666428
Energy: 1.1663490082912318
Energy: 0.9420504511151653
Energy: 1.20158850023669
Energy: 0.8648985008660389
Energy: 1.2015885002374043
Energy: 0.8648985008660389
Energy: 1.2015885002374043
Energy: 1.1043456547019117
Energy: 0.8278416149532591
Energy: 1.1043456547019117
Energy: 0.8278416149532591
Energy: 1.1043456547011972
Energy: 0.8278416149532591
Energy: 1.0864439740402008
Energy: 0.8302411579350621
Energy: 1.0864439740416294
Energy: 0.8302411579343479
Energy: 1.0864439740402008
Energy: 0.8302411579350621
Energy: 0.8533703682314998
Energy: 1.3314163250514865
Energy: 0.853370368232214
Energy: 1.3314163250522009
Energy: 0.8533703682329283
Energy: 1.3314163250514865
Energy: 1.26194772741125
Energy: 1.3190506074058128
Energy: 1.2619477274069644
Energy: 1.3190506074058128
Energy: 1.2619477274126787
Energy: 1.3190506074050987
Energy: 1.0430401178321154
Energy: 0.8654937661213966
Energy: 1.043040117833544
Energy: 0.8654937661206823
Energy: 1.0430401178321154
Energy: 0.8654937661206823
Energy: 1.1219860400231825
Energy: 0.9061549269749541
Energy: 1.121986040024611
Energy: 0.9061549269749541
Energy: 1.1219860400224682
Energy: 0.9061549269749541
Energy: 1.1657935560415364
Energy: 1.4119103056731102
Energy: 1.165793556042251
Energy: 1.4119103056745388
Energy: 1.1657935560408224
Energy: 1.411910305672396
Energy: 1.1467873923911869
Energy: 1.0589449487523004
Energy: 1.1467873923919012
Energy: 1.0589449487523004
Energy: 1.1467873923919012
Energy: 1.0589449487523004
Energy: 0.9331712299647497
Energy: 1.0996640201041925
Energy: 0.9331712299718927
Energy: 1.0996640201041925
Energy: 0.9331712299654639
Energy: 1.0996640201034782
Energy: 0.9820744343539789
Energy: 1.0558427985637409
Energy: 0.9820744343539789
Energy: 1.0558427985630265
Energy: 0.9820744343546933
Energy: 1.0558427985637409
Energy: 1.354710249306365
Energy: 1.377015423348033
Energy: 1.354710249306365
Energy: 1.377015423348033
Energy: 1.354710249306365
Energy: 1.3770154233516045
Energy: 1.2202235317657328
Energy: 0.8989840658811965
Energy: 1.2202235317650185
Energy: 0.8989840658811965
Energy: 1.2202235317643044
Energy: 0.8989840658804822
Energy: 1.0429528175812868
Energy: 0.9911336486673985
Energy: 1.0429528175798581
Energy: 0.9911336486681128
Energy: 1.0429528175812868
Energy: 0.9911336486681128
Energy: 0.8521817465449502
Energy: 1.16696990731567
Energy: 0.8521817465449502
Energy: 1.16696990731567
Energy: 0.8521817465435215
Energy: 1.16696990731567
Energy: 1.0725400305445871
Energy: 1.201895932560661
Energy: 1.07254003054173
Energy: 1.2018959325620895
Energy: 1.0725400305467303
Energy: 1.201895932562804
Energy: 1.1940193995404857
Energy: 1.0040794635962842
Energy: 1.1940193995404857
Energy: 1.0040794635962842
Energy: 1.1940193995404857
Energy: 1.0040794635962842
Energy: 1.0852132350118435
Energy: 0.9494438924009836
Energy: 1.0852132350118435
Energy: 0.9494438924016979
Energy: 1.0852132350139865
Energy: 0.9494438924016979
Energy: 0.8522713023392477
Energy: 1.3307062706126982
Energy: 0.8522713023413906
Energy: 1.3307062706134125
Energy: 0.8522713023399621
Energy: 1.3307062706134125
Energy: 1.5280766179182135
Energy: 1.3242551588907778
Energy: 1.5280766179182135
Energy: 1.3242551588907778
Energy: 1.5280766179182135
Energy: 1.3242551588907778

minimum gb energy = 0.8278416149532591 eV
minimum distance =  2.27803695960589 Angstroms
sigma value = 41


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

Energy: 1.1492571345654248
Energy: 0.957412862394038
Energy: 1.1492571345659879
Energy: 0.95741286239629
Energy: 1.1492571345654248
Energy: 0.9574128623951639
Energy: 1.2128618158863518
Energy: 1.2371272058121088
Energy: 1.212861815885789
Energy: 1.2371272058121088
Energy: 1.212861815885226
Energy: 1.2371272058126719
Energy: 1.4437182600800123
Energy: 1.6545579656758338
Energy: 1.4437182600800123
Energy: 1.6545579656752711
Energy: 1.4437182600805754
Energy: 1.6545579656752711
Energy: 1.1078861139298213
Energy: 0.9542291894502251
Energy: 1.1078861139298213
Energy: 0.9542291894502251
Energy: 1.1078861139298213
Energy: 0.954229189450788
Energy: 0.9128609572843973
Energy: 1.0066565268804155
Energy: 0.9128609572849603
Energy: 1.0066565268809784
Energy: 0.9128609572838341
Energy: 1.0066565268804155
Energy: 1.1833872552192606
Energy: 1.4085812165984786
Energy: 1.1833872552198235
Energy: 1.4085812165984786
Energy: 1.1833872552198235
Energy: 1.4085812165973524
Energy: 0.9548263312115813
Energy: 1.399450700581366
Energy: 0.9548263312110183
Energy: 1.399450700581366
Energy: 0.9548263312110183
Energy: 1.3994507005819288
Energy: 0.940562231861979
Energy: 0.954247458182843
Energy: 0.9405622318608531
Energy: 0.95424745818228
Energy: 0.940562231861979
Energy: 0.95424745818228
Energy: 0.9326537039317402
Energy: 0.9876092887652839
Energy: 0.9326537039317402
Energy: 0.9876092887652839
Energy: 0.9326537039317402
Energy: 0.9876092887652839
Energy: 1.0267409881046419
Energy: 1.5059775820407968
Energy: 1.0267409881046419
Energy: 1.50597758204136
Energy: 1.0267409881040788
Energy: 1.5059775820407968
Energy: 1.0230078244435972
Energy: 1.5073765391447163
Energy: 1.0230078244435972
Energy: 1.5073765391447163
Energy: 1.0230078244430343
Energy: 1.5073765391447163
Energy: 0.9222509060627926
Energy: 1.1137829155142085
Energy: 0.9222509060627926
Energy: 1.1137829155147716
Energy: 0.9222509060622296
Energy: 1.1137829155142085
Energy: 0.9369516216930598
Energy: 0.9544443793871534
Energy: 0.9369516216891188
Energy: 0.9544443793865904
Energy: 0.9369516216913708
Energy: 0.9544443793894053
Energy: 0.891472758903779
Energy: 1.3092931625971982
Energy: 0.891472758904342
Energy: 1.3092931625977613
Energy: 0.891472758902653
Energy: 1.3092931625983242
Energy: 1.186334140619328
Energy: 1.4100681923043277
Energy: 1.186334140619328
Energy: 1.4100681923043277
Energy: 1.186334140619891
Energy: 1.4100681923037648
Energy: 0.8924869230037701
Energy: 1.1414730727164448
Energy: 0.892486923001518
Energy: 1.141473072717008
Energy: 0.892486923002081
Energy: 1.141473072717008
Energy: 0.9462192820227477
Energy: 0.9543417716144414
Energy: 0.9462192820221847
Energy: 0.9543417716189453
Energy: 0.9462192820204958
Energy: 0.9543417716144414
Energy: 1.2497323750970142
Energy: 1.6573524347943032
Energy: 1.2497323750970142
Energy: 1.6573524347937403
Energy: 1.2497323750975773
Energy: 1.6573524347931772
Energy: 1.232441390524535
Energy: 1.2357092171664572
Energy: 1.232441390525661
Energy: 1.2357092171664572
Energy: 1.2324413905267868
Energy: 1.2357092171664572
Energy: 1.0232526536287818
Energy: 1.0480999471659787
Energy: 1.0232526536282187
Energy: 1.0480999471659787
Energy: 1.0232526536287818
Energy: 1.0480999471659787
Energy: 0.9318823657779218
Energy: 1.21845327040677
Energy: 0.9318823657779218
Energy: 1.218453270406207
Energy: 0.9318823657812999
Energy: 1.218453270407333
Energy: 1.0939315408069699
Energy: 1.5496771226286978
Energy: 1.0939315408075327
Energy: 1.5496771226281347
Energy: 1.093931540804155
Energy: 1.5496771226258828
Energy: 1.1092394167895914
Energy: 0.9519886633737294
Energy: 1.1092394167895914
Energy: 0.9519886633737294
Energy: 1.1092394167895914
Energy: 0.9519886633737294
Energy: 0.8925272463681718
Energy: 1.1266989151176694
Energy: 0.8925272463676088
Energy: 1.1266989151171063
Energy: 0.8925272463687348
Energy: 1.1266989151171063
Energy: 0.8932319274033631
Energy: 1.320864832873105
Energy: 0.893231927403926
Energy: 1.320864832873105
Energy: 0.8932319274022371
Energy: 1.320864832873105
Energy: 0.9548891288024969
Energy: 1.3028981386272538
Energy: 0.95488912880306
Energy: 1.3028981386272538
Energy: 0.95488912880306
Energy: 1.3028981386278167
Energy: 0.9364090046791839
Energy: 0.9517676664906378
Energy: 0.9364090046797469
Energy: 0.9517676664906378
Energy: 0.9364090046791839
Energy: 0.9517676664906378
Energy: 0.9330320491917138
Energy: 1.108290045026493
Energy: 0.9330320491922768
Energy: 1.108290045027056
Energy: 0.9330320491928399
Energy: 1.108290045026493
Energy: 1.0234471629186737
Energy: 1.2623592152285625
Energy: 1.0234471629186737
Energy: 1.2623592152279994
Energy: 1.0234471629186737
Energy: 1.2623592152285625
Energy: 1.3755845067298322
Energy: 1.2511597935869474
Energy: 1.3755845067303951
Energy: 1.2511597935869474
Energy: 1.3755845067298322
Energy: 1.2511597935852588
Energy: 0.9160202908374859
Energy: 1.1156269794308924
Energy: 0.9160202908369232
Energy: 1.1156269794314555
Energy: 0.9160202908369232
Energy: 1.1156269794308924
Energy: 0.9489252251810344
Energy: 0.9699096433304385
Energy: 0.9489252251815973
Energy: 0.9699096433304385
Energy: 0.9489252251810344
Energy: 0.9699096433298754
Energy: 0.8929274826551501
Energy: 1.1617457605533228
Energy: 0.8929274826551501
Energy: 1.1617457605533228
Energy: 0.8929274826557131
Energy: 1.1617457605533228

minimum gb energy = 0.891472758902653 eV
minimum distance =  2.3065587926126 Angstroms
sigma value = 33


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

Energy: 1.1304910647176951
Energy: 1.0415343646290385
Energy: 1.0830191609839688
Energy: 1.0415343646286077
Energy: 1.130491064717336
Energy: 1.0415343646270272
Energy: 1.169803009635774
Energy: 0.9989277811102673
Energy: 1.1698030096311045
Energy: 0.9989277811102673
Energy: 1.169803009635774
Energy: 0.9989277810964743
Energy: 1.0857337714315891
Energy: 1.535276685850994
Energy: 1.08573377143748
Energy: 1.5352766858502038
Energy: 1.0857337714327386
Energy: 1.5352766858517843
Energy: 1.1128593378745866
Energy: 1.0237809393637027
Energy: 1.1128593378702762
Energy: 1.0237809393632717
Energy: 1.1128593378753768
Energy: 1.0237809393624815
Energy: 1.039818869393139
Energy: 1.0256444465479915
Energy: 1.0399058164086785
Energy: 1.0256444465527328
Energy: 1.039818869393139
Energy: 1.0256444465645862
Energy: 1.3380191743997045
Energy: 1.009332414211065
Energy: 1.3380191743922332
Energy: 1.009332414211065
Energy: 1.3380191743997045
Energy: 1.0093324142165965
Energy: 1.055130158348027
Energy: 1.2004033616519987
Energy: 1.0551301583567194
Energy: 1.2004033616515677
Energy: 1.0551301583488173
Energy: 1.2004033616515677
Energy: 1.1429004693085623
Energy: 1.0709390138438415
Energy: 1.142900469311723
Energy: 1.0709390138434103
Energy: 1.1429004693093523
Energy: 1.0709390138327783
Energy: 1.0866227473666497
Energy: 1.0758697262893806
Energy: 1.086816552988945
Energy: 1.0758697262881591
Energy: 1.0866227473666497
Energy: 1.0758697262794668
Energy: 1.4053974393025381
Energy: 1.0339529547767037
Energy: 1.4053974393092912
Energy: 1.0339529547767037
Energy: 1.4053974393033284
Energy: 1.033952954771172
Energy: 1.1140517029512682
Energy: 1.0629064079123265
Energy: 1.1140517029516275
Energy: 1.0629064079127577
Energy: 1.1140517029512682
Energy: 1.0629064079115362
Energy: 1.6238759924834192
Energy: 1.0238996127063622
Energy: 1.6238759924779598
Energy: 1.0238996127063622
Energy: 1.6238759924838502
Energy: 1.0238996127055722
Energy: 1.025977862722535
Energy: 1.0864431561662484
Energy: 1.0259778627245466
Energy: 1.0864431561666794
Energy: 1.025977862722966
Energy: 1.0864431561698404
Energy: 1.0820241152233339
Energy: 1.1097348783675436
Energy: 1.0820241152331755
Energy: 1.1097348783671843
Energy: 1.0820241152237646
Energy: 1.109734878369124
Energy: 1.0725980251933762
Energy: 1.0042264313997422
Energy: 1.0725980251878446
Energy: 1.004226431399383
Energy: 1.0725980251933762
Energy: 1.0042264313946416
Energy: 1.0638410835266148
Energy: 1.3272359824191315
Energy: 1.0638410835293446
Energy: 1.3272359824191315
Energy: 1.0638410835266148
Energy: 1.3272359824131688
Energy: 0.9768260710344322
Energy: 1.0359786928539554
Energy: 0.9768260708934129
Energy: 1.0359786928543149
Energy: 0.9768260716256651
Energy: 1.0359786928444725
Energy: 1.0221820169994633
Energy: 1.086518729725589
Energy: 1.0221867931882895
Energy: 1.0865187297259484
Energy: 1.0221820170002536
Energy: 1.0865187297232184
Energy: 1.5380216500369897
Energy: 1.0763978445468583
Energy: 1.5380216500306676
Energy: 1.0763978445480078
Energy: 1.53802165003778
Energy: 1.076397844542907
Energy: 1.328484846638716
Energy: 1.050078794227917
Energy: 1.3284848466359862
Energy: 1.0500787942271268
Energy: 1.3284848466391472
Energy: 1.0500787942228165
Energy: 1.0316195454552892
Energy: 1.0827188779945276
Energy: 1.0316195454655621
Energy: 1.0827188779937373
Energy: 1.03161954545572
Energy: 1.0827188779889958
Energy: 0.996699809948465
Energy: 1.1710069037608202
Energy: 0.9966786378701383
Energy: 1.171006903763191
Energy: 0.996699809948824
Energy: 1.1710069037560786
Energy: 1.4724456759941282
Energy: 1.3157381313625716
Energy: 1.4724456759913984
Energy: 1.3157381313630023
Energy: 1.4724456759945592
Energy: 1.315738131364942
Energy: 1.0275705562236555
Energy: 1.1110370968202008
Energy: 1.0275705562311266
Energy: 1.1110370968170398
Energy: 1.0275705562232242
Energy: 1.1110370968186203
Energy: 1.0249541358932772
Energy: 1.035902982789142
Energy: 1.024954135899168
Energy: 1.0359029827887827
Energy: 1.0249541358948577
Energy: 1.0359029827962538
Energy: 1.007961512469318
Energy: 1.2637722982014994
Energy: 1.0079615124665882
Energy: 1.2637722982014994
Energy: 1.007961512469749
Energy: 1.2637722982027204
Energy: 1.121504870236099
Energy: 1.0556152809967023
Energy: 1.1215048702348775
Energy: 1.0556152809962713
Energy: 1.1215048702356678
Energy: 1.0556152810112855
Energy: 1.1235888463292187
Energy: 1.0272583318737545
Energy: 1.0730350183771895
Energy: 1.0272583318737545
Energy: 1.1235888463292187
Energy: 1.0272583318753348
Energy: 1.0775586405829742
Energy: 1.0865645724147852
Energy: 1.077558640585776
Energy: 1.0865645724147852
Energy: 1.0775586405829742
Energy: 1.0865645724111932
Energy: 1.032395939373445
Energy: 1.4044865468520884
Energy: 1.0323959393726547
Energy: 1.4044865468524474
Energy: 1.0323959393730857
Energy: 1.4044865468457668
Energy: 1.0280090695780715
Energy: 1.0229882549347962
Energy: 1.028009069579652
Energy: 1.0229882549347962
Energy: 1.0280090695785027
Energy: 1.0229882549391065
Energy: 1.027597049330952
Energy: 1.619954113230077
Energy: 1.0276004764166284
Energy: 1.619954113229718
Energy: 1.027597049330952
Energy: 1.6199541132371893
Energy: 1.0870641173039302
Energy: 1.0186369624465164
Energy: 1.087064117311042
Energy: 1.0186369624469473
Energy: 1.0870641173047204
Energy: 1.0186369624559992
Energy: 1.1077077365140477
Energy: 1.0760633507054767
Energy: 1.107707736514407
Energy: 1.0760633507054767
Energy: 1.1077077365132575
Energy: 1.0760633507018846
Energy: 1.0598620959398777
Energy: 1.0760607986512998
Energy: 1.0598620959327656
Energy: 1.0760607986512998
Energy: 1.059862095941889
Energy: 1.0760607986627222
Energy: 1.3276039957262225
Energy: 1.0709911300255472
Energy: 1.3277054341788934
Energy: 1.0709911300263375
Energy: 1.3276039957265817
Energy: 1.0709911300223864
Energy: 1.0279476979525362
Energy: 1.5715236405819537
Energy: 1.0279476979541164
Energy: 1.5715236405815225
Energy: 1.0279476979528954
Energy: 1.571523640579152
Energy: 1.08079426188722
Energy: 1.0228148721330976
Energy: 1.0807942618868605
Energy: 1.0228148721330976
Energy: 1.0807942618868605
Energy: 1.0228148721256265
Energy: 1.080608024462561
Energy: 1.3915839910159684
Energy: 1.0806085152709874
Energy: 1.3915839910159684
Energy: 1.0806080244629923
Energy: 1.391583991017549
Energy: 1.026558683609572
Energy: 1.087712308541825
Energy: 1.026558683599658
Energy: 1.0877123085370837
Energy: 1.026558683609931
Energy: 1.0877123085299714
Energy: 1.0728599799149987
Energy: 1.0252780000405977
Energy: 1.0728599799106167
Energy: 1.0252780000405977
Energy: 1.0728599799149987
Energy: 1.0252780000429682
Energy: 1.1751126896769364
Energy: 1.0037527634100494
Energy: 1.1751126896737751
Energy: 1.0037527634100494
Energy: 1.1751126896769364
Energy: 1.0037527634187418
Energy: 1.0585567502861437
Energy: 1.3233537704133136
Energy: 1.0585567502885145
Energy: 1.3233537704137446
Energy: 1.058556750287293
Energy: 1.3233537704180551
Energy: 0.9724192385515998
Energy: 1.0381763478109014
Energy: 0.9724192385476488
Energy: 1.0381763478113324
Energy: 0.9724192385480799
Energy: 1.0381763478116914
Energy: 1.027950324212331
Energy: 1.0787685561131946
Energy: 1.0279498467500352
Energy: 1.0787685561139848
Energy: 1.0279503242126904
Energy: 1.0787685561128355
Energy: 1.4008486939713887
Energy: 1.2024303849428264
Energy: 1.4008486939690181
Energy: 1.2024303849423954
Energy: 1.4008486939701676
Energy: 1.2024303849392344
Energy: 0.9964406171521715
Energy: 1.12630261136582
Energy: 0.9964406171493697
Energy: 1.1263026113666104
Energy: 0.9964406171521715
Energy: 1.1263026113666104

minimum gb energy = 0.9724192385476488 eV
minimum distance =  2.28750177588172 Angstroms
sigma value = 67


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

Energy: 1.1260643610202095
Energy: 1.0372707626398348
Energy: 1.1260643610202095
Energy: 1.0372707626398348
Energy: 1.1260643610202095
Energy: 1.0372707626398348
Energy: 1.1039690779496725
Energy: 1.0005567778300526
Energy: 1.1039690779496725
Energy: 1.0005567778300526
Energy: 1.1039690779496725
Energy: 1.0005567778300526
Energy: 1.6156856603668137
Energy: 1.263444596607062
Energy: 0.9950370272528022
Energy: 1.263444596607062
Energy: 0.9950370272554427
Energy: 1.2634445966097025
Energy: 1.1039877187654659
Energy: 1.0007559452080892
Energy: 1.1039877187654659
Energy: 1.0007559452080892
Energy: 1.1039877187654659
Energy: 1.0007559452080892
Energy: 1.1260643610202095
Energy: 1.037270762645116
Energy: 1.1260643610202095
Energy: 1.037270762645116
Energy: 1.1260643610202095
Energy: 1.037270762645116
Energy: 1.1039690779523132
Energy: 1.000556777827412
Energy: 1.1039690779523132
Energy: 1.000556777827412
Energy: 1.1039690779523132
Energy: 1.000556777827412
Energy: 1.6156856603668137
Energy: 1.2634445966097025
Energy: 0.9950370272528022
Energy: 1.2634445966097025
Energy: 0.9950370272554427
Energy: 1.2634445966097025

minimum gb energy = 0.9950370272528022 eV
minimum distance =  2.29646081920283 Angstroms
sigma value = 3


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

Energy: 1.3865009264870538
Energy: 1.2206854684707127
Energy: 1.3865009264870538
Energy: 1.2206854684707127
Energy: 1.3865009264870538
Energy: 1.2206854684707127
Energy: 1.2977436610598159
Energy: 1.1592804657799443
Energy: 1.2977436610598159
Energy: 1.1592804657799443
Energy: 1.2977436610598159
Energy: 1.1592804657799443
Energy: 1.2179215857662127
Energy: 1.4127950160546017
Energy: 1.2179215857662127
Energy: 1.4127950160581952
Energy: 1.2179215857662127
Energy: 1.4127950160581952
Energy: 1.3716258953057257
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Energy: 1.224432218066831
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Energy: 1.2644691204189535
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Energy: 1.1823049863174584
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Energy: 1.159939996684811
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Energy: 1.3046353130052193
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Energy: 1.3699426258659073
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Energy: 1.3208351840727772
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Energy: 1.2251853884412092
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Energy: 1.2706927099158853
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Energy: 1.2582372178625538
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Energy: 1.279222021620978
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Energy: 1.1551886963151585
Energy: 1.2792220216245715
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Energy: 1.2024010317719513
Energy: 1.4534844616886864
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Energy: 1.2024010317719513
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Energy: 1.3045182946207994
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Energy: 1.3045182946243927
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Energy: 1.3045182946243927
Energy: 1.3081330553426385
Energy: 1.2584230851706695
Energy: 1.3081330109073166
Energy: 1.2584230851778564
Energy: 1.3081329263038428
Energy: 1.2584230851778564
Energy: 1.190386092138017
Energy: 1.3104324219995622
Energy: 1.1903860921308298
Energy: 1.3104324220031556
Energy: 1.1903860921344234
Energy: 1.3104324219995622
Energy: 1.457699058809532
Energy: 1.1475633257714821
Energy: 1.4576990588059386
Energy: 1.1475633257714821
Energy: 1.4576990588059386
Energy: 1.1475633257714821
Energy: 1.1658154855173313
Energy: 1.473082982251998
Energy: 1.1658154855173313
Energy: 1.473082982251998
Energy: 1.1658154855173313
Energy: 1.473082982251998
Energy: 1.3021297114450199
Energy: 1.1595712242674228
Energy: 1.302129711430646
Energy: 1.1595712242710163
Energy: 1.3021297114342396
Energy: 1.1595712242674228
Energy: 1.2676585339064697
Energy: 1.2631328467307845
Energy: 1.2676585339064697
Energy: 1.2631328391087984
Energy: 1.2676585339064697
Energy: 1.2631328253806244
Energy: 1.3484470272610019
Energy: 1.1664059959810722
Energy: 1.3484470272610019
Energy: 1.1664059959846658
Energy: 1.3484470272610019
Energy: 1.1664059959846658
Energy: 1.2021725005861126
Energy: 1.346459465284006
Energy: 1.2021725005861126
Energy: 1.3464594652804127
Energy: 1.2021725005861126
Energy: 1.3464594652875996
Energy: 1.2501883705768386
Energy: 1.1698186877039007
Energy: 1.2501883705768386
Energy: 1.1698186877110877
Energy: 1.250188370580432
Energy: 1.1698186877110877
Energy: 1.1901248534562814
Energy: 1.2688295954226183
Energy: 1.190124853459875
Energy: 1.2688295954262119
Energy: 1.190124853452688
Energy: 1.2688295954226183
Energy: 1.2687520267814774
Energy: 1.270147337723151
Energy: 1.2687520267850707
Energy: 1.2701473377195576
Energy: 1.2687520267814774
Energy: 1.270147337723151
Energy: 1.202273971303342
Energy: 1.2574811012097948
Energy: 1.202273971303342
Energy: 1.2574811012133886
Energy: 1.2022739712997486
Energy: 1.2574811012097948

minimum gb energy = 1.1403274145293738 eV
minimum distance =  2.21177336536085 Angstroms
sigma value = 81


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

Energy: 1.3181664286446448
Energy: 1.2188394863192453
Energy: 1.318166428644152
Energy: 1.2188394863182588
Energy: 1.3181664286431654
Energy: 1.2188394863192453
Energy: 1.1945260325657432
Energy: 1.1676165215558327
Energy: 1.194526032567716
Energy: 1.1676165215513938
Energy: 1.1945260325682092
Energy: 1.1676165215548462
Energy: 1.3646646358803833
Energy: 1.3486504811257214
Energy: 1.3646646358803833
Energy: 1.3486504811262146
Energy: 1.3646646358798902
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Energy: 1.2182136057169852
Energy: 1.2490566154564173
Energy: 1.2182136057174784
Energy: 1.2490566154569105
Energy: 1.2182136057179715
Energy: 1.24905661545839
Energy: 1.2477327221903778
Energy: 1.1640480756878608
Energy: 1.2477327221903778
Energy: 1.1640480756868745
Energy: 1.247732722190871
Energy: 1.1640480756868745
Energy: 1.159410666887898
Energy: 1.1276785722717735
Energy: 1.1594106668874045
Energy: 1.1276785722712803
Energy: 1.159410666893323
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Energy: 1.1131859139683533
Energy: 1.1336355886413179
Energy: 1.1131859139688463
Energy: 1.1336355886403315
Energy: 1.1131859139683533
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Energy: 1.2211891070395375
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Energy: 1.5396531282029033
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Energy: 1.1910792279352416
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Energy: 1.1725623718914813
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Energy: 1.2369652697877171
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Energy: 1.2369652697887035
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Energy: 1.2369652697891966
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Energy: 1.311138418105765
Energy: 1.2855841687041905
Energy: 1.3111384181062582
Energy: 1.285584168705177
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Energy: 1.3004494867637217
Energy: 1.0980056072288062
Energy: 1.3004494867642151
Energy: 1.098005607230286
Energy: 1.3004494867632288
Energy: 1.098005607230286
Energy: 1.2212212743240183
Energy: 1.1637724577357014
Energy: 1.2212212743220454
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Energy: 1.2212212743245112
Energy: 1.163772457735208
Energy: 1.259422630893828
Energy: 1.1280551462906045
Energy: 1.259422630893335
Energy: 1.1280551462886317
Energy: 1.2594226308918555
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Energy: 1.1344106392994322
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Energy: 1.1344106392994322
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Energy: 1.351223463188631
Energy: 1.3255075758054518
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Energy: 1.3255075758069312
Energy: 1.3512234631891242
Energy: 1.3255075758089043
Energy: 1.2484425207651437
Energy: 1.3707788491719488
Energy: 1.248442520760212
Energy: 1.3707788491709625
Energy: 1.2484425207592256
Energy: 1.3707788491689896
Energy: 1.2014649185287614
Energy: 1.247064883328373
Energy: 1.201464918527775
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Energy: 1.2470648833273867
Energy: 1.2299978495541901
Energy: 1.157567549832722
Energy: 1.2299978495522172
Energy: 1.1575675498332152
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Energy: 1.1934450811627872
Energy: 1.0960030577625601
Energy: 1.1934450811613078
Energy: 1.0960030577650264
Energy: 1.1934450811677197
Energy: 1.0960030577625601
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Energy: 1.22316840172152
Energy: 1.1981081155993205
Energy: 1.223168401723986
Energy: 1.198108115597841
Energy: 1.223168401721027
Energy: 1.2869801645899812
Energy: 1.337972103969242
Energy: 1.2869801645850492
Energy: 1.3379721039677623
Energy: 1.286980164587022
Energy: 1.3379721039628305
Energy: 1.3006040363466407
Energy: 1.4697883812421852
Energy: 1.300604036347627
Energy: 1.4697883812416923
Energy: 1.3006040363471336
Energy: 1.4697883812416923
Energy: 1.13409618211322
Energy: 1.2194528164538232
Energy: 1.1340961821166726
Energy: 1.2194528164543161
Energy: 1.134096182115193
Energy: 1.2194528164548095
Energy: 1.1734334543915397
Energy: 1.128111958618602
Energy: 1.1734334543900602
Energy: 1.128111958623041
Energy: 1.1734334543949474
Energy: 1.128111958621068
Energy: 1.2369936009389575
Energy: 1.193992204410125
Energy: 1.2369936009340252
Energy: 1.1939922044106182
Energy: 1.2369936009345186
Energy: 1.193992204410125
Energy: 1.348774721943147
Energy: 1.0969722871142886
Energy: 1.3487747219426538
Energy: 1.096972287114782
Energy: 1.3487747219436403
Energy: 1.096972287115275
Energy: 1.2483381661786646
Energy: 1.3005694348339665
Energy: 1.2483381661786646
Energy: 1.3005694348344596
Energy: 1.2483381661806372
Energy: 1.3005694348334733
Energy: 1.1638869525753492
Energy: 1.2230486181744133
Energy: 1.163886952574363
Energy: 1.223048618176386
Energy: 1.163886952574363
Energy: 1.2230486181729336
Energy: 1.128928154815744
Energy: 1.2131979511683384
Energy: 1.128928154815251
Energy: 1.2129498051482686
Energy: 1.1289281548162373
Energy: 1.2129389967304276
Energy: 1.1289055161667756
Energy: 1.1107809172609053
Energy: 1.128905516166282
Energy: 1.1107809172599188
Energy: 1.128905516168255
Energy: 1.1107809172599188
Energy: 1.1841669025702821
Energy: 1.5962118267312826
Energy: 1.184166902567816
Energy: 1.5962118267298029
Energy: 1.1841669025683093
Energy: 1.5962118267317758
Energy: 1.372133726474833
Energy: 1.2485212159285362
Energy: 1.3721337264787785
Energy: 1.2485212159349028
Energy: 1.372133726482231
Energy: 1.2485212159319885
Energy: 1.2369171883080812
Energy: 1.1799031037918348
Energy: 1.236917188305122
Energy: 1.1799031037893688
Energy: 1.23691718830019
Energy: 1.1799031037913417
Energy: 1.1547653631002404
Energy: 1.133523275056282
Energy: 1.15476536310172
Energy: 1.1335232750552957
Energy: 1.1547653630997472
Energy: 1.1335232750557886

minimum gb energy = 1.0960030577625601 eV
minimum distance =  2.30957575835789 Angstroms
sigma value = 43


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

Energy: 1.418885004902816
Energy: 1.2009095908007341
Energy: 1.418885004902816
Energy: 1.2009095908007341
Energy: 1.4188850049022101
Energy: 1.2009095908007341
Energy: 1.234092404992503
Energy: 1.1368020006993333
Energy: 1.2340924049931088
Energy: 1.1368020006993333
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Energy: 1.1368020006993333
Energy: 1.2642375471570024
Energy: 1.350286958891414
Energy: 1.2642375471570024
Energy: 1.3502869588920199
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Energy: 1.350286958891414
Energy: 1.2039258969958126
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Energy: 1.2039258969952067
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Energy: 1.2307778597864718
Energy: 1.2202591079319083
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Energy: 1.2202591079337257
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Energy: 1.2307181520255843
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Energy: 1.1709484620124717
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Energy: 1.2714466111603122
Energy: 1.3670996636078219
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Energy: 1.2714466111591005
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Energy: 1.177970634367411
Energy: 1.2726533337204993
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Energy: 1.2726533337211052
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Energy: 1.1106637429860369
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Energy: 1.1106637429854311
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Energy: 1.1106637429866426
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Energy: 1.164219696965656
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Energy: 1.3061878449889175
Energy: 1.1386278766765985
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Energy: 1.1778500506900447
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Energy: 1.1778500506894387
Energy: 1.2148662084734096
Energy: 1.1778500506894387
Energy: 1.2148662084770445
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Energy: 1.2741322721622026
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Energy: 1.2741322719139305
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Energy: 1.3696004573311171
Energy: 1.1115709983537987
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Energy: 1.1115709983544044
Energy: 1.3696004573311171
Energy: 1.204301867843575
Energy: 1.2244172902549242
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Energy: 1.2244172902549242
Energy: 1.204301867843575
Energy: 1.2244172902549242
Energy: 1.1891758988181926
Energy: 1.2629784275415084
Energy: 1.1891758988175867
Energy: 1.2629784275409024
Energy: 1.1891758988187986
Energy: 1.2629784275415084
Energy: 1.2927629536488197
Energy: 1.1370660084228297
Energy: 1.2927629536494254
Energy: 1.1370660084234354
Energy: 1.292762953650637
Energy: 1.1370660084234354
Energy: 1.3296190419634824
Energy: 1.1989947295845411
Energy: 1.329619041964088
Energy: 1.1989947295845411
Energy: 1.329619041964088
Energy: 1.1989947295845411
Energy: 1.2585490478374606
Energy: 1.1581300809886923
Energy: 1.2585490478374606
Energy: 1.1581300809899036
Energy: 1.2585490478374606
Energy: 1.1581300809892978
Energy: 1.291829475217977
Energy: 1.247735665072618
Energy: 1.2918294752191886
Energy: 1.2477356650732239
Energy: 1.2918294752173713
Energy: 1.247735665076253
Energy: 1.1890250908196798
Energy: 1.1993366530115022
Energy: 1.1890250908196798
Energy: 1.1993366530102907
Energy: 1.1890250908190738
Energy: 1.199336653009685
Energy: 1.2596430547366881
Energy: 1.2357057536367306
Energy: 1.2596430547372937
Energy: 1.235705753636125
Energy: 1.2596430547366881
Energy: 1.2357057536367306
Energy: 1.1116680303139848
Energy: 1.261299611307563
Energy: 1.1116680303145905
Energy: 1.2612996113081685
Energy: 1.1116680303139848
Energy: 1.261299611307563
Energy: 1.27665923223276
Energy: 1.230864266601798
Energy: 1.27665923223276
Energy: 1.2308642666005862
Energy: 1.27665923223276
Energy: 1.230864266602404
Energy: 1.1778604491665914
Energy: 1.1786709346987199
Energy: 1.1778604491665914
Energy: 1.1786709346993258
Energy: 1.1778604491665914
Energy: 1.1786709346981141
Energy: 1.2972983597192462
Energy: 1.2166045138644994
Energy: 1.2972983597192462
Energy: 1.2166045138651054
Energy: 1.2972983597192462
Energy: 1.2166045138663169
Energy: 1.2143854870891266
Energy: 1.3251308161808266
Energy: 1.214385487087915
Energy: 1.3251308161796151
Energy: 1.214385487088521
Energy: 1.3251308161802207
Energy: 1.3260591758942826
Energy: 1.2093104203765097
Energy: 1.3260591758948885
Energy: 1.2093104203765097
Energy: 1.326059175893071
Energy: 1.2093104203759037
Energy: 1.1777189044817473
Energy: 1.276405725220978
Energy: 1.1777189044829592
Energy: 1.276405725220978
Energy: 1.1777189044823533
Energy: 1.276405725220978
Energy: 1.2460245668024559
Energy: 1.2704529410957193
Energy: 1.2460245668030618
Energy: 1.2704529410957193
Energy: 1.2460245668030618
Energy: 1.2704529410957193
Energy: 1.1712102535655196
Energy: 1.231267601006096
Energy: 1.1712102535649136
Energy: 1.2312676010067019
Energy: 1.1712102535667313
Energy: 1.231267601006096

minimum gb energy = 1.1106637429854311 eV
minimum distance =  2.25829266130558 Angstroms
sigma value = 57


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

Energy: 1.3353658116106304
Energy: 1.1652340558969414
Energy: 1.246565242823512
Energy: 1.165234055892235
Energy: 1.335365811612199
Energy: 1.165234055892235
Energy: 1.2741794787633676
Energy: 1.1177304587829944
Energy: 1.2741794787633676
Energy: 1.1177304587814254
Energy: 1.2741794787610146
Energy: 1.1177304587814254
Energy: 1.2780224207269228
Energy: 1.3094210085820417
Energy: 1.2109259837696884
Energy: 1.3094210085812574
Energy: 1.2780224161669185
Energy: 1.3094210085812574
Energy: 1.5152442884575936
Energy: 1.2570649383466832
Energy: 1.5152442884536717
Energy: 1.2570649383506052
Energy: 1.5152442884505342
Energy: 1.2570649383490362
Energy: 1.2570978764318361
Energy: 1.2151776850163096
Energy: 1.257097876431052
Energy: 1.215177685018663
Energy: 1.2570978764271301
Energy: 1.2151776850194473
Energy: 1.2904891042211564
Energy: 1.1171370777827496
Energy: 1.2904891042172344
Energy: 1.1171370777851028
Energy: 1.2904891042156656
Energy: 1.1171370777843184
Energy: 1.2519182581521064
Energy: 1.2460071716388368
Energy: 1.251918258151322
Energy: 1.2460071716388368
Energy: 1.2519182581536752
Energy: 1.2460071716380525
Energy: 1.2482433622044729
Energy: 1.17019552044338
Energy: 1.2482433622036886
Energy: 1.170195520439458
Energy: 1.2482433622044729
Energy: 1.170195520439458
Energy: 1.2979605943564247
Energy: 1.1159970708341587
Energy: 1.2979605943579935
Energy: 1.1159970708365121
Energy: 1.297960594358778
Energy: 1.1159970708365121
Energy: 1.1169480340995441
Energy: 1.1709488739785967
Energy: 1.1124496035108713
Energy: 1.1709488739778124
Energy: 1.1169480340948377
Energy: 1.1709488739785967
Energy: 1.2144078193335943
Energy: 1.2610618508053266
Energy: 1.2144078193328098
Energy: 1.2610618508029736
Energy: 1.2144078193312413
Energy: 1.2610618508029736
Energy: 1.2539352199986769
Energy: 1.263172866083566
Energy: 1.2539352199986769
Energy: 1.2631728660788595
Energy: 1.253935219997108
Energy: 1.2631728660670938
Energy: 1.2645125424701376
Energy: 1.1164365769753315
Energy: 1.2645125424724908
Energy: 1.1164365769729783
Energy: 1.2645125424701376
Energy: 1.1164365769737625
Energy: 1.3008713601514204
Energy: 1.127519954704611
Energy: 1.1991296419302033
Energy: 1.1275199547038266
Energy: 1.3008713601529893
Energy: 1.1275199547038266
Energy: 1.2968240894933778
Energy: 1.120085881199697
Energy: 1.1986190085289423
Energy: 1.1200858812020504
Energy: 1.2968240894886716
Energy: 1.1200858812004817
Energy: 1.297325867387993
Energy: 1.2284646625759732
Energy: 1.2973258673895616
Energy: 1.2284646625704827
Energy: 1.2973258673887773
Energy: 1.2284646625704827
Energy: 1.110154795445749
Energy: 1.1668739885468182
Energy: 1.110330287849078
Energy: 1.166873988544465
Energy: 1.1101547954426114
Energy: 1.166873988544465
Energy: 1.2112677150972788
Energy: 1.0525823177693236
Energy: 1.2112677150972788
Energy: 1.0525823177740297
Energy: 1.2112677150988476
Energy: 1.0525823177740297
Energy: 1.1104070609676546
Energy: 1.1670842794438394
Energy: 1.1104070609684393
Energy: 1.1670842794477614
Energy: 1.1104070609692236
Energy: 1.1670842794477614
Energy: 1.2136465701066508
Energy: 1.228403493151966
Energy: 1.2136465701082193
Energy: 1.228403493155888
Energy: 1.2136465701050818
Energy: 1.228403493155888
Energy: 1.1985581042818412
Energy: 1.1241195337815264
Energy: 1.1985581042802724
Energy: 1.1241195337776044
Energy: 1.1985581042802724
Energy: 1.1241195337776044
Energy: 1.338453686379248
Energy: 1.2144523443800288
Energy: 1.3384536863800325
Energy: 1.2144523443800288
Energy: 1.3384536863855234
Energy: 1.2144523443800288
Energy: 1.2045339235812524
Energy: 1.116398783395497
Energy: 1.205236308073181
Energy: 1.1163987833947124
Energy: 1.2063449160337572
Energy: 1.116398783395497
Energy: 1.2598369530015099
Energy: 1.2658079337815642
Energy: 1.259811038972408
Energy: 1.2658079334671646
Energy: 1.2598369530022941
Energy: 1.2658079329818388

minimum gb energy = 1.0525823177693236 eV
minimum distance =  2.17343729922749 Angstroms
sigma value = 17


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

Energy: 1.1720961284963156
Energy: 1.0439651144825508
Energy: 1.1720961284963156
Energy: 1.0439651144825508
Energy: 1.1720961284963156
Energy: 1.0439651144825508
Energy: 1.0029640916082958
Energy: 0.9915192954568803
Energy: 1.0029640916094051
Energy: 0.9915192954568803
Energy: 1.0029640916082958
Energy: 0.9915192954568803
Energy: 1.1702147578113435
Energy: 1.173969310149171
Energy: 1.1702147578113435
Energy: 1.173969310149171
Energy: 1.1702147578113435
Energy: 1.173969310149171
Energy: 0.9420410196686885
Energy: 1.1799091578123473
Energy: 0.9420410196675791
Energy: 1.1799091578123473
Energy: 0.9420410196686885
Energy: 1.1799091578112382
Energy: 1.1645031747573293
Energy: 1.1056925306355125
Energy: 1.1645031747551107
Energy: 1.1056925306355125
Energy: 1.1645031747551107
Energy: 1.1056925306344032
Energy: 1.0696020188867805
Energy: 1.1389718356104979
Energy: 1.0696020188867805
Energy: 1.1389718356104979
Energy: 1.0696020188867805
Energy: 1.1389718356104979
Energy: 1.0897032850245134
Energy: 1.002375813498569
Energy: 1.0897032850234043
Energy: 1.002375813498569
Energy: 1.0897032850256227
Energy: 1.002375813498569
Energy: 0.9419589412690316
Energy: 1.1736222900859947
Energy: 0.9419589412679221
Energy: 1.1736197676510463
Energy: 0.9419589412690316
Energy: 1.1736176834615657
Energy: 1.147047298283964
Energy: 0.991180736329748
Energy: 1.147047298283964
Energy: 0.991180736329748
Energy: 1.147047298283964
Energy: 0.9911807363286387
Energy: 1.0686664845246499
Energy: 1.005485306527417
Energy: 1.0686664845246499
Energy: 1.005485306527417
Energy: 1.0686664845246499
Energy: 1.005485306527417
Energy: 1.0512015555463325
Energy: 1.0520996265892204
Energy: 1.0512015555463325
Energy: 1.0520996265892204
Energy: 1.0512015555463325
Energy: 1.0520996265892204
Energy: 1.1356543467762146
Energy: 1.1131990967901952
Energy: 1.1356543467318425
Energy: 1.113199096789086
Energy: 1.1356543465677669
Energy: 1.113199096789086
Energy: 0.9423194468018391
Energy: 1.1373564365053255
Energy: 0.9423194468018391
Energy: 1.1373564365053255
Energy: 0.9423194468029485
Energy: 1.1373564365053255
Energy: 1.0677884869234764
Energy: 1.1518700169862157
Energy: 1.0677884869245857
Energy: 1.1518700169862157
Energy: 1.0677884869234764
Energy: 1.1518700169862157
Energy: 1.067730792367386
Energy: 1.1150467281575047
Energy: 1.067730792367386
Energy: 1.1150467281575047
Energy: 1.067730792367386
Energy: 1.1150467281575047
Energy: 1.0676891985315888
Energy: 1.4078067425506748
Energy: 1.0676891985315888
Energy: 1.4078067425495655
Energy: 1.0676891985315888
Energy: 1.407806742555112
Energy: 1.0660284829396125
Energy: 1.1498052303010653
Energy: 1.0660284829407218
Energy: 1.1498052303010653
Energy: 1.0660284829407218
Energy: 1.1498052303010653

minimum gb energy = 0.9419589412679221 eV
minimum distance =  2.3020101694618 Angstroms
sigma value = 17


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

Energy: 1.0624164079887741
Energy: 0.9502465709087861
Energy: 1.062416407989631
Energy: 0.9502465709087861
Energy: 1.0624164079887741
Energy: 0.9502465709087861
Energy: 0.9828208628302567
Energy: 1.0267589189405109
Energy: 0.9828208628298285
Energy: 1.0267589189413675
Energy: 0.9828208628315419
Energy: 1.0267589189426527
Energy: 1.0187561618804248
Energy: 1.0250682560947495
Energy: 1.0187561618744279
Energy: 1.0250682560951778
Energy: 1.0187561618808534
Energy: 1.0250682560951778
Energy: 0.9883199065640202
Energy: 1.0600741348786795
Energy: 0.9883199065661622
Energy: 1.0724661583267752
Energy: 0.9883199065665905
Energy: 1.0600741348795364
Energy: 0.9586562911292024
Energy: 0.9119545856622124
Energy: 0.958656291127489
Energy: 0.9119545856630691
Energy: 0.9586562911270605
Energy: 0.9119545856626409
Energy: 1.020976149078096
Energy: 1.0005207152233193
Energy: 1.0209761490776674
Energy: 1.0005207152228908
Energy: 1.0209761490776674
Energy: 1.0005207152233193
Energy: 0.9610497650844788
Energy: 0.9600650219032844
Energy: 0.9610497650827655
Energy: 0.960065021902856
Energy: 0.9610497650844788
Energy: 0.9600650219032844
Energy: 1.0676071790525357
Energy: 1.0697734837296924
Energy: 1.0676071790546777
Energy: 1.0697734837296924
Energy: 1.0676071790538209
Energy: 1.069773483727979
Energy: 1.000829507875101
Energy: 1.0129098756165076
Energy: 1.000829507875958
Energy: 1.0129098756173642
Energy: 1.000829507875101
Energy: 1.0129098756165076
Energy: 0.9626836552633524
Energy: 0.8705932284213195
Energy: 0.9626836552642091
Energy: 0.8705932284213195
Energy: 0.9626836552633524
Energy: 0.8705932284217479
Energy: 0.8834941182782925
Energy: 0.9284948871937054
Energy: 0.8834941182791493
Energy: 0.92928696031401
Energy: 0.8834941182774357
Energy: 0.9293833835376143
Energy: 1.07889267472905
Energy: 0.9329935899811702
Energy: 1.07889267472905
Energy: 0.9329935899815985
Energy: 1.0788926747299066
Energy: 0.9329935899811702
Energy: 0.9648903189579634
Energy: 0.9375280196137354
Energy: 0.9648903189575352
Energy: 0.9375280196141637
Energy: 0.9648903189566783
Energy: 0.9375280196141637
Energy: 0.9781748826504765
Energy: 0.9525798590455229
Energy: 0.9781748826509049
Energy: 0.9525798590446662
Energy: 0.9781748826504765
Energy: 0.9525798590459512
Energy: 1.043613280977353
Energy: 1.0365066736150352
Energy: 1.0436132809769247
Energy: 1.0365066736146067
Energy: 1.0436132809730694
Energy: 1.0365066736146067
Energy: 0.8837363725317964
Energy: 0.996113733286888
Energy: 0.8837363725296544
Energy: 0.9961137332860314
Energy: 0.8837363725317964
Energy: 0.996113733286888
Energy: 0.9767189956850332
Energy: 1.0144431775565854
Energy: 0.9767189956837481
Energy: 1.014443177557014
Energy: 0.9767189956858898
Energy: 1.014443177557014
Energy: 1.0251986166455542
Energy: 1.0120611629146288
Energy: 1.025198616645126
Energy: 1.0120611629146288
Energy: 1.0251986166472677
Energy: 1.0120611629146288
Energy: 0.9745930216551659
Energy: 0.994993691234565
Energy: 0.974593021654309
Energy: 0.9949936912371352
Energy: 0.9745930216525956
Energy: 0.9949936912341365
Energy: 0.9753403353130522
Energy: 0.9086028785541999
Energy: 0.9753403353134804
Energy: 0.8723448212417685
Energy: 0.9753403353143372
Energy: 0.8723448212417685
Energy: 0.9746411153914031
Energy: 0.994974482160557
Energy: 0.9746411153914031
Energy: 0.9949744821588434
Energy: 0.9746411153918313
Energy: 0.9949744821562733
Energy: 1.0250385129615163
Energy: 1.0120734599881243
Energy: 1.0250385129589459
Energy: 1.0120734599881243
Energy: 1.025038512960231
Energy: 1.0120734599876957
Energy: 0.9767898819216997
Energy: 1.0140998932912995
Energy: 0.9767898819199862
Energy: 1.0140998932912995
Energy: 0.9767898819229847
Energy: 1.0140998932912995
Energy: 0.885958845125875
Energy: 1.0798960316764303
Energy: 0.8859588451263033
Energy: 1.079896031676002
Energy: 0.8859588451245899
Energy: 1.0798960316764303
Energy: 1.0435749518120452
Energy: 1.0365851310090881
Energy: 1.043574951812902
Energy: 1.0365851310090881
Energy: 1.0435749518236115
Energy: 1.0365851310090881
Energy: 0.978217612197038
Energy: 0.952741118355909
Energy: 0.9782176121966095
Energy: 0.9527411183554806
Energy: 0.978217612197038
Energy: 0.9527411183571942
Energy: 0.964903009017432
Energy: 0.9376075488697434
Energy: 0.9649030090178604
Energy: 0.9376075488706
Energy: 0.9649030090170038
Energy: 0.9376075488701716
Energy: 1.0789052141943032
Energy: 0.9331209192596924
Energy: 1.0789052141934463
Energy: 0.9331209192592639
Energy: 1.0789052141947315
Energy: 0.9331209192601209
Energy: 0.883359102484947
Energy: 0.9280661810408747
Energy: 0.8833591024858036
Energy: 0.9286834328749982
Energy: 0.8833591024840902
Energy: 0.92902262808388
Energy: 0.9629756765337187
Energy: 0.8706598633740591
Energy: 0.9629756765332903
Energy: 0.8706598633736307
Energy: 0.9629756765324337
Energy: 0.8706598633740591
Energy: 1.0009409590305889
Energy: 1.01286427543795
Energy: 1.0009409590305889
Energy: 1.01286427543795
Energy: 1.0009409590305889
Energy: 1.01286427543795
Energy: 1.0674887261491048
Energy: 1.0692495723815765
Energy: 1.0674887261499615
Energy: 1.0692495723815765
Energy: 1.0674887261478196
Energy: 1.0692495723862887
Energy: 0.963431147529914
Energy: 0.9590162618126913
Energy: 0.9634311475290572
Energy: 0.9590162618122631
Energy: 0.9634311475277721
Energy: 0.9590162618131198
Energy: 1.0207610114062695
Energy: 0.9275356900425056
Energy: 1.0207610114058412
Energy: 0.9275356900420771
Energy: 1.0207610114049843
Energy: 0.9275356900420771
Energy: 0.9586004962262116
Energy: 0.9118358282690411
Energy: 0.95860049622664
Energy: 0.9118358282686128
Energy: 0.9586004962236413
Energy: 0.9118358282686128
Energy: 0.9883530597608471
Energy: 1.0290460172200697
Energy: 0.9883530597599904
Energy: 1.0290460172200697
Energy: 0.9883530597621322
Energy: 1.0290460172200697
Energy: 1.019902924054197
Energy: 1.0250436296722012
Energy: 1.0199029240571957
Energy: 1.0250436296726295
Energy: 1.019902924055054
Energy: 1.0250436296726295
Energy: 0.9827165286207943
Energy: 0.926720039220973
Energy: 0.9827165286190808
Energy: 0.926720039220973
Energy: 0.9827165286207943
Energy: 0.926720039220973
Energy: 1.0624164079870606
Energy: 0.9502465709049697
Energy: 1.0624164079883458
Energy: 0.9502465709045413
Energy: 1.0624164079879175
Energy: 0.9502465709049697
Energy: 0.9828208628341121
Energy: 0.9190492148211568
Energy: 0.9828208628323987
Energy: 0.9190492148207283
Energy: 0.9828208628336839
Energy: 0.9190492148207283
Energy: 1.0187561618829952
Energy: 1.0250682560956061
Energy: 1.0187561618774266
Energy: 1.0250682560959954
Energy: 1.018756161882567
Energy: 1.0250682560956061
Energy: 0.9883199065674474
Energy: 1.0139885528418646
Energy: 0.9883199065700176
Energy: 1.0139885528422932
Energy: 0.9883199065700176
Energy: 1.0139885528422932
Energy: 0.9586562911296308
Energy: 0.9119545856613558
Energy: 0.9586562911304874
Energy: 0.9119545856609274
Energy: 0.9586562911309159
Energy: 0.9119545856613558

minimum gb energy = 0.8705932284213195 eV
minimum distance =  2.29840553571686 Angstroms
sigma value = 57


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

Energy: 0.9802780528871837
Energy: 0.8816315863309819
Energy: 0.9802780528885787
Energy: 0.8816315863316795
Energy: 0.9802780528864862
Energy: 0.8816315863309819
Energy: 0.8998100719369371
Energy: 0.8672289290536274
Energy: 0.8998100719369371
Energy: 0.8672289290536274
Energy: 0.8998100719369371
Energy: 0.8672289290529299
Energy: 1.0290281245594457
Energy: 0.9510066851624851
Energy: 1.0290281245594457
Energy: 0.9510066851631825
Energy: 1.0290281245608406
Energy: 0.9510066851624851
Energy: 0.9246348471020283
Energy: 0.980326885221766
Energy: 0.9246348471013309
Energy: 0.9803268852203709
Energy: 0.9246348471020283
Energy: 0.9803268852210685
Energy: 0.8829693688979675
Energy: 0.8582778166932047
Energy: 0.8829693688979675
Energy: 0.8582778166932047
Energy: 0.8829693688986651
Energy: 0.8582778166932047
Energy: 0.9753817342936179
Energy: 0.8655416899291756
Energy: 0.9753817342950126
Energy: 0.8655416899298731
Energy: 0.9753817342957102
Energy: 0.8655416899284781
Energy: 0.8285147102865871
Energy: 0.9362481021206163
Energy: 0.8285147102858895
Energy: 0.9362481021192213
Energy: 0.8285147102872845
Energy: 0.9362481021199187
Energy: 1.002091014933795
Energy: 0.9095146770225035
Energy: 1.002091014936585
Energy: 0.9095146770225035
Energy: 1.0020910149324
Energy: 0.909514677019016
Energy: 0.8792990836725192
Energy: 0.8679448198724969
Energy: 0.8792990836732167
Energy: 0.8679448198731945
Energy: 0.8792990836718217
Energy: 0.8679448198724969
Energy: 0.8871649874037697
Energy: 0.8920802941068575
Energy: 0.8871649874051647
Energy: 0.8920802941068575
Energy: 0.8871649874079547
Energy: 0.892080294107555
Energy: 0.8255208255470519
Energy: 1.002250538829463
Energy: 0.8255208255463543
Energy: 1.0022505388273704
Energy: 0.8255208255491443
Energy: 1.002250538826673
Energy: 0.9258958321661915
Energy: 0.9170218848462979
Energy: 0.925895832165494
Energy: 0.9170218848462979
Energy: 0.9258958321661915
Energy: 0.9170218848469953
Energy: 0.8859759980670465
Energy: 0.9800258690837452
Energy: 0.885975998066349
Energy: 0.9800258690823502
Energy: 0.885975998066349
Energy: 0.9800258690823502
Energy: 0.8854691556996409
Energy: 0.9092303847969836
Energy: 0.8854691556996409
Energy: 0.9092303847962862
Energy: 0.8854691557010359
Energy: 0.9092303847969836
Energy: 0.9978983034575368
Energy: 0.9294520722445556
Energy: 0.9978983034582344
Energy: 0.9294520722459506
Energy: 0.9978983034582344
Energy: 0.9294520722452532
Energy: 0.9789412150254301
Energy: 1.0048831594224834
Energy: 0.9789412150240351
Energy: 1.004883159421786
Energy: 0.9789412150268251
Energy: 1.0048831594210883
Energy: 0.9098673556585555
Energy: 1.0083429404667446
Energy: 0.9098673556578579
Energy: 1.008342940466047
Energy: 0.9098673556592529
Energy: 1.008342940466047
Energy: 0.9546487181254576
Energy: 0.9661157305320861
Energy: 0.9546487181268526
Energy: 0.9661157305320861
Energy: 0.9546487181254576
Energy: 0.9661157305313887
Energy: 0.8406370804519945
Energy: 0.9438609116394785
Energy: 0.840637080452692
Energy: 0.9438609116394785
Energy: 0.8406370804512969
Energy: 0.9438609116394785
Energy: 0.8429424540073951
Energy: 0.9822954592978697
Energy: 0.8429424540094875
Energy: 0.9822954592985671
Energy: 0.8429424540087901
Energy: 0.9822954592985671
Energy: 0.9497621791563594
Energy: 0.9382485080589235
Energy: 0.949762179157057
Energy: 0.938248508059621
Energy: 0.9497621791549644
Energy: 0.938248508059621
Energy: 0.8279937098106657
Energy: 0.9450691703318004
Energy: 0.827993709812758
Energy: 0.9450691703331954
Energy: 0.8279937098120606
Energy: 0.9450691703324979
Energy: 0.9073285633249142
Energy: 0.9195083911779832
Energy: 0.9073285633256116
Energy: 0.9195083911779832
Energy: 0.9073285633249142
Energy: 0.9195083911786808
Energy: 0.9070371962675664
Energy: 1.1709749427512004
Energy: 0.9070371962682638
Energy: 1.1709749427518978
Energy: 0.9070371962682638
Energy: 1.1709749427539904
Energy: 0.9080775740754807
Energy: 0.9598902883271446
Energy: 0.9080775740747832
Energy: 0.9598902883271446
Energy: 0.9080775740761782
Energy: 0.9598902883292372
Energy: 0.8825831275953262
Energy: 0.9200529851837332
Energy: 0.8825831275967212
Energy: 0.9200529851844307
Energy: 0.8825831275946288
Energy: 0.9200529851844307
Energy: 0.8272325494603051
Energy: 0.9440145727638719
Energy: 0.8272325494596076
Energy: 0.9440145727561995
Energy: 0.8272325494596076
Energy: 0.9440145727617794

minimum gb energy = 0.8255208255463543 eV
minimum distance =  2.27002500831657 Angstroms
sigma value = 43


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

Energy: 0.9744439605584717
Energy: 0.8048377764105055
Energy: 0.9744439605584717
Energy: 0.8048377764110135
Energy: 0.9744439605579635
Energy: 0.8048377764110135
Energy: 0.886447841611441
Energy: 0.8124270409669838
Energy: 0.886447841611441
Energy: 0.812427040967492
Energy: 0.8864478416119493
Energy: 0.8124270409664756
Energy: 0.9535665691544037
Energy: 0.8795089729775498
Energy: 0.9535665691538955
Energy: 0.8795089729780579
Energy: 0.9535665691533873
Energy: 0.8795089729780579
Energy: 0.9133597434814867
Energy: 0.851089178160695
Energy: 0.9133597434830112
Energy: 0.8510891781601868
Energy: 0.9133597434825032
Energy: 0.8510891781601868
Energy: 0.7862706639157672
Energy: 0.7748934136443577
Energy: 0.7862706639152589
Energy: 0.774893413644866
Energy: 0.7862706639152589
Energy: 0.774893413644866
Energy: 0.8618018567690727
Energy: 0.7870254204258519
Energy: 0.8618018567690727
Energy: 0.7870254204258519
Energy: 0.8618018567685645
Energy: 0.7870254204258519
Energy: 0.7954027597450126
Energy: 0.8296588277717667
Energy: 0.7954027597465373
Energy: 0.8296588277732913
Energy: 0.7954027597490783
Energy: 0.8296588277702421
Energy: 1.0660023249094641
Energy: 0.7645171664059481
Energy: 1.0660023249084476
Energy: 0.7645171664064563
Energy: 1.0660023249079396
Energy: 0.7645171664064563
Energy: 0.8066558752972548
Energy: 0.7777283700739144
Energy: 0.8066558752967466
Energy: 0.7777283700739144
Energy: 0.8066558752967466
Energy: 0.7777283700739144
Energy: 0.7948542418399085
Energy: 0.7809040565405239
Energy: 0.7948542418409249
Energy: 0.7809040565400157
Energy: 0.7948542418404168
Energy: 0.7809040565415404
Energy: 0.8855293885776412
Energy: 0.857361055543761
Energy: 0.8855293885771328
Energy: 0.857361055543761
Energy: 0.8855293885766248
Energy: 0.8573610555432528
Energy: 0.7507481532934555
Energy: 0.7762063016093429
Energy: 0.7507481532939637
Energy: 0.7762063016088347
Energy: 0.7507481532934555
Energy: 0.7762063016088347
Energy: 0.7946441983335771
Energy: 0.7416746622228928
Energy: 0.7946441983315443
Energy: 0.7416746622223845
Energy: 0.7946441983315443
Energy: 0.7416746622223845
Energy: 0.884743233139223
Energy: 0.8581774627406512
Energy: 0.884743233139223
Energy: 0.8581774627411594
Energy: 0.8847432331397312
Energy: 0.8581774627406512
Energy: 0.779544194545046
Energy: 0.7758733771441881
Energy: 0.7795441945445378
Energy: 0.7758733771446964
Energy: 0.779544194545046
Energy: 0.7758733771452045
Energy: 0.8191392994456593
Energy: 0.831531239225133
Energy: 0.8191392994466759
Energy: 0.831531239225133
Energy: 0.8191392994461677
Energy: 0.8315312392261492
Energy: 0.7965104936556485
Energy: 0.853827302597105
Energy: 0.7965104936602223
Energy: 0.853827302597105
Energy: 0.7965104936556485
Energy: 0.853827302597105
Energy: 0.8119745305555008
Energy: 0.776213674789611
Energy: 0.8119745305544844
Energy: 0.776213674789611
Energy: 0.8119745305555008
Energy: 0.7762136747906275
Energy: 0.7894041105345265
Energy: 0.8800593561954673
Energy: 0.7894041105345265
Energy: 0.880059356194959
Energy: 0.7894041105350347
Energy: 0.8800593561954673
Energy: 0.8200563034791363
Energy: 0.8590888653383
Energy: 0.8200563034781199
Energy: 0.8590888653377919
Energy: 0.8200563034776116
Energy: 0.8590888653377919
Energy: 0.8730823162164867
Energy: 0.8119477047835324
Energy: 0.873082316217503
Energy: 0.8119477047830241
Energy: 0.8730823162164867
Energy: 0.8119477047840407
Energy: 0.8101543240417078
Energy: 0.8038370230783201
Energy: 0.810154324044249
Energy: 0.8038370230773038
Energy: 0.8101543240427242
Energy: 0.8038370230778119
Energy: 0.9289970506733982
Energy: 0.8782942926468644
Energy: 0.9289970506733982
Energy: 0.8782942926468644
Energy: 0.9289970506733982
Energy: 0.8782942926463563
Energy: 0.8326601421458008
Energy: 0.9200132627973784
Energy: 0.8326601421447843
Energy: 0.9200132627973784
Energy: 0.8326601421524072
Energy: 0.9200132627978865
Energy: 0.8310869816706964
Energy: 0.7624122199071015
Energy: 0.8310869816706964
Energy: 0.7624122199060851
Energy: 0.8310869816706964
Energy: 0.7624122199050688
Energy: 0.7697855836243098
Energy: 0.8509879784028878
Energy: 0.7697855836253261
Energy: 0.8509879784018712
Energy: 0.769785583624818
Energy: 0.8509879784018712
Energy: 0.8600804408446072
Energy: 0.8702074448041559
Energy: 0.8600804408456236
Energy: 0.8702074448036478
Energy: 0.8511720149495534
Energy: 0.8702074448041559
Energy: 0.7891745227209587
Energy: 0.7602968756983388
Energy: 0.7891745227204505
Energy: 0.7602968756983388
Energy: 0.789174522721975
Energy: 0.7602968756983388
Energy: 0.7686787229205154
Energy: 0.8055598411576845
Energy: 0.7686787229210236
Energy: 0.8055598411576845
Energy: 0.7686787229200072
Energy: 0.8055598411576845
Energy: 0.7768630153294822
Energy: 0.8458767861586383
Energy: 0.7768630153294822
Energy: 0.8458767861576217
Energy: 0.7768630153299905
Energy: 0.8458767861586383
Energy: 0.7624868753616012
Energy: 1.0676594027992594
Energy: 0.762486875361093
Energy: 1.067659402797781
Energy: 0.762486875361093
Energy: 1.067659402797781
Energy: 0.7693459904244774
Energy: 0.7695226449850839
Energy: 0.7693459904239692
Energy: 0.7695226449855921
Energy: 0.7693459904239692
Energy: 0.7695226449855921
Energy: 0.7491384572836532
Energy: 0.762811606529692
Energy: 0.7491384572846697
Energy: 0.7628116065291839
Energy: 0.7491384572816205
Energy: 0.762811606529692
Energy: 0.8885848509375989
Energy: 0.9644537916487388
Energy: 0.8885848509370905
Energy: 0.9644537916492468
Energy: 0.8885848509386152
Energy: 0.9644537916492468
Energy: 0.7705650852631463
Energy: 0.7446756695077444
Energy: 0.7705650852636544
Energy: 0.7446756695087607
Energy: 0.7705650852646708
Energy: 0.7446756695077444
Energy: 0.69410832482222
Energy: 0.7626848058111466
Energy: 0.6941083248232364
Energy: 0.7626848058116548
Energy: 0.6941083248217117
Energy: 0.7626848058111466

minimum gb energy = 0.6941083248217117 eV
minimum distance =  2.27173525055501 Angstroms
sigma value = 81


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

Energy: 0.08668721827180335
Energy: 0.13703938717693315
Energy: 0.08668721827180335
Energy: 0.13703938717693315
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.8854190397749625
Energy: 0.0878708243141514
Energy: 0.8854190397749625
Energy: 0.08787082431228416
Energy: 0.8854190397730952
Energy: 0.08787082431041691
Energy: 0.885420386302413
Energy: 0.08748585531327577
Energy: 0.885420386302413
Energy: 0.0874858553095413
Energy: 0.885420386302413
Energy: 0.08748585531140854
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.8854190397749625
Energy: 0.08787082430854969
Energy: 0.8854190397749625
Energy: 0.08787082431041691
Energy: 0.8854190397730952
Energy: 0.08787082431228416
Energy: 0.885420386302413
Energy: 0.08748585531327577
Energy: 0.885420386302413
Energy: 0.08748585531327577
Energy: 0.885420386302413
Energy: 0.08748585531327577
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.08668721827367058
Energy: 0.13703938717506595
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.8854190397730952
Energy: 0.08787082430668246
Energy: 0.8854190397730952
Energy: 0.08787082431041691
Energy: 0.8854190397730952
Energy: 0.08787082430854969
Energy: 0.885420386302413
Energy: 0.08748585531327577
Energy: 0.885420386302413
Energy: 0.0874858553095413
Energy: 0.885420386302413
Energy: 0.08748585530767408
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.08668721827367058
Energy: 0.13703938717693315
Energy: 0.08668721827367058
Energy: 0.13703938717693315

minimum gb energy = 0.08668721827180335 eV
minimum distance =  2.46549054586267 Angstroms
sigma value = 3


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

Energy: 0.9376267957319809
Energy: 0.7751274999599306
Energy: 0.9376267957319809
Energy: 0.7751274999599306
Energy: 0.9376267957319809
Energy: 0.7751274999593718
Energy: 0.7828001216619097
Energy: 0.8057301257018881
Energy: 0.7828001216607922
Energy: 0.8057301257030056
Energy: 0.7828001216619097
Energy: 0.8057301257013292
Energy: 0.8142405900057511
Energy: 0.8058095858129946
Energy: 0.81424059000631
Energy: 0.8058095858141121
Energy: 0.8142405900057511
Energy: 0.805809585814671
Energy: 0.8815399700665967
Energy: 0.7950859366152269
Energy: 0.8815399700671552
Energy: 0.7950859366146681
Energy: 0.8815399700665967
Energy: 0.7950859366152269
Energy: 0.6673954998749385
Energy: 0.7861382065044717
Energy: 0.6673954998743797
Energy: 0.7861382065027955
Energy: 0.6673954998743797
Energy: 0.78613820657823
Energy: 0.8215902445888986
Energy: 0.8628118541335164
Energy: 0.8215902445888986
Energy: 0.8628118541329577
Energy: 0.8215902445900161
Energy: 0.8628118541307224
Energy: 0.8349882101229913
Energy: 0.8786774155842265
Energy: 0.8349882101241088
Energy: 0.8786774155847854
Energy: 0.8349882101246677
Energy: 0.8786774155842265
Energy: 0.6629566074527469
Energy: 0.785942678638008
Energy: 0.6629566074527469
Energy: 0.7859426786385668
Energy: 0.6629566074521881
Energy: 0.7859426786352143
Energy: 0.8349835878715348
Energy: 0.8412464342826994
Energy: 0.8349835878715348
Energy: 0.8412464342877283
Energy: 0.8349835878709759
Energy: 0.8412464342866108
Energy: 0.7607992951036543
Energy: 0.8188737369825544
Energy: 0.7607992951014192
Energy: 0.8188737369808783
Energy: 0.7607992950952728
Energy: 0.8188737369797607
Energy: 0.7187848728178732
Energy: 0.7884645800609362
Energy: 0.7187848728173143
Energy: 0.7884645800620538
Energy: 0.7187848728167555
Energy: 0.788464580061495
Energy: 0.8641737991804237
Energy: 0.8714583454825278
Energy: 0.864173799179865
Energy: 0.8714583454830863
Energy: 0.864173799179865
Energy: 0.8714583454830863
Energy: 0.7946707323231803
Energy: 0.800622560419201
Energy: 0.7946707323287172
Energy: 0.8006225604197598
Energy: 0.7946707323248565
Energy: 0.800622560419201
Energy: 0.736802732294824
Energy: 0.847459926566582
Energy: 0.7368027322937064
Energy: 0.847459926566582
Energy: 0.7368027322886774
Energy: 0.8474599265676994
Energy: 0.8806827307472789
Energy: 0.838586699470526
Energy: 0.8806827307478375
Energy: 0.8385866994699671
Energy: 0.8806827307472789
Energy: 0.838586699470526
Energy: 0.7653363248349213
Energy: 0.6624802465898937
Energy: 0.7653363248349213
Energy: 0.6624802465893349
Energy: 0.7653363248354801
Energy: 0.6624802465893349
Energy: 0.7886507128808816
Energy: 0.8714745968345909
Energy: 0.788650712880323
Energy: 0.8714745968340323
Energy: 0.7886507128808816
Energy: 0.8714745968345909
Energy: 0.8245889128649104
Energy: 0.8102634435091315
Energy: 0.8245889128637928
Energy: 0.8102634435096903
Energy: 0.8245889128637928
Energy: 0.8102634435096903
Energy: 0.8249333075411349
Energy: 0.9003644943059292
Energy: 0.8249333075422526
Energy: 0.9003644943070467
Energy: 0.8249333075439289
Energy: 0.9003644943059292
Energy: 0.772716065660295
Energy: 0.9192935152456917
Energy: 0.7727160656608538
Energy: 0.9192935152451328
Energy: 0.7727160656614126
Energy: 0.9192935152451328
Energy: 0.8620213663032977
Energy: 0.7874645658382003
Energy: 0.8620213663032977
Energy: 0.7874645658370828
Energy: 0.8620213663044152
Energy: 0.7874645658376416
Energy: 0.847799220425835
Energy: 0.7859577219063836
Energy: 0.8477992200934656
Energy: 0.7859577219063836
Energy: 0.8477992190440368
Energy: 0.7859577219069424
Energy: 0.7978971130045498
Energy: 0.8974931499943427
Energy: 0.7978971130067849
Energy: 0.8974931499954603
Energy: 0.7978971130062262
Energy: 0.8974931499949016
Energy: 0.8156146370634254
Energy: 0.7849535177173756
Energy: 0.8156146370651018
Energy: 0.7849535177184933
Energy: 0.8156146370656604
Energy: 0.7849535177184933
Energy: 0.877547508701674
Energy: 0.8188073240864612
Energy: 0.8775475087027915
Energy: 0.8188073240870201
Energy: 0.8775475087027915
Energy: 0.818807324089255
Energy: 0.7603273200906929
Energy: 0.8573571646962721
Energy: 0.7603273200867815
Energy: 0.8573571646945957
Energy: 0.7603273200890167
Energy: 0.8573571647007422
Energy: 0.917770441822536
Energy: 0.6728405673036267
Energy: 0.9177704418230948
Energy: 0.6728405673041855
Energy: 0.9177704418214184
Energy: 0.6728405673041855
Energy: 0.834882405704435
Energy: 0.8345444582006224
Energy: 0.8348824057021997
Energy: 0.8345444582000635
Energy: 0.8348824057038761
Energy: 0.8345444582006224
Energy: 0.7352503540594252
Energy: 0.7854708228833349
Energy: 0.735250354059984
Energy: 0.7854708228850111
Energy: 0.735250354059984
Energy: 0.7854708228838937
Energy: 0.9122354013731002
Energy: 0.7345605177760869
Energy: 0.9122354013725413
Energy: 0.7345605177760869
Energy: 0.9122354013719826
Energy: 0.7345605177749694
Energy: 0.8621862823849489
Energy: 0.8280519428091592
Energy: 0.8621862823849489
Energy: 0.8280519428086004
Energy: 0.8621862823855075
Energy: 0.8280519428102767
Energy: 0.816244377199112
Energy: 0.7744451055012731
Energy: 0.8162443771979944
Energy: 0.774445105496244
Energy: 0.816244377199112
Energy: 0.7744451054979204
Energy: 0.8379444827688595
Energy: 0.8852697741351806
Energy: 0.837944482769977
Energy: 0.8852697741351806
Energy: 0.8379444827694184
Energy: 0.8852697741346219

minimum gb energy = 0.6624802465893349 eV
minimum distance =  2.33378505587489 Angstroms
sigma value = 67


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

Energy: 1.0869754639204134
Energy: 0.9499730768167198
Energy: 1.086975463918025
Energy: 0.9499730768159237
Energy: 1.086975463919617
Energy: 0.9499730768159237
Energy: 0.9479453517102115
Energy: 0.973531234054865
Energy: 0.9479453517102115
Energy: 0.973531234054865
Energy: 0.9479453517094154
Energy: 0.9735312340524764
Energy: 1.0158343931586076
Energy: 0.9845997864369811
Energy: 1.0158343931578115
Energy: 0.9845997864377772
Energy: 1.0158343931578115
Energy: 0.9845997864377772
Energy: 1.039637241940113
Energy: 0.9346999922666547
Energy: 1.0396372419385207
Energy: 0.9346999922650624
Energy: 1.039637241940113
Energy: 0.9346999922602852
Energy: 0.8275404641784481
Energy: 0.9280970917371251
Energy: 0.8275404641792442
Energy: 0.9280970917387174
Energy: 0.8275404641784481
Energy: 0.9280970917387174
Energy: 1.016984368494181
Energy: 1.0173678658261933
Energy: 1.016984368494181
Energy: 1.0173678658253968
Energy: 1.016984368494181
Energy: 1.0173678658261933
Energy: 0.941157115274595
Energy: 1.038029068306018
Energy: 0.941157115274595
Energy: 1.0380290683044258
Energy: 0.9411571152753913
Energy: 1.038029068306814
Energy: 0.9136399639331582
Energy: 0.9178376553521099
Energy: 0.9136399639275846
Energy: 0.9178376553529063
Energy: 0.91363996394112
Energy: 0.9178376553529063
Energy: 1.0773127094763872
Energy: 1.067680584015619
Energy: 1.077312709475591
Energy: 1.067680584015619
Energy: 1.077312709475591
Energy: 1.067680584015619
Energy: 0.9405441071549163
Energy: 1.0159970601854373
Energy: 0.9405441071541201
Energy: 1.0159970601854373
Energy: 0.9405441071557125
Energy: 1.0159970601854373
Energy: 1.0438909050335026
Energy: 1.0168427157706446
Energy: 1.0438909050335026
Energy: 1.0168427157706446
Energy: 1.0438909050327063
Energy: 1.0168427157706446
Energy: 0.9463323474126087
Energy: 0.9995276489287453
Energy: 0.9463323474142011
Energy: 0.9995276489279491
Energy: 0.9463323474142011
Energy: 0.9995276489279491
Energy: 0.9455314643796331
Energy: 0.9337200356170676
Energy: 0.9455314643860027
Energy: 0.9337200356170676
Energy: 0.9455314643804292
Energy: 0.9337200356178637
Energy: 0.9324662258634004
Energy: 1.0442654431168388
Energy: 0.932466225865789
Energy: 1.0442654431168388
Energy: 0.9324662258649928
Energy: 1.0442654431160425
Energy: 0.9569781384520527
Energy: 0.9440704116320014
Energy: 0.9569781384528491
Energy: 0.9440704116320014
Energy: 0.9569781384528491
Energy: 0.9440704116320014
Energy: 0.9734461865922721
Energy: 0.9685466841919873
Energy: 0.9734461865922721
Energy: 0.9685466841911913
Energy: 0.9734461865906797
Energy: 0.9685466841911913
Energy: 0.971340453945824
Energy: 1.0341046445209523
Energy: 0.9713404539442316
Energy: 1.0341046445209523
Energy: 0.971340453945824
Energy: 1.0341046445201558
Energy: 0.982098486933942
Energy: 0.9271309718850509
Energy: 0.982098486933942
Energy: 0.9271309718850509
Energy: 0.9820984869347381
Energy: 0.9271309718850509
Energy: 1.0223130440742363
Energy: 1.0209488310408759
Energy: 1.0223130440758286
Energy: 1.0209488310400796
Energy: 1.0223130440742363
Energy: 1.0209488310400796
Energy: 1.0797144258516544
Energy: 0.9279558667131066
Energy: 1.0797144258516544
Energy: 0.9279558667123105
Energy: 1.0797144258508582
Energy: 0.9279558667131066
Energy: 1.116537442812878
Energy: 0.9402636195251809
Energy: 1.116537442812878
Energy: 0.940263619525977
Energy: 1.1165374428136743
Energy: 0.940263619525977
Energy: 1.0453364069612683
Energy: 1.1081817793385773
Energy: 1.0453364069612683
Energy: 1.1081817793377813
Energy: 1.045336406960472
Energy: 1.1081817793377813
Energy: 1.047323459234545
Energy: 0.9287341576213045
Energy: 1.0133421898759698
Energy: 0.9287341576197121
Energy: 1.0133421898759698
Energy: 0.9287341576205084

minimum gb energy = 0.8275404641784481 eV
minimum distance =  2.33001344273546 Angstroms
sigma value = 33


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

Energy: 1.245780583901621
Energy: 1.0682459021908264
Energy: 1.1934766536211665
Energy: 1.0682459021862805
Energy: 1.2457805839006106
Energy: 1.0682459021862805
Energy: 1.093397734679048
Energy: 1.1181275665172705
Energy: 1.0933977346765227
Energy: 1.1181275665213113
Energy: 1.0933977346800583
Energy: 1.1181275665213113
Energy: 1.1277901617966353
Energy: 1.1069494706586784
Energy: 1.1277901617961303
Energy: 1.1069494706596887
Energy: 1.1277901617971404
Energy: 1.1069494706591836
Energy: 1.1643229516575482
Energy: 1.0904169234627943
Energy: 1.164322951650982
Energy: 1.0904169234612788
Energy: 1.1643229516545177
Energy: 1.0904169234607737
Energy: 1.0896494249153799
Energy: 1.0681067853314756
Energy: 1.0896494249174
Energy: 1.0681067853345063
Energy: 1.0896494249153799
Energy: 1.0681067853345063
Energy: 1.2319247611286328
Energy: 1.0901532818046658
Energy: 1.2319247611291377
Energy: 1.2298542008693165
Energy: 1.231924761130653
Energy: 1.0901532818041604
Energy: 1.047308601249107
Energy: 1.0127370483750155
Energy: 1.047308601252643
Energy: 1.0127370483785512
Energy: 1.047308601253653
Energy: 1.0127370483785512
Energy: 1.1821069137279814
Energy: 1.1442233018136236
Energy: 1.1821069137330324
Energy: 1.1442233018166543
Energy: 1.1821069137335374
Energy: 1.1442233018166543
Energy: 1.0975355112464722
Energy: 1.136882133628069
Energy: 1.0975171507681927
Energy: 1.1368821336300894
Energy: 1.0975355112404113
Energy: 1.1368821336310995
Energy: 1.1116449881020303
Energy: 1.1051179998249459
Energy: 1.1116449881010202
Energy: 1.105117999826966
Energy: 1.111644988104051
Energy: 1.0845762817413458
Energy: 1.1683055490580376
Energy: 1.168114695977225
Energy: 1.1683156735314104
Energy: 1.168114695976215
Energy: 1.1683055490585428
Energy: 1.168114695976215
Energy: 1.0484756721495243
Energy: 1.114354564557544
Energy: 1.0484756721464938
Energy: 1.1143545645509778
Energy: 1.048475672140938
Energy: 1.1143545645509778
Energy: 1.1955139178619718
Energy: 1.0723150136618926
Energy: 1.1955139178584364
Energy: 1.0723150136659334
Energy: 1.1955139178584364
Energy: 1.0723150136664383
Energy: 1.1169593788003738
Energy: 1.1719712019296664
Energy: 1.1169593787978485
Energy: 1.1719712019326973
Energy: 1.1169593787943126
Energy: 1.1719712019321922
Energy: 1.0815058225076266
Energy: 1.1139585130532141
Energy: 1.0815058225101521
Energy: 1.1139585130486684
Energy: 1.081505822513688
Energy: 1.1139585130486684
Energy: 1.1607994808266535
Energy: 1.1088089493602693
Energy: 1.160799480822613
Energy: 1.1088089493632998
Energy: 1.1607994808221078
Energy: 1.1088089493607745
Energy: 1.2037337523469753
Energy: 1.0639667135584052
Energy: 1.2037337523424296
Energy: 1.0639667135649713
Energy: 1.2037337523424296
Energy: 1.0639667135664865
Energy: 1.162875833606548
Energy: 1.2046585810181547
Energy: 1.1628758336090732
Energy: 1.2046585810237105
Energy: 1.1628758336080631
Energy: 1.2046585810227004
Energy: 1.0465875178187345
Energy: 1.1588986207718726
Energy: 1.0465875178217652
Energy: 1.1588986194764141
Energy: 1.04658751782126
Energy: 1.158898618823106
Energy: 1.2372754113368012
Energy: 1.0750103355843064
Energy: 1.2372754113403368
Energy: 1.0750103355797607
Energy: 1.2372754113398317
Energy: 1.0750103355797607
Energy: 1.127027847851127
Energy: 1.2167318578590902
Energy: 1.1263934137572063
Energy: 1.2167318578590902
Energy: 1.1270278478460762
Energy: 1.2167318578601005
Energy: 1.088287330871099
Energy: 1.0795899293521896
Energy: 1.0882873308736245
Energy: 1.0795899293501692
Energy: 1.088287330871099
Energy: 1.0795899293501692
Energy: 1.1672428248769666
Energy: 1.1669619659472805
Energy: 1.0739404079347492
Energy: 1.166961965951321
Energy: 1.167242824874946
Energy: 1.166961965951321
Energy: 1.1885475216617754
Energy: 1.110762950615981
Energy: 1.1415053816533696
Energy: 1.1107629506149708
Energy: 1.1885475216622805
Energy: 1.1107629506144656
Energy: 1.0930074717648406
Energy: 1.1042061277225617
Energy: 1.0482696113483072
Energy: 1.1042061277210462
Energy: 1.0930074717698914
Energy: 1.1042061277215514
Energy: 1.1417370733341696
Energy: 1.1751859659361827
Energy: 1.1417370733296237
Energy: 1.1751859659341621
Energy: 1.141737073325078
Energy: 1.1751859659341621
Energy: 1.0480011658060824
Energy: 1.075472674211155
Energy: 1.0480011658065875
Energy: 1.0754726742035785
Energy: 1.0480011658055775
Energy: 1.0754726742035785
Energy: 1.1270713486435742
Energy: 1.2178836804941868
Energy: 1.127071348642564
Energy: 1.2178836804916613
Energy: 1.1270713486380182
Energy: 1.2113135593900535
Energy: 1.1254285293075847
Energy: 1.075528642040162
Energy: 1.1254285293151607
Energy: 1.0755286420371313
Energy: 1.1254285293141506
Energy: 1.0755286420371313
Energy: 1.0457478831475564
Energy: 1.0458569911948685
Energy: 1.0457478831480616
Energy: 1.045856991202445
Energy: 1.0457478831515972
Energy: 1.0458569911994144
Energy: 1.2378973868051604
Energy: 1.220469690602161
Energy: 1.2378973868092011
Energy: 1.2204696906062018
Energy: 1.2378973868102112
Energy: 1.2204696906062018
Energy: 1.052440770307936
Energy: 1.0748357414041216
Energy: 1.0522944622221886
Energy: 1.074835741401596
Energy: 1.0524407703044005
Energy: 1.0748357414036163
Energy: 1.1608822882279353
Energy: 1.2312258405381236
Energy: 1.160884807449313
Energy: 1.2312258405366083
Energy: 1.16088228822743
Energy: 1.2312258405361032
Energy: 1.1486286446081864
Energy: 1.11815405282505
Energy: 1.1486286446021254
Energy: 1.1181540528320753
Energy: 1.1486286446006102
Energy: 1.1181540528320753
Energy: 1.0529926744115299
Energy: 1.1068456912848492
Energy: 1.0529926744115299
Energy: 1.1068456912843443
Energy: 1.0529926744155707
Energy: 1.106845691283334
Energy: 1.196592642883825
Energy: 1.0707670432609895
Energy: 1.196592642883825
Energy: 1.0707670432604843
Energy: 1.1965926428848352
Energy: 1.0707670432604843
Energy: 1.0948891746144536
Energy: 1.11808952226391
Energy: 1.0948891746099076
Energy: 1.118089522270476
Energy: 1.0948891746078875
Energy: 1.1180895222699712

minimum gb energy = 1.0127370483750155 eV
minimum distance =  2.18156407820967 Angstroms
sigma value = 41


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

Energy: 1.3174632464533773
Energy: 1.2068295946717955
Energy: 1.3174632464533773
Energy: 1.2068295946717955
Energy: 1.3174632464533773
Energy: 1.2068295946717955
Energy: 1.1993974503370108
Energy: 1.2497845127769203
Energy: 1.1993974503370108
Energy: 1.2497845127769203
Energy: 1.1993974503356315
Energy: 1.2497845127769203
Energy: 1.399360389067508
Energy: 1.3030651365305252
Energy: 1.3936148436420688
Energy: 1.3030651365319044
Energy: 1.3936148436420688
Energy: 1.3030651365319044
Energy: 1.275505150989285
Energy: 1.33061469004423
Energy: 1.275505150989285
Energy: 1.33061469004423
Energy: 1.275505150989285
Energy: 1.3306146900428508
Energy: 1.3204579243733314
Energy: 1.2380090828376333
Energy: 1.3204579243733314
Energy: 1.2380090828376333
Energy: 1.3204579243733314
Energy: 1.2380090828376333
Energy: 1.3751334848366497
Energy: 1.343462455296469
Energy: 1.3751334848394077
Energy: 1.3434624552950896
Energy: 1.3751334848394077
Energy: 1.3434624552950896
Energy: 1.2841372827171107
Energy: 1.1903326335108828
Energy: 1.2841372827171107
Energy: 1.1903326335122617
Energy: 1.2841372827171107
Energy: 1.1903326335108828
Energy: 1.2775118234289649
Energy: 1.2785102000258057
Energy: 1.2775118234289649
Energy: 1.2785102000258057
Energy: 1.2775118234289649
Energy: 1.2785102000258057
Energy: 1.2035051231833935
Energy: 1.206085366849919
Energy: 1.2035051231833935
Energy: 1.206085366849919
Energy: 1.2035051231847727
Energy: 1.206085366849919
Energy: 1.3390701670723033
Energy: 1.2119244178968787
Energy: 1.3390701670736824
Energy: 1.2119244178968787
Energy: 1.3390701670736824
Energy: 1.2119244178968787
Energy: 1.2011381760868654
Energy: 1.2869441657392364
Energy: 1.2011381760882442
Energy: 1.2869441657378575
Energy: 1.2011381760868654
Energy: 1.2869441657378575
Energy: 1.2646138458171594
Energy: 1.2487302701878231
Energy: 1.2646138458171594
Energy: 1.248730270189202
Energy: 1.2646138458171594
Energy: 1.2487302701878231
Energy: 1.3028824384442679
Energy: 1.3306596944245779
Energy: 1.3028824384442679
Energy: 1.330659694423199
Energy: 1.3028824384456468
Energy: 1.3306596944218196
Energy: 1.3176735348348605
Energy: 1.2504740273900032
Energy: 1.3176735348348605
Energy: 1.2504740273900032
Energy: 1.3176735348348605
Energy: 1.2504740273900032

minimum gb energy = 1.1903326335108828 eV
minimum distance =  2.23389450016464 Angstroms
sigma value = 11


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

Energy: 1.462116929678569
Energy: 1.4356326300834172
Energy: 1.4621169296773573
Energy: 1.4356326300834172
Energy: 1.462116929678569
Energy: 1.4356326300834172
Energy: 1.3221187727422616
Energy: 1.417636650415946
Energy: 1.3221187727434733
Energy: 1.417636650415946
Energy: 1.3221187727428674
Energy: 1.417636650415946
Energy: 1.4605273838666353
Energy: 1.4090350059895063
Energy: 1.460527383867847
Energy: 1.4090350059895063
Energy: 1.4101760410932282
Energy: 1.4090350059895063
Energy: 1.406132535227415
Energy: 1.3517970332686944
Energy: 1.406132535227415
Energy: 1.3517970332693003
Energy: 1.406132535227415
Energy: 1.3517970332693003
Energy: 1.4432677408186032
Energy: 1.3844648732536398
Energy: 1.4432677408173917
Energy: 1.3844648732536398
Energy: 1.4432677408186032
Energy: 1.3844648732536398
Energy: 1.3661844554485625
Energy: 1.4216661978993372
Energy: 1.3661844554485625
Energy: 1.4216661978987315
Energy: 1.3661844554491682
Energy: 1.4216661978987315
Energy: 1.4040158150943705
Energy: 1.400092860143969
Energy: 1.4040158150943705
Energy: 1.400092860143969
Energy: 1.4040158150949762
Energy: 1.400092860143969
Energy: 1.3824873861062223
Energy: 1.4051257982984076
Energy: 1.3824873861068283
Energy: 1.4051257982971959
Energy: 1.3824873861068283
Energy: 1.4051257982971959
Energy: 1.405212810819826
Energy: 1.3817171810728022
Energy: 1.4052128108204316
Energy: 1.3817171810728022
Energy: 1.4052128108192203
Energy: 1.3817171810734081
Energy: 1.3817917265058726
Energy: 1.4190069673141323
Energy: 1.3817917265058726
Energy: 1.4190069673135264
Energy: 1.3817917265058726
Energy: 1.4190069673135264
Energy: 1.3819174399258989
Energy: 1.4039536822479823
Energy: 1.3819174399258989
Energy: 1.4039536822479823
Energy: 1.3819174399258989
Energy: 1.4039536822479823
Energy: 1.4102412456052895
Energy: 1.4315408072163573
Energy: 1.4102412456052895
Energy: 1.431540807217569
Energy: 1.4102412456071067
Energy: 1.431540807217569
Energy: 1.4142756067262012
Energy: 1.3752721286950114
Energy: 1.4142756067262012
Energy: 1.3752721286950114
Energy: 1.4142756067262012
Energy: 1.3752721286950114
Energy: 1.3786359542852744
Energy: 1.4380558126150287
Energy: 1.3786359542840632
Energy: 1.438055812614423
Energy: 1.3786359542858804
Energy: 1.4380558126150287
Energy: 1.3590959693548128
Energy: 1.3741484907474995
Energy: 1.3590959693554185
Energy: 1.3741484907474995
Energy: 1.3590959693554185
Energy: 1.3741484907468937
Energy: 1.3976672289068774
Energy: 1.3998726618474322
Energy: 1.3976672289062717
Energy: 1.399872661848644
Energy: 1.3976672289068774
Energy: 1.3998726618492496
Energy: 1.3414722505281356
Energy: 1.4136368880627381
Energy: 1.3414722505281356
Energy: 1.4136368880633439
Energy: 1.3414722505275296
Energy: 1.4136368880627381
Energy: 1.4583262670111916
Energy: 1.448409592412623
Energy: 1.4583262670117976
Energy: 1.4484086894989174
Energy: 1.4583262670117976
Energy: 1.4484071058984058
Energy: 1.36303438814596
Energy: 1.3308545561134548
Energy: 1.36303438814596
Energy: 1.3308545561134548
Energy: 1.36303438814596
Energy: 1.3308545561134548
Energy: 1.4119653742174563
Energy: 1.386225860327163
Energy: 1.411965374218062
Energy: 1.386225860327163
Energy: 1.4119653742168505
Energy: 1.386225860327163
Energy: 1.3329260544595303
Energy: 1.3592591594786443
Energy: 1.332926054460136
Energy: 1.3592591594786443
Energy: 1.332926054460136
Energy: 1.3592591594786443
Energy: 1.4830119964717512
Energy: 1.4342553453325935
Energy: 1.4830119964717512
Energy: 1.4342553453338052
Energy: 1.4830119964711452
Energy: 1.4342553453331992
Energy: 1.3857623314305454
Energy: 1.4093916907616064
Energy: 1.3857623314305454
Energy: 1.4093916907616064
Energy: 1.3857623314299397
Energy: 1.4093916907616064
Energy: 1.4466054108541635
Energy: 1.4170924028551883
Energy: 1.4466054108541635
Energy: 1.4170924028551883
Energy: 1.4466054108547692
Energy: 1.4170924028545824
Energy: 1.3771315735719127
Energy: 1.3934093155520566
Energy: 1.3771315735719127
Energy: 1.3934093155514506
Energy: 1.3771315735719127
Energy: 1.3934093155514506
Energy: 1.3786019041153625
Energy: 1.389160330154364
Energy: 1.3786019041153625
Energy: 1.389160330154364
Energy: 1.3786019041147568
Energy: 1.389160330154364
Energy: 1.3646512318849706
Energy: 1.4393528384772722
Energy: 1.3646512318843649
Energy: 1.4393528384766663
Energy: 1.3646512318843649
Energy: 1.4393528384772722
Energy: 1.4247912616422969
Energy: 1.357454836093574
Energy: 1.4247912616416911
Energy: 1.357454836093574
Energy: 1.4247912616416911
Energy: 1.357454836093574
Energy: 1.3798670188608195
Energy: 1.4504889162437766
Energy: 1.3798670188614255
Energy: 1.4504889162437766
Energy: 1.3798670188608195
Energy: 1.4504889162437766
Energy: 1.3616582876736711
Energy: 1.3150234386717594
Energy: 1.3616582876724594
Energy: 1.3150234386717594
Energy: 1.3616582876730654
Energy: 1.3150234386717594
Energy: 1.3889714254505454
Energy: 1.4473931936906792
Energy: 1.3889714254511512
Energy: 1.447393193691285
Energy: 1.3889714254511512
Energy: 1.4473931936906792

minimum gb energy = 1.3150234386717594 eV
minimum distance =  2.20744884205851 Angstroms
sigma value = 57


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

Energy: 1.3434951387563214
Energy: 1.325045868690954
Energy: 1.3434951387563214
Energy: 1.325045868690954
Energy: 1.3434951387563214
Energy: 1.325045868690954
Energy: 1.4267632896625424
Energy: 1.4077598543221752
Energy: 1.4267632896636202
Energy: 1.4077598543221752
Energy: 1.4267632896625424
Energy: 1.4077598543221752
Energy: 1.4307663677820064
Energy: 1.3850512859265287
Energy: 1.4307663677830842
Energy: 1.3850512859265287
Energy: 1.4307663677820064
Energy: 1.385051285927607
Energy: 1.3609577474922536
Energy: 1.48771805255712
Energy: 1.3609577474922536
Energy: 1.4877180525560418
Energy: 1.3609577474922536
Energy: 1.487718052558198
Energy: 1.4306279335551808
Energy: 1.3850727447858242
Energy: 1.4306279335562588
Energy: 1.3850727447847464
Energy: 1.4306279335551808
Energy: 1.3850727447858242
Energy: 1.4268795869757755
Energy: 1.4110244188167085
Energy: 1.4268795869757755
Energy: 1.4110244188167085
Energy: 1.4268795869768536
Energy: 1.4110244188167085
Energy: 1.3434951387584775
Energy: 1.325045868690954
Energy: 1.3434951387584775
Energy: 1.325045868690954
Energy: 1.3434951387584775
Energy: 1.325045868690954
Energy: 1.4267632896636202
Energy: 1.4077598543221752
Energy: 1.4267632896636202
Energy: 1.4077598543210972
Energy: 1.4267632896636202
Energy: 1.4077598543221752
Energy: 1.4307663677852402
Energy: 1.385051285927607
Energy: 1.4307663677852402
Energy: 1.385051285928685
Energy: 1.4307663677852402
Energy: 1.385051285928685
Energy: 1.3609577474933316
Energy: 1.48771805255712
Energy: 1.3609577474933316
Energy: 1.48771805255712
Energy: 1.3609577474933316
Energy: 1.48771805255712
Energy: 1.4306279335541028
Energy: 1.3850727447847464
Energy: 1.4306279335541028
Energy: 1.3850727447847464
Energy: 1.4306279335541028
Energy: 1.3850727447847464
Energy: 1.4268795869736195
Energy: 1.4110244188177863
Energy: 1.4268795869736195
Energy: 1.4110244188188645
Energy: 1.4268795869746975
Energy: 1.4110244188188645
Energy: 1.3434951387563214
Energy: 1.325045868690954
Energy: 1.3434951387563214
Energy: 1.325045868690954
Energy: 1.3434951387563214
Energy: 1.325045868690954
Energy: 1.4267632896636202
Energy: 1.4077598543200192
Energy: 1.4267632896625424
Energy: 1.407759854318941
Energy: 1.4267632896625424
Energy: 1.4077598543200192
Energy: 1.4307663677830842
Energy: 1.3850512859265287
Energy: 1.4307663677830842
Energy: 1.3850512859265287
Energy: 1.4307663677820064
Energy: 1.3850512859265287
Energy: 1.3609577474922536
Energy: 1.4877180525560418
Energy: 1.3609577474922536
Energy: 1.4877180525560418
Energy: 1.3609577474922536
Energy: 1.487718052558198
Energy: 1.4306279335551808
Energy: 1.3850727447858242
Energy: 1.4306279335551808
Energy: 1.3850727447858242
Energy: 1.4306279335562588
Energy: 1.3850727447858242

minimum gb energy = 1.325045868690954 eV
minimum distance =  2.26633889127554 Angstroms
sigma value = 9


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

Energy: 1.4405061293168302
Energy: 1.535520039639642
Energy: 1.4405061293168302
Energy: 1.5355200396387616
Energy: 1.4405061293168302
Energy: 1.5355200396387616
Energy: 1.470986102399903
Energy: 1.4491059108641353
Energy: 1.470986102400783
Energy: 1.4491059108632551
Energy: 1.470986102400783
Energy: 1.4491059108632551
Energy: 1.462006002727091
Energy: 1.4302997375954856
Energy: 1.4620060027235702
Energy: 1.4302997375954856
Energy: 1.4620060027253303
Energy: 1.4302997375954856
Energy: 1.4113686461115835
Energy: 1.5592742774589334
Energy: 1.4113686461107036
Energy: 1.5592742774589334
Energy: 1.4113686461115835
Energy: 1.559274277461574
Energy: 1.4490736286623824
Energy: 1.445411956354649
Energy: 1.4490736286632628
Energy: 1.445411956354649
Energy: 1.4490736286623824
Energy: 1.445411956354649
Energy: 1.4461340651532237
Energy: 1.4175484142122308
Energy: 1.4461340651523436
Energy: 1.4175484142131107
Energy: 1.4461340651532237
Energy: 1.4175484142131107
Energy: 1.4140677223540399
Energy: 1.4873838116368872
Energy: 1.4140677223540399
Energy: 1.4873838116360072
Energy: 1.4140677223540399
Energy: 1.4873838116368872
Energy: 1.4405151676401837
Energy: 1.4661634175978768
Energy: 1.4405151676401837
Energy: 1.4661634175969964
Energy: 1.440515167641064
Energy: 1.4661634175978768
Energy: 1.613725551550822
Energy: 1.4538279084284667
Energy: 1.6137255515490614
Energy: 1.4538279084284667
Energy: 1.6137255515490614
Energy: 1.4538279084284667
Energy: 1.4107057604170654
Energy: 1.4575081137510104
Energy: 1.4107057604161852
Energy: 1.4575081137501305
Energy: 1.4107057604170654
Energy: 1.4575081137510104
Energy: 1.442865769687655
Energy: 1.4623194055233513
Energy: 1.442865769687655
Energy: 1.4623194055233513
Energy: 1.442865769687655
Energy: 1.462319405522471
Energy: 1.5309376619205435
Energy: 1.4313902948465569
Energy: 1.5309376619223038
Energy: 1.4313902948465569
Energy: 1.5309376619223038
Energy: 1.4313902948465569
Energy: 1.4140943823539474
Energy: 1.4812499106139145
Energy: 1.4140943823539474
Energy: 1.4812499106139145
Energy: 1.4140943823548278
Energy: 1.4812499106139145
Energy: 1.4561278001031541
Energy: 1.5095602166751096
Energy: 1.4561278001022737
Energy: 1.5095602166751096
Energy: 1.4561278001040343
Energy: 1.5095602166751096
Energy: 1.4781161067608979
Energy: 1.428495331836637
Energy: 1.478116106761778
Energy: 1.428495331836637
Energy: 1.532423017969749
Energy: 1.4284953318357567
Energy: 1.4419877340918423
Energy: 1.4661401068326483
Energy: 1.4419877340892016
Energy: 1.4661401068317679
Energy: 1.4419877340918423
Energy: 1.4661401068317679
Energy: 1.4647364246830363
Energy: 1.4602065406253635
Energy: 1.4647364246830363
Energy: 1.4602065406253635
Energy: 1.4647364246839165
Energy: 1.4602065406253635
Energy: 1.6140078388680008
Energy: 1.430612819124794
Energy: 1.6140078388680008
Energy: 1.430612819124794
Energy: 1.6140078388671204
Energy: 1.430612819124794
Energy: 1.418313873652816
Energy: 1.4625495367736447
Energy: 1.418313873652816
Energy: 1.4625495367745247
Energy: 1.4183138736536962
Energy: 1.4625495367745247
Energy: 1.4197263060993925
Energy: 1.4745582599967078
Energy: 1.4197263060993925
Energy: 1.4745582599967078
Energy: 1.4197263061002727
Energy: 1.4745582599967078
Energy: 1.533188487982354
Energy: 1.4270817663619868
Energy: 1.5331884879832343
Energy: 1.4270817663619868
Energy: 1.533188487982354
Energy: 1.4270817663619868

minimum gb energy = 1.4107057604161852 eV
minimum distance =  2.2439470873991 Angstroms
sigma value = 27


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

Energy: 1.3955564919230794
Energy: 1.4487889463109682
Energy: 1.395556491923821
Energy: 1.4487889463109682
Energy: 1.3955564919230794
Energy: 1.4487889463109682
Energy: 1.407953475267733
Energy: 1.386168518422447
Energy: 1.4079534752684748
Energy: 1.386168518422447
Energy: 1.4079534752684748
Energy: 1.3861685184231891
Energy: 1.490668203703662
Energy: 1.3469164965706026
Energy: 1.49066820370292
Energy: 1.3469164965706026
Energy: 1.4906682037021781
Energy: 1.3469164965706026
Energy: 1.3300994154694765
Energy: 1.4496669397807866
Energy: 1.3300994154694765
Energy: 1.4496669397807866
Energy: 1.3300994154694765
Energy: 1.4496669397807866
Energy: 1.3813077162232696
Energy: 1.4192808215372856
Energy: 1.3813077162225278
Energy: 1.4192808215380277
Energy: 1.3813077162225278
Energy: 1.4192808215380277
Energy: 1.3885085100684207
Energy: 1.3301064738332176
Energy: 1.3885085100691628
Energy: 1.3301064738332176
Energy: 1.3885085100684207
Energy: 1.3301064738324757
Energy: 1.363727770156333
Energy: 1.4682479675457918
Energy: 1.3637277701570751
Energy: 1.4682479675457918
Energy: 1.363727770156333
Energy: 1.4682479675457918
Energy: 1.4520089242643583
Energy: 1.487503386284113
Energy: 1.4520089242636163
Energy: 1.4875033862848548
Energy: 1.4520089242643583
Energy: 1.487503386284113
Energy: 1.4353970624895511
Energy: 1.3301614213591615
Energy: 1.4353970624895511
Energy: 1.3301614213591615
Energy: 1.4353970624895511
Energy: 1.3301614213591615
Energy: 1.3301291729110218
Energy: 1.463573354240075
Energy: 1.3301291729125058
Energy: 1.4635733542408171
Energy: 1.330129172911764
Energy: 1.463573354240075
Energy: 1.3301278208587697
Energy: 1.4493059873755307
Energy: 1.3301278208587697
Energy: 1.4493059873755307
Energy: 1.3301278208587697
Energy: 1.4493059873755307
Energy: 1.4642119738489183
Energy: 1.3652503647577288
Energy: 1.4642119738489183
Energy: 1.3652503647577288
Energy: 1.464211973848176
Energy: 1.3652503647577288
Energy: 1.4462467793014964
Energy: 1.414889138640956
Energy: 1.4462467793014964
Energy: 1.414889138640956
Energy: 1.4462467793014964
Energy: 1.414889138640956
Energy: 1.3304199961962113
Energy: 1.4340318388775521
Energy: 1.3304199961954695
Energy: 1.4340318388775521
Energy: 1.3304199961954695
Energy: 1.4340318388775521
Energy: 1.38878857644339
Energy: 1.3300923592438694
Energy: 1.3887885764426482
Energy: 1.3300923592446114
Energy: 1.38878857644339
Energy: 1.3300923592446114
Energy: 1.3876421157184433
Energy: 1.3649470607922798
Energy: 1.3876421157177012
Energy: 1.364947060791538
Energy: 1.3876421157184433
Energy: 1.3649470607922798
Energy: 1.361192031793821
Energy: 1.4768962553555276
Energy: 1.361192031793821
Energy: 1.4768962553555276
Energy: 1.361192031793821
Energy: 1.4768962553555276
Energy: 1.4119599166929317
Energy: 1.348092351015844
Energy: 1.41195991669219
Energy: 1.3480923510151022
Energy: 1.41195991669219
Energy: 1.3480923510151022
Energy: 1.3833916158612802
Energy: 1.380518685466722
Energy: 1.383391615862022
Energy: 1.3805186854659803
Energy: 1.383391615862022
Energy: 1.3805186854659803
Energy: 1.3955564919245633
Energy: 1.4487889463117105
Energy: 1.3955564919245633
Energy: 1.4487889463117105
Energy: 1.395556491923821
Energy: 1.4487889463117105
Energy: 1.4079534752692169
Energy: 1.386168518422447
Energy: 1.4079534752692169
Energy: 1.386168518422447
Energy: 1.4079534752692169
Energy: 1.386168518422447
Energy: 1.490668203703662
Energy: 1.3469164965706026
Energy: 1.490668203703662
Energy: 1.3469164965706026
Energy: 1.490668203704404
Energy: 1.3469164965706026
Energy: 1.3300994154739283
Energy: 1.4496669397837547
Energy: 1.3300994154731862
Energy: 1.4496669397837547
Energy: 1.3300994154739283
Energy: 1.4496669397837547
Energy: 1.3813077162217857
Energy: 1.4192808215380277
Energy: 1.3813077162217857
Energy: 1.4192808215387696
Energy: 1.3813077162217857
Energy: 1.4192808215387696
Energy: 1.3885085100661947
Energy: 1.3301064738339594
Energy: 1.3885085100661947
Energy: 1.3301064738332176
Energy: 1.3885085100661947
Energy: 1.3301064738332176

minimum gb energy = 1.3300923592438694 eV
minimum distance =  2.29042606976441 Angstroms
sigma value = 19


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

Energy: 1.326287473408935
Energy: 1.5383670430495366
Energy: 1.3262874734095753
Energy: 1.5383670430495366
Energy: 1.3262874734082943
Energy: 1.5383670430495366
Energy: 1.4452020658125118
Energy: 1.3292375482529837
Energy: 1.4452020658131524
Energy: 1.3292375482529837
Energy: 1.4452020658125118
Energy: 1.3292375482529837
Energy: 1.5543460510617344
Energy: 1.2679034276494743
Energy: 1.4905182849761314
Energy: 1.2679034276494743
Energy: 1.4905182849761314
Energy: 1.2679034276494743
Energy: 1.2875743879617592
Energy: 1.462822091615283
Energy: 1.2875743879611186
Energy: 1.462822091615283
Energy: 1.2875743879611186
Energy: 1.462822091615283
Energy: 1.3701910957829782
Energy: 1.432459696531299
Energy: 1.3701910957823376
Energy: 1.4324596965319394
Energy: 1.3701910957823376
Energy: 1.4324596965319394
Energy: 1.4281201677130984
Energy: 1.2900285289426667
Energy: 1.4281201677137387
Energy: 1.2900285289420264
Energy: 1.428120167712458
Energy: 1.2900285289420264
Energy: 1.274148400968309
Energy: 1.425403069776518
Energy: 1.2741484009689494
Energy: 1.4254030697771585
Energy: 1.2741484009689494
Energy: 1.4254030697771585
Energy: 1.3348772146773833
Energy: 1.4311590285463986
Energy: 1.3348772146773833
Energy: 1.4311590285463986
Energy: 1.334877214676743
Energy: 1.4311590285470392
Energy: 1.5385787872402363
Energy: 1.2667020544499874
Energy: 1.538578787239596
Energy: 1.2667020544499874
Energy: 1.538578787239596
Energy: 1.2667020544499874
Energy: 1.3998874820873788
Energy: 1.3997775696019874
Energy: 1.3998874820880192
Energy: 1.3997775696019874
Energy: 1.3998874820867384
Energy: 1.3997775696019874
Energy: 1.268469113413679
Energy: 1.6120005622236788
Energy: 1.268469113413679
Energy: 1.6120005622243192
Energy: 1.2684691134130386
Energy: 1.6120005622236788
Energy: 1.5008189207499583
Energy: 1.2908137372211184
Energy: 1.5008189207499583
Energy: 1.2908137372211184
Energy: 1.5008189207493177
Energy: 1.2908137372211184
Energy: 1.3500860274579656
Energy: 1.3157879150257477
Energy: 1.3500860274579656
Energy: 1.315787915023826
Energy: 1.3500860274586057
Energy: 1.3157879150244667
Energy: 1.2881395436569805
Energy: 1.443529705206192
Energy: 1.28813954365634
Energy: 1.4435297052055516
Energy: 1.2881395436569805
Energy: 1.443529705206192
Energy: 1.463425329903439
Energy: 1.2677142792084373
Energy: 1.463425329903439
Energy: 1.2677142792084373
Energy: 1.4634253299027986
Energy: 1.2677142792084373
Energy: 1.4336110185477475
Energy: 1.2668940382275218
Energy: 1.43361101855095
Energy: 1.2668940382275218
Energy: 1.4336110185503095
Energy: 1.2668940382275218
Energy: 1.3024339065836033
Energy: 1.4710652082739002
Energy: 1.3024339065842436
Energy: 1.4710652082739002
Energy: 1.3024339065836033
Energy: 1.4710652082739002
Energy: 1.4143644480328565
Energy: 1.4011646629050591
Energy: 1.4143644480328565
Energy: 1.4011646629050591
Energy: 1.4143644480328565
Energy: 1.4011646629050591
Energy: 1.5073285280665718
Energy: 1.2881869177610181
Energy: 1.5073285280684934
Energy: 1.2881869177616585
Energy: 1.4746883964976476
Energy: 1.2881869177616585
Energy: 1.2890050865804294
Energy: 1.4613286610448095
Energy: 1.2890050865817102
Energy: 1.4613286610448095
Energy: 1.2890050865810698
Energy: 1.4613286610454501
Energy: 1.2720300840994363
Energy: 1.501382113354068
Energy: 1.272030084098796
Energy: 1.5013821133553489
Energy: 1.2720300840994363
Energy: 1.5013821133553489
Energy: 1.541837854706531
Energy: 1.290275938900634
Energy: 1.5418378545183247
Energy: 1.290275938900634
Energy: 1.5418378539543165
Energy: 1.290275938900634
Energy: 1.3769749837381113
Energy: 1.3313950527567304
Energy: 1.3769749837387517
Energy: 1.3313950527580114
Energy: 1.3769749837381113
Energy: 1.331395052757371
Energy: 1.3202738073911762
Energy: 1.4865408372038806
Energy: 1.3202738073911762
Energy: 1.48654083720324
Energy: 1.3202738073905358
Energy: 1.48654083720324
Energy: 1.4195553450628164
Energy: 1.2937757435989994
Energy: 1.419555345062176
Energy: 1.2937757435983588
Energy: 1.4195553450628164
Energy: 1.2937757435983588
Energy: 1.3334821239357015
Energy: 1.3007902238200293
Energy: 1.333482123935061
Energy: 1.3007902238200293
Energy: 1.3334821239357015
Energy: 1.300790223819389
Energy: 1.2645746939797946
Energy: 1.45499822672395
Energy: 1.2645746939797946
Energy: 1.45499822672395
Energy: 1.2645746939804352
Energy: 1.45499822672395
Energy: 1.4605536078539068
Energy: 1.2882745833269253
Energy: 1.4605536078545471
Energy: 1.2882745833269253
Energy: 1.4605536078539068
Energy: 1.288274583327566
Energy: 1.4306117343348763
Energy: 1.2881848926913106
Energy: 1.4306117343355167
Energy: 1.288184892693232
Energy: 1.4306117343348763
Energy: 1.2881848926951536

minimum gb energy = 1.2645746939797946 eV
minimum distance =  2.24937074623099 Angstroms
sigma value = 101


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

Energy: 1.2457740778389426
Energy: 1.4537908916073905
Energy: 1.2457740778389426
Energy: 1.4537908916068274
Energy: 1.2457740778389426
Energy: 1.4537908916068274
Energy: 1.3818340948484038
Energy: 1.2551616469963187
Energy: 1.3818340948478407
Energy: 1.2551616469963187
Energy: 1.3818340948489667
Energy: 1.2551616469957558
Energy: 1.4400079644072423
Energy: 1.2277005837094572
Energy: 1.4400079644078054
Energy: 1.227700583708331
Energy: 1.4400079644078054
Energy: 1.2277005837094572
Energy: 1.198256366675647
Energy: 1.4503067215671184
Energy: 1.1982563666762098
Energy: 1.4503067215676817
Energy: 1.198256366675084
Energy: 1.4503067215676817
Energy: 1.3109519968403767
Energy: 1.2601578164602334
Energy: 1.3109519968392507
Energy: 1.2601578164619223
Energy: 1.3109519968403767
Energy: 1.2601578164602334
Energy: 1.4313975839543616
Energy: 1.2092243550878383
Energy: 1.4313975839560507
Energy: 1.2092243550878383
Energy: 1.4313975839549247
Energy: 1.2092243550878383
Energy: 1.2554935590246477
Energy: 1.3793522877633255
Energy: 1.2554935590240848
Energy: 1.3793522877616362
Energy: 1.2554935590252108
Energy: 1.3793522877621993
Energy: 1.1977780313300206
Energy: 1.4579326467383062
Energy: 1.1977780313311466
Energy: 1.4579326467388694
Energy: 1.1977780313305835
Energy: 1.4579326467394322
Energy: 1.430309422299502
Energy: 1.2111963037663946
Energy: 1.430309422300065
Energy: 1.2111963037663946
Energy: 1.430309422300065
Energy: 1.2111963037663946
Energy: 1.311205678986792
Energy: 1.307579685997965
Energy: 1.3112056789862288
Energy: 1.3075796859985278
Energy: 1.311205678986792
Energy: 1.3075796859974018
Energy: 1.197039871986317
Energy: 1.582606903506007
Energy: 1.1970398719857538
Energy: 1.5826069035076957
Energy: 1.197039871986317
Energy: 1.5826069035076957
Energy: 1.305522480233574
Energy: 1.2571755220030227
Energy: 1.305522480233574
Energy: 1.2571755220024599
Energy: 1.3055224802347
Energy: 1.2571755220024599
Energy: 1.4057444307471683
Energy: 1.2277606844997973
Energy: 1.4057444307471683
Energy: 1.2277606845003604
Energy: 1.4057444307471683
Energy: 1.2277606844997973
Energy: 1.2457191645171053
Energy: 1.5297636224594797
Energy: 1.2457191645165422
Energy: 1.4502419867190834
Energy: 1.2457191645176684
Energy: 1.4502419867247132
Energy: 1.2459740128182004
Energy: 1.3187851239657777
Energy: 1.2459740128176373
Energy: 1.3187851239657777
Energy: 1.2459740128176373
Energy: 1.3187851239657777
Energy: 1.439441663125498
Energy: 1.2306545837817051
Energy: 1.439441663125498
Energy: 1.2306545837817051
Energy: 1.439441663124372
Energy: 1.2306545837822682
Energy: 1.1973242374422002
Energy: 1.3978739853301523
Energy: 1.197324237442763
Energy: 1.3978739853284634
Energy: 1.1973242374422002
Energy: 1.3978739853290263
Energy: 1.1912470036936988
Energy: 1.3938893707635547
Energy: 1.1912470036948248
Energy: 1.3938893707635547
Energy: 1.1912470036948248
Energy: 1.3938893707635547
Energy: 1.4318436896581954
Energy: 1.2094317464145439
Energy: 1.4318436896581954
Energy: 1.209431746413981
Energy: 1.4318436896581954
Energy: 1.2094317464145439
Energy: 1.2548037409171282
Energy: 1.3307163701390476
Energy: 1.2548037409171282
Energy: 1.3307163701396105
Energy: 1.2548037409171282
Energy: 1.3307163701390476
Energy: 1.2161662620152873
Energy: 1.5927152429067337
Energy: 1.216166262016413
Energy: 1.5927152429078595
Energy: 1.2161662620147242
Energy: 1.5927152429078595
Energy: 1.415957355784157
Energy: 1.2090181005025238
Energy: 1.4159573557847198
Energy: 1.2090181005025238
Energy: 1.415957355784157
Energy: 1.2090181005019605
Energy: 1.4068400591192167
Energy: 1.2091824278772778
Energy: 1.4068400591192167
Energy: 1.209182427876715
Energy: 1.4068400591186536
Energy: 1.209182427876715
Energy: 1.1983239361008786
Energy: 1.4668186572833593
Energy: 1.1983239361008786
Energy: 1.4668186572833593
Energy: 1.1983239361014417
Energy: 1.4668186572833593
Energy: 1.349446362690509
Energy: 1.2623721026420478
Energy: 1.34944636268882
Energy: 1.2623721026426107
Energy: 1.349446362691072
Energy: 1.2623721026426107
Energy: 1.405519863791454
Energy: 1.230700685129682
Energy: 1.405519863791454
Energy: 1.230700685129682
Energy: 1.4055198637908912
Energy: 1.230700685129682
Energy: 1.2457127824602396
Energy: 1.4877808736011595
Energy: 1.2457127824602396
Energy: 1.4877808736017224
Energy: 1.2457127824596765
Energy: 1.4877808736017224
Energy: 1.2457359668627095
Energy: 1.368792661179724
Energy: 1.2457359668632724
Energy: 1.368792661179724
Energy: 1.2457359668627095
Energy: 1.3687926611791612
Energy: 1.4667420565270504
Energy: 1.2276839210278776
Energy: 1.466742056526487
Energy: 1.2276839210273145
Energy: 1.466742056526487
Energy: 1.2276839210273145
Energy: 1.1919427453396032
Energy: 1.3679014928845252
Energy: 1.1919427453401665
Energy: 1.3679014928845252
Energy: 1.1919427453396032
Energy: 1.3679014928845252
Energy: 1.1917243829762503
Energy: 1.4237855138732773
Energy: 1.1917243829768134
Energy: 1.423785513872714
Energy: 1.1917243829762503
Energy: 1.423785513872714
Energy: 1.4681485446338598
Energy: 1.208988408882133
Energy: 1.468148544634423
Energy: 1.208988408882133
Energy: 1.468148544632734
Energy: 1.208988408882133
Energy: 1.4176799594658682
Energy: 1.209022462234915
Energy: 1.417679959466431
Energy: 1.209022462234915
Energy: 1.4176799594658682
Energy: 1.209022462234915

minimum gb energy = 1.1912470036936988 eV
minimum distance =  2.2719530807526 Angstroms
sigma value = 33


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

Energy: 0.020413649989508745
Energy: 1.1769574998638497
Energy: 0.020413649989508745
Energy: 1.1769574998624983
Energy: 0.020413649989508745
Energy: 1.1769574998638497
Energy: 0.021373823458633066
Energy: 0.42787244367752936
Energy: 0.021373823458633066
Energy: 0.4278724436779452
Energy: 0.021373823458633066
Energy: 0.4278724436779452
Energy: 1.1776781552077982
Energy: 0.42853211531024626
Energy: 1.1776781558999438
Energy: 0.42853211531024626
Energy: 1.1776781542961636
Energy: 0.4285321153120653
Energy: 0.021373823459516637
Energy: 0.4278724436793485
Energy: 0.021373823459516637
Energy: 0.4278724436793485
Energy: 0.021373823459516637
Energy: 0.4278724436793485

minimum gb energy = 0.020413649989508745 eV
minimum distance =  2.47852695699374 Angstroms
sigma value = 1