Model name: model_name=EAM_Dynamo_HepburnAckland_2008_FeC__MO_143977152728_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8553125262260437
cohesive_energy=4.013297914353109
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.015228926476997423
Energy: 0.49850602828640694
Energy: 0.015228926476997423
Energy: 0.49850602828640694
Energy: 0.015228926476997423
Energy: 0.49850602828522117
Energy: 0.015228926476997423
Energy: 0.016158286791629558
Energy: 0.5890549411261221
Energy: 0.016158286791219115
Energy: 0.589054941125324
Energy: 0.016158286791629558
Energy: 0.589054941125324
Energy: 0.016158286791629558
Energy: 0.417871034833333
Energy: 0.5311506443805949
Energy: 0.41787103483773386
Energy: 0.5311506481076074
Energy: 0.4178710348345416
Energy: 0.5311506437744871
Energy: 0.41787103483572724
Energy: 0.016158286791219115
Energy: 0.5890549411249136
Energy: 0.016158286790421035
Energy: 0.589054941123705
Energy: 0.016158286792039997
Energy: 0.5890549411241155
Energy: 0.016158286790033394
Energy: 0.015228926476199342
Energy: 0.4985060282856088
Energy: 0.015228926476199342
Energy: 0.4985060282880258
Energy: 0.015228926476199342
Energy: 0.4985060282872278
Energy: 0.015228926476609783
Energy: 0.016158286791629558
Energy: 0.5890549411241155
Energy: 0.016158286790831474
Energy: 0.5890549411249136
Energy: 0.016158286791219115
Energy: 0.589054941124526
Energy: 0.016158286790033394

minimum gb energy = 0.015228926476199342 eV
minimum distance =  2.46832693786729 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.278032853681171
Energy: 1.6806628564521446
Energy: 1.2780328536836223
Energy: 1.6806628564501838
Energy: 1.2780328536801902
Energy: 1.680662856449693
Energy: 1.278032853683132
Energy: 1.252881981908125
Energy: 1.2160261047332683
Energy: 1.2528819819144987
Energy: 1.2160261047317975
Energy: 1.2528819819086152
Energy: 1.216026104732288
Energy: 1.2528819819149888
Energy: 1.177604126557187
Energy: 1.206546889516025
Energy: 1.177604126557187
Energy: 1.2065468895135736
Energy: 1.1776041265581678
Energy: 1.2065468895155347
Energy: 1.1776041265581678
Energy: 1.1736579782098198
Energy: 1.2496586874564788
Energy: 1.1736579782019751
Energy: 1.2496586874589304
Energy: 1.1736579782093295
Energy: 1.2496586874564788
Energy: 1.173657978203446
Energy: 1.1607509285910675
Energy: 1.253544397263457
Energy: 1.1607509285891062
Energy: 1.253544397261986
Energy: 1.1607509285915578
Energy: 1.253544397263457
Energy: 1.1607509285895967
Energy: 1.2786239908730572
Energy: 1.3329312721450655
Energy: 1.2786239908686445
Energy: 1.3329312721435944
Energy: 1.2786239908735473
Energy: 1.332931272146046
Energy: 1.2786239908759989
Energy: 1.2549106159750112
Energy: 1.2865050876027124
Energy: 1.2549106159799142
Energy: 1.2865050876017319
Energy: 1.2549106159735404
Energy: 1.2865050876022222
Energy: 1.2549106159808947
Energy: 1.2045171663072394
Energy: 1.2929765652217302
Energy: 1.20451716630822
Energy: 1.292976565222711
Energy: 1.2045171663062588
Energy: 1.29297656522124
Energy: 1.2045171663087102
Energy: 1.2030478723685902
Energy: 1.2799051334641032
Energy: 1.2030478723632414
Energy: 1.2799051334641032
Energy: 1.2030478723685902
Energy: 1.2799051334626323
Energy: 1.2030478723632414
Energy: 1.1811161724627735
Energy: 1.1528231256166777
Energy: 1.1811161724598318
Energy: 1.1528231256215806
Energy: 1.1811161724632637
Energy: 1.1528231256181485
Energy: 1.1811161724608124
Energy: 1.2251626236041095
Energy: 1.1861860532284678
Energy: 1.2251626236060706
Energy: 1.1861860532323902
Energy: 1.22516262360509
Energy: 1.1861860532284678
Energy: 1.225162623606561
Energy: 1.2044320100612065
Energy: 1.2129668237828408
Energy: 1.2044320100582648
Energy: 1.2129668237671516
Energy: 1.204432010062187
Energy: 1.2129668237676419
Energy: 1.2044320100582648
Energy: 1.2434690237047117
Energy: 1.2872767543326182
Energy: 1.2434690237007893
Energy: 1.2872767543331085
Energy: 1.243469023705692
Energy: 1.2872767543345793
Energy: 1.2434690237007893
Energy: 1.1832919248573766
Energy: 1.2348663970220413
Energy: 1.1832919248588476
Energy: 1.2348663970293956
Energy: 1.1832919248573766
Energy: 1.2348663970220413
Energy: 1.1832919248593379
Energy: 1.2870377036083505
Energy: 1.2794351632472571
Energy: 1.2870377036049185
Energy: 1.2794351632408834
Energy: 1.2870377036083505
Energy: 1.2794351632467669
Energy: 1.2870377036044283
Energy: 1.1611817075750117
Energy: 1.2299049333461587
Energy: 1.1611817075804047
Energy: 1.229904933341746
Energy: 1.161181707575502
Energy: 1.2299049333461587
Energy: 1.1611817075799145
Energy: 1.3139270957971336
Energy: 1.3068253362871052
Energy: 1.313927095789289
Energy: 1.3068253362920084
Energy: 1.3139270957971336
Energy: 1.3068253362895568
Energy: 1.31392709579076
Energy: 1.1801646101215615
Energy: 1.2399018582306618
Energy: 1.1801646101347993
Energy: 1.2399018582228172
Energy: 1.1801646101220518
Energy: 1.239901858229191
Energy: 1.1801646101347993
Energy: 1.3031270855494903
Energy: 1.3150356789702062
Energy: 1.3031270855534127
Energy: 1.3150356789672648
Energy: 1.3031270855499808
Energy: 1.315035678969716
Energy: 1.3031270855514516
Energy: 1.244079961896936
Energy: 1.2085550841138497
Energy: 1.2440799618939944
Energy: 1.2085550841006116
Energy: 1.2440799618974263
Energy: 1.2085550841138497
Energy: 1.244079961894975
Energy: 1.2175187526528735
Energy: 1.1813962015051265
Energy: 1.21751875264699
Energy: 1.1813962015031652
Energy: 1.2175187526543443
Energy: 1.1813962015051265
Energy: 1.2175187526464997
Energy: 1.2027379019367062
Energy: 1.1853721531437902
Energy: 1.2027379019416091
Energy: 1.185372153134965
Energy: 1.2027379019352353
Energy: 1.1853721531437902
Energy: 1.2027379019416091
Energy: 1.1936433048277488
Energy: 1.2686587786173338
Energy: 1.1936433048287296
Energy: 1.268658778623663
Energy: 1.1936433048267685
Energy: 1.2686587786173338
Energy: 1.1936433048282393
Energy: 1.186330621312385
Energy: 1.266184977237631
Energy: 1.186330621312385
Energy: 1.2661849772332185
Energy: 1.1863306213133655
Energy: 1.2661849772371407
Energy: 1.186330621312385
Energy: 1.2388898732902451
Energy: 1.2763635617839102
Energy: 1.2388898732922062
Energy: 1.27636356178342
Energy: 1.2388898732902451
Energy: 1.27636356178342
Energy: 1.2388898732917162
Energy: 1.2878922420159848
Energy: 1.3627730463549497
Energy: 1.287892242017946
Energy: 1.3627730463539691
Energy: 1.287892242015004
Energy: 1.3627730463544594
Energy: 1.2878922420164751
Energy: 1.1586197169956232
Energy: 1.262463014642621
Energy: 1.1586197169990553
Energy: 1.2624630146431115
Energy: 1.1586197169956232
Energy: 1.2624630146436018
Energy: 1.1586197169995456
Energy: 1.307400665183181
Energy: 1.2600017532297818
Energy: 1.3074006651905354
Energy: 1.260001753235175
Energy: 1.307400665183181
Energy: 1.260001753230272
Energy: 1.3074006651910257
Energy: 1.1773812949946965
Energy: 1.198401541539766
Energy: 1.177381294992245
Energy: 1.1984015415422176
Energy: 1.177381294995187
Energy: 1.1984015415402565
Energy: 1.177381294991755
Energy: 1.273425966045212
Energy: 1.325434884520263
Energy: 1.273425966036387
Energy: 1.3254348845246755
Energy: 1.2734259660437413
Energy: 1.325434884520263
Energy: 1.2734259660368772
Energy: 1.2325342091729716
Energy: 1.343124686673109
Energy: 1.2221957655848175
Energy: 1.3431246866726188
Energy: 1.1927346529037273
Energy: 1.3431246866745798
Energy: 1.1927346529027465
Energy: 1.2633344612294817
Energy: 1.2139511633872733
Energy: 1.2633344612363457
Energy: 1.2139511633838413
Energy: 1.2633344612304622
Energy: 1.213951163386293
Energy: 1.2633344612343846
Energy: 1.1776930996030917
Energy: 1.1861484062256664
Energy: 1.177693099605543
Energy: 1.1861484062192926
Energy: 1.177693099603582
Energy: 1.1861484062261565
Energy: 1.1776930996045625
Energy: 1.1572805232975305
Energy: 1.2532874834726409
Energy: 1.157280523301453
Energy: 1.2532874834677379
Energy: 1.1572805232970405
Energy: 1.2532874834721506
Energy: 1.1572805233024337
Energy: 1.160207013467616
Energy: 1.2893951266009356
Energy: 1.160207013464184
Energy: 1.2893951266014259
Energy: 1.1602070134700673
Energy: 1.2893951266004453
Energy: 1.1602070134583005
Energy: 1.2612678626292149
Energy: 1.2791796881607382
Energy: 1.2612678626233313
Energy: 1.2791796881646604
Energy: 1.2612678626301954
Energy: 1.2791796881612285
Energy: 1.261267862622841
Energy: 1.213777204640444
Energy: 1.3039734723747523
Energy: 1.2137772046433857
Energy: 1.3039734723723007
Energy: 1.213777204640444
Energy: 1.303973472374262
Energy: 1.2137772046428954
Energy: 1.192871337853273
Energy: 1.2784043186556449
Energy: 1.192871337853273
Energy: 1.2784043186517224
Energy: 1.1928713378527827
Energy: 1.2784043186546639
Energy: 1.192871337853273
Energy: 1.269440134021745
Energy: 1.2607168304837881
Energy: 1.2694401340227257
Energy: 1.2607168304793757
Energy: 1.2694401340207644
Energy: 1.2607168304832979
Energy: 1.2694401340232158
Energy: 1.1685138968270092
Energy: 1.1747381527492726
Energy: 1.1685138968270092
Energy: 1.1747381527424086
Energy: 1.1685138968274993
Energy: 1.1747381527487823
Energy: 1.1685138968265187
Energy: 1.3089262476654149
Energy: 1.2031058477076393
Energy: 1.3089262476600219
Energy: 1.203105847700285
Energy: 1.3089262476663956
Energy: 1.2031058477096004
Energy: 1.308926247661983
Energy: 1.2199097757667654
Energy: 1.2230210902987064
Energy: 1.2199097757687265
Energy: 1.2230210902903715
Energy: 1.2199097757657846
Energy: 1.223021090303119
Energy: 1.219909775767746
Energy: 1.256439702108981
Energy: 1.3053648519493675
Energy: 1.2564397021168257
Energy: 1.305364851946916
Energy: 1.256439702108491
Energy: 1.3053648519493675
Energy: 1.2564397021163356
Energy: 1.183304166781343
Energy: 1.2666995737900555
Energy: 1.183304166781343
Energy: 1.2666995737905458
Energy: 1.1833041667818336
Energy: 1.2666995737905458
Energy: 1.1833041667818336
Energy: 1.182892778304347
Energy: 1.2700645440516267
Energy: 1.1828927783048373
Energy: 1.2700645440575102
Energy: 1.182892778304347
Energy: 1.2700645440516267
Energy: 1.182892778304347
Energy: 1.1737281448576091
Energy: 1.2374547344134832
Energy: 1.1737281448625119
Energy: 1.237454734422754
Energy: 1.1737281448576091
Energy: 1.2374547344134832
Energy: 1.1737281448620216
Energy: 1.2002683782237336
Energy: 1.2400233187526308
Energy: 1.2002683782266754
Energy: 1.2400233187550824
Energy: 1.200268378222753
Energy: 1.240023318753121
Energy: 1.2002683782256947

minimum gb energy = 1.1528231256166777 eV
minimum distance =  2.25875018292353 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.4318553625419548
Energy: 1.3281698032597595
Energy: 1.4318553625391721
Energy: 1.3281698032569769
Energy: 1.4318553625402852
Energy: 1.3281698032592029
Energy: 1.4318553625391721
Energy: 1.236977733224732
Energy: 1.2503537656488786
Energy: 1.2369777332258454
Energy: 1.2503537656466523
Energy: 1.236977733224732
Energy: 1.2503537656527743
Energy: 1.2369777332258454
Energy: 1.2283041834755488
Energy: 1.2812775360520179
Energy: 1.2283041834749922
Energy: 1.2812775360464526
Energy: 1.2283041834777746
Energy: 1.2812775360470094
Energy: 1.2283041834777746
Energy: 1.1966241416824244
Energy: 1.2885633813852408
Energy: 1.1966241416790853
Energy: 1.2885633813863537
Energy: 1.1966241416824244
Energy: 1.2885633813863537
Energy: 1.1966241416790853
Energy: 1.1870835674807563
Energy: 1.2996255042004565
Energy: 1.1870835674796432
Energy: 1.2996255041999
Energy: 1.1870835674807563
Energy: 1.2996255042021263
Energy: 1.1870835674790867
Energy: 1.2975103847890035
Energy: 1.2792650307024054
Energy: 1.2975103847890035
Energy: 1.2792650307001792
Energy: 1.29751038478956
Energy: 1.2792650307018487
Energy: 1.2975103847901164
Energy: 1.2629769813978473
Energy: 1.2795584313095698
Energy: 1.2629769813950646
Energy: 1.2795584313095698
Energy: 1.2629769813989604
Energy: 1.2795584313095698
Energy: 1.262976981399517
Energy: 1.3372341457770711
Energy: 1.3276745416416516
Energy: 1.3372341457804102
Energy: 1.327674541639982
Energy: 1.3372341457865322
Energy: 1.327674541641095
Energy: 1.3372341457820798
Energy: 1.2919083295030744
Energy: 1.328040552331687
Energy: 1.2919083295014049
Energy: 1.3280405523361394
Energy: 1.2919083295030744
Energy: 1.3280405523399843
Energy: 1.2919083295008482
Energy: 1.229487361465726
Energy: 1.2781400758391726
Energy: 1.229487361465726
Energy: 1.2781400758441814
Energy: 1.2294873614651693
Energy: 1.278140075839729
Energy: 1.2294873614579347
Energy: 1.2425630206937257
Energy: 1.2806544782221136
Energy: 1.2425630206903868
Energy: 1.280654478228792
Energy: 1.2425630206942821
Energy: 1.2806544782232268
Energy: 1.2425630206920564
Energy: 1.2020167288051502
Energy: 1.2225020326168838
Energy: 1.202016728804037
Energy: 1.2225020326196665
Energy: 1.2020167288051502
Energy: 1.2225020326163274
Energy: 1.2020167288034804
Energy: 1.2629902266977708
Energy: 1.2249818733110585
Energy: 1.26299022669939
Energy: 1.224981873311615
Energy: 1.2629902266966577
Energy: 1.2249818733121713
Energy: 1.2629902266977708
Energy: 1.3597507110965774
Energy: 1.382724334744736
Energy: 1.359750711096021
Energy: 1.382724334745849
Energy: 1.3597507110943514
Energy: 1.3827243347452924
Energy: 1.3597507110988036
Energy: 1.264721358027124
Energy: 1.2483558395821792
Energy: 1.2647213580254542
Energy: 1.248355839584962
Energy: 1.2647213580260108
Energy: 1.2483558395883012
Energy: 1.2647213580287935
Energy: 1.228233752318339
Energy: 1.2809853762773595
Energy: 1.228233752318339
Energy: 1.2809853762873769
Energy: 1.2282337523200089
Energy: 1.280985376284038
Energy: 1.228233752321122
Energy: 1.1966241416857637
Energy: 1.3106510320241775
Energy: 1.1966241416846508
Energy: 1.3106510320230647
Energy: 1.1966241416868768
Energy: 1.3106510320197253
Energy: 1.196624141685207
Energy: 1.187083567483539
Energy: 1.299706239015183
Energy: 1.1870835674813127
Energy: 1.2997062390118437
Energy: 1.187083567483539
Energy: 1.2997062390124003
Energy: 1.1870835674818694
Energy: 1.2975103847862206
Energy: 1.279265030705188
Energy: 1.2975103847867773
Energy: 1.2792650307001792
Energy: 1.2975103847867773
Energy: 1.2792650307046318
Energy: 1.2975103847867773
Energy: 1.2629769814039693
Energy: 1.279558431310683
Energy: 1.2629769814045255
Energy: 1.279558431310683
Energy: 1.2629769814045255
Energy: 1.279558431310683
Energy: 1.26297698140063
Energy: 1.3269142841791184
Energy: 1.3283214439888404
Energy: 1.3269142841824575
Energy: 1.3283214439872213
Energy: 1.326914284189136
Energy: 1.3283214439899536
Energy: 1.3269142841841273
Energy: 1.2960344457280522
Energy: 1.3273668102188552
Energy: 1.2960344457297217
Energy: 1.3273668102177418
Energy: 1.2960344457430786
Energy: 1.3273668102105072
Energy: 1.2960344457492006
Energy: 1.2300363712814664
Energy: 1.278140075839729
Energy: 1.23003637127924
Energy: 1.2781400758447379
Energy: 1.2300363712848055
Energy: 1.278140075839729
Energy: 1.2300363712875881
Energy: 1.2494587579035883
Energy: 1.2806544782248963
Energy: 1.2494587579035883
Energy: 1.2806544782293487
Energy: 1.2494587578924576
Energy: 1.2806544782248963
Energy: 1.2494587578935707
Energy: 1.2020167288096022
Energy: 1.2225020326163274
Energy: 1.202016728807376
Energy: 1.2225020326202232
Energy: 1.2020167288096022
Energy: 1.2225020326163274
Energy: 1.2020167288084893
Energy: 1.235495853928364
Energy: 1.2249818733166238
Energy: 1.2354958539289205
Energy: 1.224981873312728
Energy: 1.235495853928364
Energy: 1.2249818733155104
Energy: 1.235495853928364
Energy: 1.431855362543624
Energy: 1.3281698032592029
Energy: 1.4318553625402852
Energy: 1.3281698032541942
Energy: 1.431855362543624
Energy: 1.3281698032597595
Energy: 1.4318553625413981
Energy: 1.2369777332236194
Energy: 1.2503537656449828
Energy: 1.2369777332241758
Energy: 1.2503537656477655
Energy: 1.2369777332236194
Energy: 1.2503537656516612
Energy: 1.236977733224732
Energy: 1.2283041834749922
Energy: 1.2812775360514614
Energy: 1.2283041834738793
Energy: 1.2812775360464526
Energy: 1.2283041834777746
Energy: 1.2812775360492352
Energy: 1.2283041834783315
Energy: 1.1966241416829813
Energy: 1.28856338138858
Energy: 1.196624141681868
Energy: 1.2885633813919193
Energy: 1.1966241416835375
Energy: 1.2885633813913626
Energy: 1.196624141681868
Energy: 1.1870835674813127
Energy: 1.2996255041993436
Energy: 1.1870835674801996
Energy: 1.2996255041993436
Energy: 1.1870835674813127
Energy: 1.2996255042010132
Energy: 1.1870835674813127
Energy: 1.297510384784551
Energy: 1.2792650307024054
Energy: 1.2975103847862206
Energy: 1.2792650307001792
Energy: 1.2975103847839946
Energy: 1.2792650307018487
Energy: 1.2975103847862206
Energy: 1.262976981402856
Energy: 1.2795584313067871
Energy: 1.26297698140063
Energy: 1.279558431308457
Energy: 1.2629769814034126
Energy: 1.2795584313067871
Energy: 1.26297698140063
Energy: 1.3372341457776276
Energy: 1.327674541641095
Energy: 1.3372341457820798
Energy: 1.3276745416416516
Energy: 1.3372341457893149
Energy: 1.3276745416416516
Energy: 1.3372341457837493
Energy: 1.2919083295008482
Energy: 1.3280405523322436
Energy: 1.2919083294958396
Energy: 1.328040552337809
Energy: 1.291908329502518
Energy: 1.3280405523394279
Energy: 1.2919083295008482
Energy: 1.2294873614668391
Energy: 1.278140075840842
Energy: 1.2294873614651693
Energy: 1.2781400758441814
Energy: 1.2294873614673956
Energy: 1.278140075840842
Energy: 1.2294873614607171
Energy: 1.2425630206942821
Energy: 1.28065447822434
Energy: 1.2425630206931693
Energy: 1.2806544782299052
Energy: 1.2425630206948388
Energy: 1.2806544782248963
Energy: 1.2425630206914995
Energy: 1.2020167288084893
Energy: 1.2225020326141012
Energy: 1.2020167288057064
Energy: 1.2225020326185534
Energy: 1.2020167288084893
Energy: 1.2225020326146576
Energy: 1.2020167288068198
Energy: 1.2629902266972146
Energy: 1.2249818733138411
Energy: 1.2629902266988842
Energy: 1.224981873312728
Energy: 1.2629902266966577
Energy: 1.2249818733138411
Energy: 1.2629902266983275
Energy: 1.3597507110949076
Energy: 1.3827243347452924
Energy: 1.359750711093238
Energy: 1.3827243347469622
Energy: 1.3597507110965774
Energy: 1.3827243347464055
Energy: 1.35975071109936
Energy: 1.2647213580265673
Energy: 1.248355839577727
Energy: 1.2647213580248977
Energy: 1.2483558395749443
Energy: 1.2647213580265673
Energy: 1.2483558395827359
Energy: 1.26472135802935

minimum gb energy = 1.1870835674790867 eV
minimum distance =  2.24370583098389 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.2285716903218127
Energy: 1.2656862058926759
Energy: 1.228571690319885
Energy: 1.2656862058926759
Energy: 1.2285716903224553
Energy: 1.2656862058933185
Energy: 1.2285716903192423
Energy: 1.2075932022073412
Energy: 1.2087518256799152
Energy: 1.2075932022105542
Energy: 1.2087518256805287
Energy: 1.207593202209269
Energy: 1.2087518256799152
Energy: 1.207593202209269
Energy: 1.2461098186954047
Energy: 1.2593585406527994
Energy: 1.2461098186947621
Energy: 1.25935854065537
Energy: 1.2461098186947621
Energy: 1.25935854065537
Energy: 1.2461098186960473
Energy: 1.3442942349192737
Energy: 1.2609586510614557
Energy: 1.3442942349199163
Energy: 1.2609586510601705
Energy: 1.344294234920559
Energy: 1.2609586510614557
Energy: 1.3442942349212015
Energy: 1.3440788332486242
Energy: 1.3355701909776558
Energy: 1.344078833247339
Energy: 1.3355701909789413
Energy: 1.344078833247339
Energy: 1.3355701909782984
Energy: 1.3440788332492668
Energy: 1.1465094615755642
Energy: 1.304458826102588
Energy: 1.1465094615755642
Energy: 1.3044588261038732
Energy: 1.1465094615755642
Energy: 1.304458826104516
Energy: 1.1465094615755642
Energy: 1.1600664789603106
Energy: 1.2967189168916902
Energy: 1.1600664789596677
Energy: 1.2967189168897622
Energy: 1.1600664789603106
Energy: 1.2967189168878344
Energy: 1.1600664789596677
Energy: 1.2971055033783143
Energy: 1.2782288230757604
Energy: 1.2971055033789567
Energy: 1.2782288230770458
Energy: 1.2971055033789567
Energy: 1.2782288230757604
Energy: 1.2971055033789567
Energy: 1.2737614287586938
Energy: 1.2840284344316144
Energy: 1.2737614287580512
Energy: 1.2840284344328996
Energy: 1.2737614287586938
Energy: 1.2840284344316144
Energy: 1.2737614287586938
Energy: 1.2246392331388058
Energy: 1.3563922848479382
Energy: 1.2246392331388058
Energy: 1.3563922848511512
Energy: 1.2246392331381633
Energy: 1.356392284849866
Energy: 1.2246392331388058
Energy: 1.2369285826731675
Energy: 1.3649986278496216
Energy: 1.2369285826750953
Energy: 1.3649986278502642
Energy: 1.2369285826763807
Energy: 1.3649986278521922
Energy: 1.2369285826763807
Energy: 1.3250243449275274
Energy: 1.3433952402772191
Energy: 1.3250243449288126
Energy: 1.343395240278504
Energy: 1.3250243449275274
Energy: 1.343395240278504
Energy: 1.3250243449288126
Energy: 1.2568383838560124
Energy: 1.2736708623557855
Energy: 1.2568383838540844
Energy: 1.2736708623538575
Energy: 1.2568383838553696
Energy: 1.2736708623557855
Energy: 1.2568383838534418
Energy: 1.1473699779038038
Energy: 1.1663741315046092
Energy: 1.147369977903161
Energy: 1.1663741315058944
Energy: 1.1473699779038038
Energy: 1.1663741315046092
Energy: 1.147369977903161
Energy: 1.2465577272800104
Energy: 1.3147312184970372
Energy: 1.2465577272793678
Energy: 1.3147312185047486
Energy: 1.2465577272812958
Energy: 1.3147312185008928
Energy: 1.2465577272896207
Energy: 1.2161908561141452
Energy: 1.2696484373710677
Energy: 1.2161908561128598
Energy: 1.269648437370425
Energy: 1.2161908561141452
Energy: 1.2696484373710677
Energy: 1.2161908561128598
Energy: 1.2722703693932627
Energy: 1.2581880758032165
Energy: 1.2722703693951907
Energy: 1.2581880758038593
Energy: 1.272270369394548
Energy: 1.2581880758025739
Energy: 1.2722703693939053
Energy: 1.2480200744602885
Energy: 1.2548760328325095
Energy: 1.2480200744602885
Energy: 1.2548760328318667
Energy: 1.2480200744615737
Energy: 1.2548760328325095
Energy: 1.2480200744570753
Energy: 1.299470574150619
Energy: 1.3799642028744081
Energy: 1.3506383145369418
Energy: 1.3799642028724801
Energy: 1.3555726334953495
Energy: 1.3799642028744081
Energy: 1.3555726334953495
Energy: 1.3101914316522132
Energy: 1.4019763759862456
Energy: 1.310191431650928
Energy: 1.4019763759856028
Energy: 1.3101914316515704
Energy: 1.4019763759849602
Energy: 1.3101914316528558
Energy: 1.1525857824929693
Energy: 1.1673478502320176
Energy: 1.1525857824936119
Energy: 1.1673478502339454
Energy: 1.1525857824929693
Energy: 1.1673478502320176
Energy: 1.1525857824942547
Energy: 1.160521576998111
Energy: 1.2833674004109303
Energy: 1.160521576998111
Energy: 1.283367400415429
Energy: 1.160521576998111
Energy: 1.283367400413501
Energy: 1.160521576998111
Energy: 1.3206276974004643
Energy: 1.269943811719119
Energy: 1.3206276974004643
Energy: 1.269943811719762
Energy: 1.3206276974004643
Energy: 1.2699438117184767
Energy: 1.3206276973998217
Energy: 1.301889070614526
Energy: 1.3215312302262696
Energy: 1.3018890706158113
Energy: 1.3215312302243416
Energy: 1.301889070614526
Energy: 1.3215312302269122
Energy: 1.3018890706158113
Energy: 1.2509590851291748
Energy: 1.2494357904639901
Energy: 1.2509590851278893
Energy: 1.249435790462705
Energy: 1.2509590851266041
Energy: 1.2494357904614486
Energy: 1.2509590851285322
Energy: 1.3635528296772488
Energy: 1.3774571299862064
Energy: 1.3635528296778623
Energy: 1.3774571299836358
Energy: 1.3635528296778623
Energy: 1.3774571299817078
Energy: 1.3635528296778623
Energy: 1.2981388705170815
Energy: 1.305791073378054
Energy: 1.2981388705157964
Energy: 1.3057910733774116
Energy: 1.2981388705170815
Energy: 1.305791073378054
Energy: 1.2981388705164392
Energy: 1.2598822873266073
Energy: 1.371232993515947
Energy: 1.25988228732725
Energy: 1.3712329935133767
Energy: 1.2598822873266073
Energy: 1.3712329935133767
Energy: 1.2598822873285354
Energy: 1.1526123059768785
Energy: 1.1644569635397817
Energy: 1.1526123059762359
Energy: 1.1644569635384967
Energy: 1.1526123059768785
Energy: 1.1644569635397817
Energy: 1.1526123059762359
Energy: 1.3020245129935177
Energy: 1.3176533469095846
Energy: 1.3020245129941603
Energy: 1.3176533469089418
Energy: 1.3020245129948032
Energy: 1.317653346910227
Energy: 1.3020245129948032
Energy: 1.2582894564224318
Energy: 1.2699535778487454
Energy: 1.2582894564224318
Energy: 1.2699535778487454
Energy: 1.2582894564230744
Energy: 1.2699535778487454
Energy: 1.2582894564224318
Energy: 1.252698313977457
Energy: 1.3506569162795468
Energy: 1.2526983139800274
Energy: 1.3506569162795468
Energy: 1.252698313978742
Energy: 1.3506569162756907
Energy: 1.252698313977457
Energy: 1.2386090962553744
Energy: 1.2778033059421239
Energy: 1.2386090962566596
Energy: 1.277803305941481
Energy: 1.2386090962579448
Energy: 1.277803305941481
Energy: 1.2386090962585874
Energy: 1.2746752364021428
Energy: 1.3898699460564237
Energy: 1.2746752364034282
Energy: 1.3898699460564237
Energy: 1.2746752364021428
Energy: 1.3898699460570663
Energy: 1.2746752364034282
Energy: 1.308523159154819
Energy: 1.380086616690272
Energy: 1.3085231591689566
Energy: 1.380086616688987
Energy: 1.3085231591695992
Energy: 1.380086616688987
Energy: 1.3085231591606024
Energy: 1.1478081542718437
Energy: 1.1677243135769086
Energy: 1.1478081542718437
Energy: 1.167724313578194
Energy: 1.147808154271201
Energy: 1.1677243135769086
Energy: 1.147808154271201

minimum gb energy = 1.1465094615755642 eV
minimum distance =  2.25478985750232 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.2030285324835635
Energy: 1.2322313771343532
Energy: 1.2030285324843217
Energy: 1.2322313771328364
Energy: 1.2030285324835635
Energy: 1.2322313771351117
Energy: 1.20302853248508
Energy: 1.2534871821869717
Energy: 1.1317873087197796
Energy: 1.2534871821854552
Energy: 1.1317873087212962
Energy: 1.2534871821869717
Energy: 1.1317873087197796
Energy: 1.2534871821854552
Energy: 1.1946702967588438
Energy: 1.1537701109827285
Energy: 1.1946702967603606
Energy: 1.1537701109865206
Energy: 1.1946702967588438
Energy: 1.1537701109834868
Energy: 1.1946702967603606
Energy: 1.2535894791898363
Energy: 1.1407210627668358
Energy: 1.2535894791921116
Energy: 1.1407210627660773
Energy: 1.2535894791905948
Energy: 1.1407210627668358
Energy: 1.2535894791921116
Energy: 1.2616878625945347
Energy: 1.131964872466195
Energy: 1.2616878625945347
Energy: 1.1319648724654365
Energy: 1.261687862595293
Energy: 1.131964872466195
Energy: 1.2616878625945347
Energy: 1.2531215262907451
Energy: 1.1320541212698079
Energy: 1.2531215262915034
Energy: 1.1320541212713249
Energy: 1.2531215262899866
Energy: 1.1320541212690496
Energy: 1.2531215262915034
Energy: 1.2924395105647193
Energy: 1.1536320208144908
Energy: 1.3175060476559133
Energy: 1.1536320208122155
Energy: 1.207023619377049
Energy: 1.1536320208144908
Energy: 1.2070236187311818
Energy: 1.2271560563920267
Energy: 1.1486700605684372
Energy: 1.2271560563897514
Energy: 1.1486700605646452
Energy: 1.2271560563920267
Energy: 1.1486700605691957
Energy: 1.2271560563882347
Energy: 1.2762132306730962
Energy: 1.132044256181666
Energy: 1.2762132306700626
Energy: 1.1320442561793906
Energy: 1.276213230672338
Energy: 1.1320442561809074
Energy: 1.276213230670821
Energy: 1.2021329832020395
Energy: 1.2328258386016906
Energy: 1.2021329832020395
Energy: 1.2328258386054827
Energy: 1.2021329832027978
Energy: 1.232825838600932
Energy: 1.202132983201281
Energy: 1.2616705351626605
Energy: 1.1522671558077413
Energy: 1.3046054565928367
Energy: 1.1522671558092585
Energy: 1.2066504106794813
Energy: 1.1522671558084998
Energy: 1.2066504106992004
Energy: 1.20911394177521
Energy: 1.148569515950167
Energy: 1.2091139417729346
Energy: 1.14856951594865
Energy: 1.20911394177521
Energy: 1.1485695159494083
Energy: 1.2091139417729346
Energy: 1.315455752406398
Energy: 1.1386059709522784
Energy: 1.3154557524086732
Energy: 1.138605970949245
Energy: 1.3154557524079147
Energy: 1.1386059709522784
Energy: 1.31545575241019
Energy: 1.2089483828614906
Energy: 1.1489072195988157
Energy: 1.2089483828630077
Energy: 1.1489072195980574
Energy: 1.2089483828614906
Energy: 1.1489072195980574
Energy: 1.2089483828630077
Energy: 1.264658382709408
Energy: 1.2151694089068528
Energy: 1.264658382709408
Energy: 1.2151694089076113
Energy: 1.2646583827071327
Energy: 1.2151694089076113
Energy: 1.2023756779030714
Energy: 1.2090403493771524
Energy: 1.1488289968391026
Energy: 1.2090403493756356
Energy: 1.1488289968406196
Energy: 1.209040349376394
Energy: 1.148828996839861
Energy: 1.2090403493756356
Energy: 1.3155057606891674
Energy: 1.138569604394467
Energy: 1.3155057606906844
Energy: 1.1385696043959843
Energy: 1.315505760688409
Energy: 1.138569604394467
Energy: 1.3155057606922012
Energy: 1.2089740534800864
Energy: 1.1485376744154634
Energy: 1.2089740534793278
Energy: 1.1485376744177387
Energy: 1.2089740534808446
Energy: 1.1485376744154634
Energy: 1.2089740534785693
Energy: 1.2521162371649186
Energy: 1.152257348603402
Energy: 1.2521162371656773
Energy: 1.152257348603402
Energy: 1.2521162371702277
Energy: 1.152257348603402
Energy: 1.2521162371664356
Energy: 1.2021161452958053
Energy: 1.2327620164724342
Energy: 1.2021161452958053
Energy: 1.2327620164716757
Energy: 1.2021161452958053
Energy: 1.2327620164709174
Energy: 1.2021161452950466
Energy: 1.2762893873667607
Energy: 1.1320775447463176
Energy: 1.2762893873652437
Energy: 1.1320775447455593
Energy: 1.276289387367519
Energy: 1.1320775447463176
Energy: 1.2762893873682775
Energy: 1.22727219243182
Energy: 1.1486473785690088
Energy: 1.22727219243182
Energy: 1.1486473785690088
Energy: 1.22727219243182
Energy: 1.1486473785690088
Energy: 1.2272721924325785
Energy: 1.2518067022343051
Energy: 1.1534211764398163
Energy: 1.2518067022320298
Energy: 1.1534211764398163
Energy: 1.2518067022350636
Energy: 1.1534211764405404
Energy: 1.2518067022320298
Energy: 1.252800106116465
Energy: 1.132040826350209
Energy: 1.252800106116465
Energy: 1.1320408263532429
Energy: 1.252800106116465
Energy: 1.1320408263509676
Energy: 1.252800106116465
Energy: 1.2616163012866526
Energy: 1.1319626063620538
Energy: 1.2616163012881694
Energy: 1.131962606364329
Energy: 1.2616163012866526
Energy: 1.131962606363571
Energy: 1.2616163012889279
Energy: 1.252744684716304
Energy: 1.1412093122693152
Energy: 1.2527446847193378
Energy: 1.1412093122685567
Energy: 1.2527446847064443
Energy: 1.1412093122685567
Energy: 1.2527446847125117
Energy: 1.1946940874946916
Energy: 1.1537903797734226
Energy: 1.1946940874992422
Energy: 1.1537903797734226
Energy: 1.1946940874946916
Energy: 1.1537903797726643
Energy: 1.1946940874992422
Energy: 1.2512576402389832
Energy: 1.1318236095210683
Energy: 1.251257640238225
Energy: 1.1318236095241019
Energy: 1.2512576402351914
Energy: 1.1318236095210683
Energy: 1.251257640238225
Energy: 1.2030285324843217
Energy: 1.2322313771366284
Energy: 1.20302853248508
Energy: 1.2322313771351117
Energy: 1.20302853248508
Energy: 1.2322313771366284
Energy: 1.20302853248508
Energy: 1.2534871821862137
Energy: 1.1317873087175043
Energy: 1.2534871821846965
Energy: 1.1317873087197796
Energy: 1.2534871821862137
Energy: 1.1317873087167456
Energy: 1.2534871821846965

minimum gb energy = 1.1317873087167456 eV
minimum distance =  2.23390268480231 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.2565525477040047
Energy: 1.287001520966957
Energy: 1.2565525477040047
Energy: 1.287001520966957
Energy: 1.2565525477040047
Energy: 1.287001520966957
Energy: 1.2565525477049255
Energy: 1.129376198718272
Energy: 1.1015010466278492
Energy: 1.1293761987173516
Energy: 1.1015010466287698
Energy: 1.129376198718272
Energy: 1.1015010466269286
Energy: 1.1293761987173516
Energy: 1.2683526009987667
Energy: 1.2130891590836268
Energy: 1.2683526009978459
Energy: 1.2130891590836268
Energy: 1.2683526009987667
Energy: 1.2130891590836268
Energy: 1.2683526009978459
Energy: 1.1217274221434137
Energy: 1.1023969000149352
Energy: 1.121727422141572
Energy: 1.1023969000167555
Energy: 1.1217274221424929
Energy: 1.102396900015835
Energy: 1.1217274221434137
Energy: 1.0595398867250359
Energy: 1.1461861250628773
Energy: 1.0595398867250359
Energy: 1.146186125060115
Energy: 1.0595398867250359
Energy: 1.1461861250628773
Energy: 1.0595398867250359
Energy: 1.0783179645636167
Energy: 1.1067403470434272
Energy: 1.0783179645617753
Energy: 1.1067403470443478
Energy: 1.0783179645636167
Energy: 1.1067403470434272
Energy: 1.0783179645617753
Energy: 1.0775612941904265
Energy: 1.1733465520839388
Energy: 1.0775612941913468
Energy: 1.1733465520811768
Energy: 1.0775612941904265
Energy: 1.1733465520839388
Energy: 1.0775612941913468
Energy: 1.059207456193296
Energy: 1.0902155382892347
Energy: 1.0592074561914546
Energy: 1.090215538291055
Energy: 1.0592074561923757
Energy: 1.0902155382892347
Energy: 1.0592074561951375
Energy: 1.1244940691787304
Energy: 1.090464237688894
Energy: 1.1244940691768892
Energy: 1.0904642376907352
Energy: 1.1244940691787304
Energy: 1.090464237688894
Energy: 1.1244940691778098
Energy: 1.0785434674566128
Energy: 1.149474013220674
Energy: 1.078543467455692
Energy: 1.149474013223436
Energy: 1.078543467455692
Energy: 1.14947401321515
Energy: 1.0785434674566128
Energy: 1.0787135624214492
Energy: 1.1113424799496534
Energy: 1.0787135624214492
Energy: 1.1113424799487328
Energy: 1.0787135624214492
Energy: 1.1113424799496534
Energy: 1.0787135624214492
Energy: 1.059476143374237
Energy: 1.1373236143009313
Energy: 1.0594761433751578
Energy: 1.1373236142981693
Energy: 1.059476143374237
Energy: 1.1373236143000107
Energy: 1.0594761433751578
Energy: 1.1159281897451951
Energy: 1.0949415589933487
Energy: 1.1159281897451951
Energy: 1.0949415589951899
Energy: 1.1159281897442743
Energy: 1.0949415589933487
Energy: 1.1159281897461157
Energy: 1.171329301225611
Energy: 1.173487302799432
Energy: 1.1713293012265318
Energy: 1.1734873028058768
Energy: 1.171329301225611
Energy: 1.1734873028049562
Energy: 1.1713293012246904
Energy: 1.1261802867457442
Energy: 1.1105745437046333
Energy: 1.1261802867475854
Energy: 1.110574543702792
Energy: 1.1261802867448234
Energy: 1.1105745437046333
Energy: 1.1261802867475854
Energy: 1.2466885946478612
Energy: 1.222121983839473
Energy: 1.246688594648782
Energy: 1.2221219838413142
Energy: 1.246688594648782
Energy: 1.2221219838413142
Energy: 1.246688594648782
Energy: 1.1546656578554693
Energy: 1.1076844772126295
Energy: 1.1546656578545487
Energy: 1.1076844772117085
Energy: 1.1546656578554693
Energy: 1.1076844772126295
Energy: 1.1546656578545487
Energy: 1.1722132233557268
Energy: 1.1736823480430527
Energy: 1.1722132233566473
Energy: 1.173682348045815
Energy: 1.1722132233566473
Energy: 1.1736823480448944
Energy: 1.1722132233557268
Energy: 1.1556120157084533
Energy: 1.111760272220358
Energy: 1.1556120157075325
Energy: 1.111760272219437
Energy: 1.1556120157084533
Energy: 1.111760272220358
Energy: 1.1556120157075325
Energy: 1.059454744902515
Energy: 1.1016689335175334
Energy: 1.0594547449034357
Energy: 1.1016689335184537
Energy: 1.0594547449034357
Energy: 1.1016689335184537
Energy: 1.059454744902515
Energy: 1.1156336593961467
Energy: 1.1671902310311344
Energy: 1.115633659394305
Energy: 1.167190231032055
Energy: 1.1156336593961467
Energy: 1.167190231032055
Energy: 1.115633659394305
Energy: 1.0776477643591713
Energy: 1.1711805035199503
Energy: 1.0776477643600917
Energy: 1.1711805035190297
Energy: 1.0776477643591713
Energy: 1.1711805035190297
Energy: 1.0776477643591713
Energy: 1.1484557709731869
Energy: 1.1109417781817366
Energy: 1.1484557709741074
Energy: 1.1109417781798951
Energy: 1.1484557709741074
Energy: 1.1109417781817366
Energy: 1.148455770975028
Energy: 1.1277874066324303
Energy: 1.1005990366188654
Energy: 1.1277874066324303
Energy: 1.1005990366188654
Energy: 1.1277874066324303
Energy: 1.1005990366188654
Energy: 1.1277874066324303
Energy: 1.1104418244566685
Energy: 1.1687761487650146
Energy: 1.1104418244566685
Energy: 1.1687761487650146
Energy: 1.1104418244566685
Energy: 1.1687761487650146
Energy: 1.1104418244566685

minimum gb energy = 1.0592074561914546 eV
minimum distance =  2.27827668582095 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.0584146089658353
Energy: 1.1078013966920823
Energy: 1.0584146089591553
Energy: 1.1078013966925961
Energy: 1.0584146089586415
Energy: 1.1078013966956792
Energy: 1.0584146089648074
Energy: 1.0259616092269435
Energy: 0.9612815171581551
Energy: 1.025961609225916
Energy: 0.9612815171581551
Energy: 1.0259616092279715
Energy: 0.9612815171566138
Energy: 1.025961609225916
Energy: 1.0328434182221182
Energy: 0.999380116648269
Energy: 1.032843418223146
Energy: 0.9993801166477553
Energy: 1.0328434182226318
Energy: 0.9993801166472415
Energy: 1.0328434182221182
Energy: 0.9938422864004731
Energy: 0.9772565694164436
Energy: 0.9938422864035561
Energy: 0.9772565694226097
Energy: 0.9938422864015009
Energy: 0.9772565694174713
Energy: 0.9938422864035561
Energy: 0.9977807658183692
Energy: 1.0340922976313238
Energy: 0.9977807658193968
Energy: 1.0340922976323512
Energy: 0.9977807658188831
Energy: 1.0340922976282405
Energy: 0.9977807658188831
Energy: 0.9713046817178446
Energy: 0.9635133524358557
Energy: 0.9713046817214415
Energy: 0.9635133524420216
Energy: 0.9713046817183584
Energy: 0.9635133524389388
Energy: 0.9713046817209275
Energy: 0.9861228528483331
Energy: 0.9877281010582922
Energy: 0.9861228528529578
Energy: 0.9877281010593197
Energy: 0.9861228528478193
Energy: 0.9877281010552091
Energy: 0.9861228528534716
Energy: 0.9753991892793276
Energy: 0.9451222074003853
Energy: 0.975399189280869
Energy: 0.9451222074008994
Energy: 0.9753991892798415
Energy: 0.9451222074003853
Energy: 0.9753991892803552
Energy: 0.9653703546602583
Energy: 0.9804251264709943
Energy: 0.9653703546546061
Energy: 0.9804251264704806
Energy: 0.9653703546592305
Energy: 0.9804251264725359
Energy: 0.9653703546530645
Energy: 0.9720258837115544
Energy: 0.9291231621146369
Energy: 0.9720258837100129
Energy: 0.929123162110526
Energy: 0.9720258837120682
Energy: 0.9291231621146369
Energy: 0.9720258837110407
Energy: 0.9601313177558664
Energy: 0.9445296626563446
Energy: 0.960131317753811
Energy: 0.9445296626589139
Energy: 0.9601313177558664
Energy: 0.9445296626573724
Energy: 0.960131317753811
Energy: 0.9974480637247
Energy: 0.9572134544112064
Energy: 0.9974480637257277
Energy: 0.9572134544076095
Energy: 0.997448063725214
Energy: 0.9572134544086371
Energy: 0.997448063725214
Energy: 0.9043051749212612
Energy: 0.9984831878791114
Energy: 0.9043051749202335
Energy: 0.9984831878760284
Energy: 0.9043051749181781
Energy: 0.9984831878739729
Energy: 0.9043051749171506
Energy: 0.9593105736650525
Energy: 0.9284382021422498
Energy: 0.9593105736696769
Energy: 0.9284382021437914
Energy: 0.9593105736655662
Energy: 0.9284382021422498
Energy: 0.9593105736691631
Energy: 0.9467265576123075
Energy: 0.922409064693037
Energy: 0.9467265576117938
Energy: 0.9224090646889264
Energy: 0.9467265576123075
Energy: 0.9224090646925233
Energy: 0.9467265576123075
Energy: 1.0173659039664578
Energy: 0.9990102316162102
Energy: 1.0173659039674852
Energy: 0.9990102316146686
Energy: 1.0173659039669714
Energy: 0.9990102316146686
Energy: 1.0173659039674852
Energy: 0.9058045237978958
Energy: 0.9267832065182837
Energy: 0.9058045238020065
Energy: 0.9267832065193116
Energy: 0.9058045237978958
Energy: 0.9267832065208531
Energy: 0.9058045238025204
Energy: 0.9730431543632401
Energy: 0.9414659807790308
Energy: 0.973043154369406
Energy: 0.9414659807769754
Energy: 0.9730431543632401
Energy: 0.9414659807790308
Energy: 0.9730431543688922
Energy: 0.9672989736964015
Energy: 0.9234308822172077
Energy: 0.9672989736973825
Energy: 0.9234308822084724
Energy: 0.9672989736964015
Energy: 0.923430882219777
Energy: 0.9672989736984101
Energy: 0.9656446937297818
Energy: 1.0046345406333157
Energy: 0.9656446937308094
Energy: 1.004634540635885
Energy: 0.9656446937297818
Energy: 1.0046345406348571
Energy: 0.9656446937308094
Energy: 0.9827368459793324
Energy: 0.9269208825999022
Energy: 0.9827368459829293
Energy: 0.9269208825963052
Energy: 0.9827368459798462
Energy: 0.9269208825988744
Energy: 0.9827368459824155
Energy: 0.9922762641433143
Energy: 0.9630803512259161
Energy: 0.9922762641453695
Energy: 0.9630803512289989
Energy: 0.9922762641433143
Energy: 0.9630803512254021
Energy: 0.9922762641453695
Energy: 0.9559751521463042
Energy: 1.00223957251646
Energy: 0.9559751521478457
Energy: 1.0022395725195432
Energy: 0.9559751521478457
Energy: 1.00223957251646
Energy: 0.9559751521488733
Energy: 0.9674207617917973
Energy: 1.0303866413156688
Energy: 0.9674207617871728
Energy: 1.0303866411210176
Energy: 0.9674207617928251
Energy: 1.0303866411934222
Energy: 0.9674207617825483
Energy: 0.9625935826169968
Energy: 0.9739962353305889
Energy: 0.9625935826591315
Energy: 0.9739962353300752
Energy: 0.9625935826883734
Energy: 0.9739962353300752
Energy: 0.9625935826139137
Energy: 1.0236001683077505
Energy: 0.9695475825821497
Energy: 1.0236001683118614
Energy: 0.9695475825852327
Energy: 1.0236001683077505
Energy: 0.9695475825821497
Energy: 1.0236001683118614
Energy: 1.0237001754901598
Energy: 0.9598802927447797
Energy: 1.0237001754870767
Energy: 0.959880292743752
Energy: 1.0237001754906736
Energy: 0.9598802927442659
Energy: 1.023700175486049
Energy: 1.0290083519243927
Energy: 1.0775761107849837
Energy: 1.0290083519249065
Energy: 1.0775761109380142
Energy: 1.0290083519249065
Energy: 1.0775761108214195
Energy: 1.0290083519243927
Energy: 1.0046143801381018
Energy: 0.9621444008618654
Energy: 1.004614395699456
Energy: 0.9621444008582686
Energy: 1.004614430509887
Energy: 0.9621444008623327
Energy: 1.004614414015823
Energy: 1.0145268729160166
Energy: 0.9696785645222465
Energy: 1.0145268729129335
Energy: 0.9696785645217328
Energy: 1.0145268729165304
Energy: 0.9696785645212188
Energy: 1.014526872914475
Energy: 0.9833507438379054
Energy: 1.120653704406358
Energy: 0.9833507438379054
Energy: 1.1206537044048166
Energy: 0.9833507438343088
Energy: 1.120653704406358
Energy: 0.9833507438379054
Energy: 0.967473158531546
Energy: 1.0037870557167539
Energy: 0.9674731585305183
Energy: 1.0037870556571955
Energy: 0.9674731585325737
Energy: 1.0037870556972281
Energy: 0.9674731585361706
Energy: 1.0479942197168093
Energy: 0.9622015931717991
Energy: 1.0479942197152678
Energy: 0.9622015931707713
Energy: 1.0479942197168093
Energy: 0.9622015931717991
Energy: 1.0479942197132126
Energy: 0.9747186665661685
Energy: 0.9697699248488144
Energy: 0.9747186667541399
Energy: 0.9697699248472729
Energy: 0.9747186669051615
Energy: 0.9697699248457313
Energy: 0.974718666862513
Energy: 0.9794725921340797
Energy: 1.0660044345431903
Energy: 0.9794725921310435
Energy: 1.066004434541135
Energy: 0.9794725921330522
Energy: 1.0660044345426767
Energy: 0.9794725921310435
Energy: 0.9482483540469653
Energy: 0.9985090319758158
Energy: 0.948248354051076
Energy: 0.9985090319177987
Energy: 0.9482483540474791
Energy: 0.9985090319753017
Energy: 0.9482483540505622
Energy: 0.9459369935088848
Energy: 0.9279431682641454
Energy: 0.9459369935109404
Energy: 0.9279431682631175
Energy: 0.9459369935027188
Energy: 0.9279431682641454
Energy: 0.9459369935073435
Energy: 0.9694195948708462
Energy: 0.9233882346475766
Energy: 0.9694195948672493
Energy: 0.923388234646035
Energy: 0.9694195948693046
Energy: 0.9233882346475766
Energy: 0.9694195948672493
Energy: 0.9560628684916574
Energy: 0.9769340922792495
Energy: 0.9560628684880605
Energy: 0.9769340922828464
Energy: 0.9560628684921713
Energy: 0.9769340922797634
Energy: 0.9560628684890883
Energy: 0.9046518509827213
Energy: 1.0159923434256344
Energy: 0.9046518509806659
Energy: 1.015992343384574
Energy: 0.9046518509822074
Energy: 1.015992343413816
Energy: 0.9046518509796383
Energy: 0.948316896602147
Energy: 0.9271839564965255
Energy: 0.948316896602147
Energy: 0.9271839564934424
Energy: 0.9483168966016332
Energy: 0.9271839564960116
Energy: 0.948316896602147
Energy: 0.9510706119072491
Energy: 0.9202538360854836
Energy: 0.9510706119093044
Energy: 0.9202538360885666
Energy: 0.9510706119082766
Energy: 0.9202538360859974
Energy: 0.9510706119098181
Energy: 0.9402774168785119
Energy: 1.0598777115195746
Energy: 0.9402774168790258
Energy: 1.0598777115200886
Energy: 0.9402774168790258
Energy: 1.059877711518547
Energy: 0.9402774168790258
Energy: 0.9069775834337523
Energy: 0.9264090110617723
Energy: 0.9069775834352939
Energy: 0.9264090110581754
Energy: 0.9069775834342662
Energy: 0.926409011062286
Energy: 0.9069775834358077
Energy: 0.9387332122548002
Energy: 0.9399812160718336
Energy: 0.9387332122568556
Energy: 0.9399812160718336
Energy: 0.9387332122548002
Energy: 0.9399812160713198
Energy: 0.9387332122568556

minimum gb energy = 0.9043051749171506 eV
minimum distance =  2.26787287854986 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.40561726309296753
Energy: 0.32020443974083584
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 0.32020443974083584
Energy: 0.40561726309180896
Energy: 1.8453414916021358
Energy: 1.0719588345975088
Energy: 1.845508902091023
Energy: 1.0719588345963502
Energy: 1.845498319998446
Energy: 1.0719588345975088
Energy: 1.8455294890014906
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 0.3202044397385188
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 2.27031939964372
Energy: 1.0719588345975088
Energy: 2.3931897054878184
Energy: 1.0719588345963502
Energy: 2.083182176426119
Energy: 1.0719588345963502
Energy: 1.8455902328324663
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 0.32020443974083584
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 1.8455287870162287
Energy: 1.0719588345963502
Energy: 1.8453734885979725
Energy: 1.0719588345975088
Energy: 1.8454895199580679
Energy: 1.0719588345963502
Energy: 1.8455133391578922
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309065044
Energy: 1.8453505186425307
Energy: 1.0719588345963502
Energy: 1.8454426483313184
Energy: 1.0719588345951918
Energy: 1.845535639840376
Energy: 1.0719588345963502
Energy: 1.8455595154555327
Energy: 0.40561726309296753
Energy: 0.32020443974083584
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 2.0831895104910036
Energy: 1.0719588345963502
Energy: 1.8453740742947793
Energy: 1.0719588345975088
Energy: 1.8455684387022637
Energy: 1.0719588345963502
Energy: 1.845586894033946
Energy: 0.40561726309180896
Energy: 0.3202044397385188
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 0.3202044397385188
Energy: 0.40561726309296753
Energy: 1.845440691321868
Energy: 1.0719588345940334
Energy: 1.845342309929118
Energy: 1.0719588345963502
Energy: 1.8453418134363568
Energy: 1.0719588345940334
Energy: 1.8455201350548287
Energy: 0.40561726309296753
Energy: 0.32020443974083584
Energy: 0.40561726309180896
Energy: 0.32020443974083584
Energy: 0.40561726309296753
Energy: 0.32020443974083584
Energy: 0.40561726309180896
Energy: 1.8453889326963049
Energy: 1.0719588345963502
Energy: 1.8453574343505634
Energy: 1.0719588345951918
Energy: 1.845446182530408
Energy: 1.0719588345963502
Energy: 1.845596597501428
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 1.8455342175943212
Energy: 1.0719588345963502
Energy: 1.8453478142427224
Energy: 1.0719588345951918
Energy: 1.8455127700054035
Energy: 1.0719588345963502
Energy: 1.8455726693837875
Energy: 0.40561726309296753
Energy: 0.3202044397385188
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 0.3202044397396774
Energy: 0.40561726309296753
Energy: 1.8454327826202293
Energy: 1.0719588345951918
Energy: 1.8454091896746563
Energy: 1.0719588345951918
Energy: 1.845346340930134
Energy: 1.0719588345951918
Energy: 1.8455318410596067
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309180896
Energy: 0.3202044397396774
Energy: 0.40561726309065044
Energy: 1.8454925173313201
Energy: 1.0719588345951918
Energy: 1.8453652757088341
Energy: 1.0719588345951918
Energy: 1.8455638276253843
Energy: 1.0719588345951918
Energy: 1.8455260601084236

minimum gb energy = 0.3202044397385188 eV
minimum distance =  2.24485603189988 Angstroms
sigma value = 23