Model name: model_name=EAM_Dynamo_AcklandBaconCalder_1997_Fe__MO_142799717516_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.680044695734978
cohesive_energy=4.26217454226904
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.017990714421601647
Energy: 0.4218484849029589
Energy: 0.4218484849043537
Energy: 0.017990714421601647
Energy: 0.4218484849043537
Energy: 0.4218484849043537
Energy: 0.017990714421601647
Energy: 0.4218484849043537
Energy: 0.4218484849043537
Energy: 0.017990714421601647
Energy: 2.3314833243987554
Energy: 0.021276135133613698
Energy: 0.4207753070473564
Energy: 2.3314833243987554
Energy: 0.021276135133613698
Energy: 0.4207753070473564
Energy: 2.3314833243987554
Energy: 0.021276135133613698
Energy: 0.4207753070473564
Energy: 2.3314833243987554
Energy: 0.5232661041286564
Energy: 0.8138390529090476
Energy: 0.8138390529090476
Energy: 0.523043272085982
Energy: 0.8138390529076526
Energy: 0.8138390529076526
Energy: 0.9557408269874457
Energy: 0.6534474127250324
Energy: 0.9970331823430899
Energy: 0.9557378449513042
Energy: 2.331483324397361
Energy: 0.4207753070473564
Energy: 0.021276135133613698
Energy: 2.3314833243987554
Energy: 0.4207753070487512
Energy: 0.021276135133613698
Energy: 2.331483324397361
Energy: 0.4207753070473564
Energy: 0.021276135133613698
Energy: 2.3314833243987554
Energy: 0.017990714421601647
Energy: 0.4218484849043537
Energy: 0.4218484849043537
Energy: 0.017990714421601647
Energy: 0.4218484849043537
Energy: 0.4218484849043537
Energy: 0.017990714421601647
Energy: 0.4218484849043537
Energy: 0.4218484849043537
Energy: 0.017990714421601647
Energy: 2.3314833243987554
Energy: 0.021276135133613698
Energy: 0.4207753070487512
Energy: 2.3314833243987554
Energy: 0.021276135133613698
Energy: 0.4207753070473564
Energy: 2.331483324397361
Energy: 0.021276135133613698
Energy: 0.4207753070487512
Energy: 2.3314833243987554
Energy: 0.9556840324746161
Energy: 1.1733807516830268
Energy: 0.018721172834424094
Energy: 0.9557481380475169
Energy: 1.1733807516830268
Energy: 0.018721172834424094
Energy: 0.9557441940803973
Energy: 1.1733807516830268
Energy: 0.45228389651840595
Energy: 0.9557146143473069

minimum gb energy = 0.017990714421601647 eV
minimum distance =  2.31937786707552 Angstroms
sigma value = 3


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

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Energy: 1.0900049448737545
Energy: 1.0884769593131307
Energy: 1.0775750784737543
Energy: 1.0900049448771714
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Energy: 1.0900049448737545
Energy: 1.0884769593028807
Energy: 1.0775750784771712
Energy: 1.1651575697480239
Energy: 0.9353875242340575
Energy: 1.0364085454435201
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Energy: 1.063652529097217
Energy: 1.0982008097374396
Energy: 1.3249359385160315
Energy: 1.0619707753197334
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Energy: 1.0778553806339848
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Energy: 0.8561626403040407
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Energy: 1.1371356016244498
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Energy: 0.9966701875628783
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Energy: 1.1407699935560256
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Energy: 1.1472597532286328
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Energy: 1.1915540006410188
Energy: 1.2159153119415655
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Energy: 0.8565658691657482
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Energy: 0.8565658691725815
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Energy: 1.3726465453589112
Energy: 1.1622038288345446
Energy: 0.9441393233537544
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Energy: 1.162203828837961
Energy: 0.9441393233503376
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Energy: 0.9993680344644019
Energy: 1.1075041767515033
Energy: 0.935403039555275
Energy: 0.9993680344678187
Energy: 1.1075041767446698
Energy: 0.93535848717982
Energy: 0.9993680344745899
Energy: 1.1075041767583365
Energy: 0.9354030395586919
Energy: 0.9993680344678187
Energy: 1.1809694570173377
Energy: 1.0900049448703377
Energy: 1.0884769593131307
Energy: 1.0775750784771712
Energy: 1.0900049448737545
Energy: 1.0884769593062973
Energy: 1.1809694570207543
Energy: 1.0900049448737545
Energy: 1.0884769593028807
Energy: 1.0775750784771712
Energy: 1.1651575697480239
Energy: 0.9353875242340575
Energy: 1.0364085454435201
Energy: 1.1651575697514405
Energy: 0.9353875242443076
Energy: 1.0364085454435201
Energy: 1.1651575697480239
Energy: 0.9353875242408908
Energy: 1.0364085454401035
Energy: 1.1651575697446073
Energy: 1.063652529097217
Energy: 1.098200809744273
Energy: 1.324935938512615
Energy: 1.0619707753197334
Energy: 1.0982008097374396
Energy: 1.3249359385160315
Energy: 1.0636525291006338
Energy: 1.098200809744273
Energy: 1.324935938512615
Energy: 1.0619707753197334
Energy: 1.0889766327158492
Energy: 1.077855396610244
Energy: 0.8561776579368487
Energy: 1.0889766327056614
Energy: 1.0778553801114772
Energy: 0.8561776579436823
Energy: 1.088976632709078
Energy: 1.0778552514716402
Energy: 0.8561776579436823
Energy: 1.088976632709078

minimum gb energy = 0.7956389582452233 eV
minimum distance =  2.38428814302662 Angstroms
sigma value = 75


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

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Energy: 1.0402222649593909
Energy: 1.0397990629624339
Energy: 1.1745336793936052
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minimum gb energy = 1.0390534328357601 eV
minimum distance =  2.30392485983907 Angstroms
sigma value = 105


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

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Energy: 1.2580255453503728
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Energy: 1.2659907094862595
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Energy: 1.2659907094843785
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Energy: 1.20333402979948
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Energy: 1.20333402979948
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Energy: 1.119544426384803
Energy: 1.227475511184919
Energy: 1.117935040724049
Energy: 1.119544426384803
Energy: 1.227475511184919
Energy: 1.11793504072593
Energy: 1.119544426382922
Energy: 1.2274755111867999
Energy: 1.037446697024015
Energy: 1.2763668719367678
Energy: 1.2163598010040282
Energy: 1.0374466970258958
Energy: 1.2763769735640687
Energy: 1.2163598010040282
Energy: 1.0374466970258958
Energy: 1.2763668719405297
Energy: 1.2163598010040282
Energy: 1.0374466970277765
Energy: 1.2793877842817742
Energy: 1.2763901160984825
Energy: 1.3025317650190507
Energy: 1.2793877842798935
Energy: 1.2759242171121536
Energy: 1.3025317650190507
Energy: 1.2793877842780126
Energy: 1.2763901160984825
Energy: 1.3025317650209314
Energy: 1.2793877842798935
Energy: 1.1147084482571392
Energy: 1.2132404786138336
Energy: 1.2809037278332864
Energy: 1.1147084482590202
Energy: 1.2132404786119524
Energy: 1.2809037278314055
Energy: 1.1147084482571392
Energy: 1.2132404786119524
Energy: 1.2809037278295248
Energy: 1.1147084482571392
Energy: 1.310013654962867
Energy: 1.3628756895764271
Energy: 1.2053992355519745
Energy: 1.3100136549647476
Energy: 1.364891310484523
Energy: 1.2053992355519745
Energy: 1.3100136549647476
Energy: 1.3628756895764271
Energy: 1.2053992355500935
Energy: 1.3100136549647476
Energy: 1.3342772081802647
Energy: 1.2637043367262693
Energy: 1.395362123917532
Energy: 1.3342772081802647
Energy: 1.26383036870425
Energy: 1.3953621239194125
Energy: 1.3342772081802647
Energy: 1.26370433672815
Energy: 1.395362123917532
Energy: 1.3342772081821457
Energy: 1.1979235720640307
Energy: 1.2453799328840325
Energy: 1.2965097096039144
Energy: 1.1979235720640307
Energy: 1.2453880683335625
Energy: 1.2965097096020337
Energy: 1.1979235720621497
Energy: 1.2453799328840325
Energy: 1.2965097096020337
Energy: 1.1979235720640307

minimum gb energy = 1.0364839695305124 eV
minimum distance =  2.31030735596282 Angstroms
sigma value = 165


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

Energy: 1.319507939330167
Energy: 1.2557605747248555
Energy: 1.2669909798366876
Energy: 1.259070643885207
Energy: 1.2557605747242095
Energy: 1.266990993290241
Energy: 1.3195079393282299
Energy: 1.2557605747267924
Energy: 1.2669909954517389
Energy: 1.259070643885207
Energy: 1.305860816427439
Energy: 1.2392953772657127
Energy: 1.325757683000717
Energy: 1.3058608323625795
Energy: 1.239295377265067
Energy: 1.32575768299878
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Energy: 1.3257576829981341
Energy: 1.3058608262234157
Energy: 1.2047925392090977
Energy: 1.2412008104793164
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Energy: 1.2412008104780252
Energy: 1.1786906053263193
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Energy: 1.2412008104806078
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Energy: 1.3198230939751396
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Energy: 1.238547325454488
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Energy: 1.3215720471458954
Energy: 1.2673123594370057
Energy: 1.308584259664355
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Energy: 1.2674620574414608
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Energy: 1.3215720471452497
Energy: 1.2673123594357143
Energy: 1.3085842596656467
Energy: 1.2859648289790908
Energy: 1.2788072745981887
Energy: 1.3727830300981856
Energy: 1.2394880114698958
Energy: 1.2788072745988344
Energy: 1.3727830300981856
Energy: 1.2859648289803234
Energy: 1.2788072745988344
Energy: 1.3727830300981856
Energy: 1.239488011467959
Energy: 1.2600251326672787
Energy: 1.1927581687688966
Energy: 1.3801745288645932
Energy: 1.1899671017908284
Energy: 1.1927581692329763
Energy: 1.2667720981514206
Energy: 1.2600251326679246
Energy: 1.192758168637879
Energy: 1.380174528865239
Energy: 1.1899671017869542
Energy: 1.2801450988083427
Energy: 1.238349976247918
Energy: 1.2779260797184433
Energy: 1.2801450980835192
Energy: 1.2383499762459809
Energy: 1.2779260798171763
Energy: 1.280145104457599
Energy: 1.2383499762466268
Energy: 1.2779260798068452
Energy: 1.2801450879428578
Energy: 1.2477713664721786
Energy: 1.17545639983973
Energy: 1.303665993954846
Energy: 1.2477725758531284
Energy: 1.1754563998390843
Energy: 1.3036659939503261
Energy: 1.247772546062342
Energy: 1.1754563998410217
Energy: 1.3036659939509718
Energy: 1.2477731393061464
Energy: 1.2982137533322087
Energy: 1.3504974643531131
Energy: 1.2382500232945357
Energy: 1.298213753331563
Energy: 1.3504974641794798
Energy: 1.2382500232951814
Energy: 1.2982137533328542
Energy: 1.3504974641652743
Energy: 1.2382500232945357
Energy: 1.2982137533341458
Energy: 1.2590706438845614
Energy: 1.2557605747267924
Energy: 1.266990977076277
Energy: 1.2590706438845614
Energy: 1.2557605747248555
Energy: 1.2669909869019558
Energy: 1.2590706438845614
Energy: 1.2557605747261467
Energy: 1.2669910003884397
Energy: 1.2590706438858528

minimum gb energy = 1.1754563998390843 eV
minimum distance =  2.3520594264839 Angstroms
sigma value = 41


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

Energy: 1.4483603045543372
Energy: 1.0989986896985058
Energy: 1.062098039237033
Energy: 1.3684853147907379
Energy: 1.0989986896985058
Energy: 1.062098039239538
Energy: 1.448360304551832
Energy: 1.0989986896985058
Energy: 1.062098039237033
Energy: 1.3684853147907379
Energy: 1.1416360917076898
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Energy: 1.1416360917076898
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Energy: 1.075716128759972
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Energy: 1.1230508625093714
Energy: 1.0805745890266296
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Energy: 1.0396893760696426
Energy: 1.04673379109243
Energy: 1.0299157838041149
Energy: 1.0321980204700418
Energy: 0.9898700165905558
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Energy: 1.0299157838016098
Energy: 1.0321980204650314
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Energy: 1.0299157838041149
Energy: 1.0341927499509613
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Energy: 0.9981887396449128
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Energy: 0.954172538088501
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Energy: 1.034465339685597
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Energy: 0.9856328989237131
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Energy: 1.094281665526078
Energy: 1.0497886485799863
Energy: 0.9856328989212078
Energy: 1.1115675184342229
Energy: 0.9328886901330813
Energy: 1.1282671699657025
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Energy: 0.9328886901330813
Energy: 1.1282671699631972
Energy: 1.111567518436728
Energy: 0.9328886901330813
Energy: 1.1282671699657025
Energy: 1.1115675184342229
Energy: 1.0565755951659228
Energy: 0.9583980386102542
Energy: 0.992023762827314
Energy: 1.0565755951634177
Energy: 0.958398038607749
Energy: 0.9921975265946992
Energy: 1.0565755951659228
Energy: 0.9583980386102542
Energy: 0.9920237628323243
Energy: 1.0565755951659228
Energy: 1.132974999875111
Energy: 1.1378110156249328
Energy: 0.9818951920360799
Energy: 1.1329749998801215
Energy: 1.137811015654996
Energy: 0.9816584598270037
Energy: 1.132974999875111
Energy: 1.13781101564247
Energy: 0.9818951920335747
Energy: 1.1329749998801215
Energy: 0.9972730357899858
Energy: 1.3237822920617672
Energy: 1.0379136093075172
Energy: 0.9972730357899858
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Energy: 1.0379136093100225
Energy: 0.9972730357924909
Energy: 1.3237822920617672
Energy: 1.0379136093100225
Energy: 0.9972730357874806
Energy: 0.9805382260437561
Energy: 0.9861066894984907
Energy: 0.9842438956660506
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Energy: 0.9842438956585349
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Energy: 0.9842438956585349
Energy: 0.9805382260462614
Energy: 1.015860958789541
Energy: 1.1114188295609349
Energy: 1.0566537326457859
Energy: 1.0158609587920462
Energy: 1.1114188295634404
Energy: 1.0566537326457859
Energy: 1.0158609587945515
Energy: 1.1114188295634404
Energy: 1.0566537326482912
Energy: 1.0158609587945515
Energy: 1.1179424984195399
Energy: 0.9357533905184287
Energy: 1.080644487583525
Energy: 1.1179424984195399
Energy: 0.9357533905184287
Energy: 1.080644487570999
Energy: 1.1179424984195399
Energy: 0.935753390520934
Energy: 1.0806444875810202
Energy: 1.1179424984195399
Energy: 1.0985389442079836
Energy: 1.0782110612359257
Energy: 1.0454938515095087
Energy: 1.0985389442079836
Energy: 1.0782110612359257
Energy: 1.3663462514189926
Energy: 1.098538944205478
Energy: 1.0782110612434415
Energy: 1.0454938515070036
Energy: 1.0985389442104887
Energy: 0.9347340988741194
Energy: 1.0709046099073383
Energy: 1.0210419743648873
Energy: 0.9347340988741194
Energy: 1.1186324426094332
Energy: 1.0002758756145196
Energy: 0.9347340988791301
Energy: 1.0709046099073383
Energy: 1.0210419743673924
Energy: 0.9347340988766247
Energy: 0.9520579253798938
Energy: 1.0316041885733886
Energy: 1.0322657737606094
Energy: 0.9520579253823991
Energy: 1.0317054903238643
Energy: 1.0326502788495413
Energy: 0.9520579253773886
Energy: 1.0316041885733886
Energy: 1.032265773763115
Energy: 0.9520579253823991
Energy: 1.042569610085954
Energy: 0.9970689666027677
Energy: 1.086669312184469
Energy: 1.042569610083449
Energy: 0.9969968940367319
Energy: 1.086669312184469
Energy: 1.0425696100809438
Energy: 0.9970689666027677
Energy: 1.0866693121869742
Energy: 1.042569610083449
Energy: 1.2039933634149205
Energy: 0.9810782930719715
Energy: 1.104815180834857
Energy: 1.203993363417426
Energy: 0.981055245256215
Energy: 1.104815180837362
Energy: 1.2039933634149205
Energy: 0.9810782930719715
Energy: 1.104815180837362
Energy: 1.203993363417426
Energy: 1.2438310248911502
Energy: 1.0981625530973755
Energy: 0.9824271577740552
Energy: 1.2438310248936557
Energy: 1.0981625530973755
Energy: 0.9824271577740552
Energy: 1.2438310248911502
Energy: 1.0981625530973755
Energy: 0.9824271577690445
Energy: 1.2438310248961606

minimum gb energy = 0.9328886901330813 eV
minimum distance =  2.29606411519765 Angstroms
sigma value = 185


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

Energy: 1.009802761516463
Energy: 0.6268118708405571
Energy: 0.6251157796638542
Energy: 0.6858039415419553
Energy: 0.6268118708417466
Energy: 0.6251157796647194
Energy: 1.0098027615206266
Energy: 0.6268118708455857
Energy: 0.625115779665909
Energy: 0.685803941541685
Energy: 0.899863334315771
Energy: 0.6203615016513331
Energy: 0.7649466737571564
Energy: 0.7800424081258376
Energy: 0.6203615016510629
Energy: 0.7927651917628542
Energy: 0.8998633343169609
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Energy: 0.7649466737571564
Energy: 0.7800424081267026
Energy: 0.7430514310151207
Energy: 0.6212253128275993
Energy: 0.638504858131051
Energy: 0.7436074993147028
Energy: 0.6212253128225166
Energy: 0.6386539006106997
Energy: 0.7430514310163102
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Energy: 0.7436074993164871
Energy: 0.9843517995692762
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Energy: 0.8151624228291756
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Energy: 0.8151624228273913
Energy: 0.9843517995686815
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Energy: 0.6184367092078906
Energy: 0.5400182947680997
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Energy: 0.6184367092075662
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Energy: 0.7095339831206617
Energy: 0.9355909711164387
Energy: 0.8063037963878777
Energy: 0.7750860737981625
Energy: 0.9355909711182231
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Energy: 0.8063037963866883
Energy: 0.7750860737967026
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Energy: 0.7086112937422663
Energy: 0.7760189843376688
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Energy: 0.7086112937386977
Energy: 0.8162258596452877
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Energy: 0.776018984340048
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Energy: 0.9526853810541636
Energy: 0.5879603850784475
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Energy: 0.952685381052974
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Energy: 0.9526853810535688
Energy: 0.6739984695065122
Energy: 0.7356310501531771
Energy: 0.6194174114817649
Energy: 0.6326462990754231
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Energy: 0.6194174114832247
Energy: 0.6739984695118653
Energy: 0.7356310501529068
Energy: 0.6194174114799805
Energy: 0.6326462990703946
Energy: 0.6852348884946474
Energy: 0.5943840585370628
Energy: 0.6230235535514035
Energy: 0.6849569686018211
Energy: 0.5881312044429574
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Energy: 0.5943840585331698
Energy: 0.6230235535486999
Energy: 0.6849569686038757
Energy: 0.8647433465442419
Energy: 0.8838186669468032
Energy: 0.6294456273947245
Energy: 0.790821780124923
Energy: 0.8838186669485875
Energy: 0.62944562739267
Energy: 0.8647433465475401
Energy: 0.883818666947398
Energy: 0.6294456273923456
Energy: 0.790821780127897
Energy: 0.7829978132785721
Energy: 0.6268118708393675
Energy: 0.6251157796653142
Energy: 0.5683250117451996
Energy: 0.6268118708429362
Energy: 0.625115779665909
Energy: 0.782997813274679
Energy: 0.6268118708453153
Energy: 0.6251157796680177
Energy: 0.568325011745524
Energy: 0.8593460558428224
Energy: 0.6203615016495488
Energy: 0.8229522070349783
Energy: 0.7800424081243236
Energy: 0.6203615016483593
Energy: 0.7623351807438344
Energy: 0.8593460558422278
Energy: 0.6203615016516576
Energy: 0.8229522070337888
Energy: 0.780042408127027
Energy: 0.6849705358378166
Energy: 0.6212253128225166
Energy: 0.5878590950228044
Energy: 0.6848730865802033
Energy: 0.6212253128207863
Energy: 0.5889968812445928
Energy: 0.6849705358384114
Energy: 0.6212253128246253
Energy: 0.5878590950186411
Energy: 0.6848730865802033
Energy: 0.9843517995674917
Energy: 0.6204987849711534
Energy: 0.813743378848068
Energy: 0.9843517995678164
Energy: 0.6204987849743976
Energy: 0.7357995768460955
Energy: 0.9843517995663023
Energy: 0.6204987849738028
Energy: 0.8137433788513122
Energy: 0.9843517995672214
Energy: 0.7095339831215268
Energy: 0.6184367092114593
Energy: 0.6757454492367905
Energy: 0.7095339831212565
Energy: 0.6184367092099453
Energy: 0.5879794170903778
Energy: 0.7095339831221216
Energy: 0.6184367092099453
Energy: 0.6757454492367905
Energy: 0.7095339831206617
Energy: 0.9355909711176282
Energy: 0.7112885828242048
Energy: 0.7750860737967026
Energy: 0.9355909711194127
Energy: 0.7442145022113638
Energy: 0.7377087544767128
Energy: 0.9355909711182231
Energy: 0.711288582825124
Energy: 0.7750860737957834
Energy: 0.9355909711173038
Energy: 0.7086112937422663
Energy: 0.7761912666202541
Energy: 0.8887906108297909
Energy: 0.7086112937386977
Energy: 0.7761912666211191
Energy: 0.8887906108306559
Energy: 0.7086112937375082
Energy: 0.776191266622579
Energy: 0.8887906108315751
Energy: 0.7086112937372377
Energy: 0.9526853810511897
Energy: 0.5386698896393403
Energy: 0.6183548853560967
Energy: 0.9526853810523792
Energy: 0.62700513977183
Energy: 0.6183548853543126
Energy: 0.9526853810520548
Energy: 0.5386698896396647
Energy: 0.6183548853545829
Energy: 0.9526853810517846
Energy: 0.6739984695053227
Energy: 0.7356310501537718
Energy: 0.619417411483495
Energy: 0.6980155944749713
Energy: 0.7751577176823093
Energy: 0.6194174114832247
Energy: 0.6739984695094862
Energy: 0.7356310501540962
Energy: 0.6194174114811701
Energy: 0.6980155944761608
Energy: 0.7432851714211822
Energy: 0.6382589151229722
Energy: 0.6230235535502139
Energy: 0.7437396223167148
Energy: 0.6379534290750912
Energy: 0.6230235535496191
Energy: 0.7432851714241561
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Energy: 0.8838186669462085
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Energy: 0.8403115609352958
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Energy: 0.6294456273902909
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Energy: 0.8838186669477224
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Energy: 0.625115779665909
Energy: 0.6858039415410903
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Energy: 0.6251157796665038
Energy: 1.0098027615230056
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Energy: 0.625115779668288
Energy: 0.6858039415410903
Energy: 0.8998633343149061
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Energy: 0.7800424081261079
Energy: 0.7430514310142015
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Energy: 0.6385048581289423
Energy: 0.7436074993158923
Energy: 0.6212253128201916
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Energy: 0.7430514310157156
Energy: 0.6212253128201916
Energy: 0.6385048581301319
Energy: 0.7436074993180011
Energy: 0.9843517995692762
Energy: 0.6204987849726132
Energy: 0.8151624228285809
Energy: 0.9843517995690059
Energy: 0.620498784974722
Energy: 0.7357995768466904
Energy: 0.9843517995674917
Energy: 0.6204987849738028
Energy: 0.8151624228276617
Energy: 0.9843517995690059
Energy: 0.7095339831215268
Energy: 0.6184367092123245
Energy: 0.6269941318308188
Energy: 0.7095339831218512
Energy: 0.6184367092108646
Energy: 0.5400182947719387
Energy: 0.7095339831212565
Energy: 0.6184367092111348
Energy: 0.6269941318272503
Energy: 0.7095339831221216
Energy: 0.9355909711176282
Energy: 0.8063037963878777
Energy: 0.775086073796973
Energy: 0.9355909711194127
Energy: 0.7679847810559352
Energy: 0.7377087544769831
Energy: 0.935590971118818
Energy: 0.806303796387283
Energy: 0.7750860737961079
Energy: 0.9355909711176282
Energy: 0.7086112937416715
Energy: 0.7760189843364793
Energy: 0.8887906108294665
Energy: 0.7086112937392924
Energy: 0.8162258596449634
Energy: 0.8887906108294665
Energy: 0.7086112937372377
Energy: 0.7760189843388583
Energy: 0.8887906108306559
Energy: 0.7086112937381029
Energy: 0.9526853810550285
Energy: 0.5879603850799074
Energy: 0.618354885359341
Energy: 0.9526853810547582
Energy: 0.6757893562737775
Energy: 0.6183548853572864
Energy: 0.9526853810547582
Energy: 0.5879603850766632
Energy: 0.6183548853557723
Energy: 0.9526853810511897
Energy: 0.6739984695038088
Energy: 0.7356310501525823
Energy: 0.6194174114805753
Energy: 0.632646299070719
Energy: 0.7756283927747889
Energy: 0.6194174114829003
Energy: 0.6739984695071072
Energy: 0.7356310501519876
Energy: 0.6194174114784666
Energy: 0.6326462990703946
Energy: 0.685234888494377
Energy: 0.594384058537928
Energy: 0.6230235535510791
Energy: 0.6849569686018211
Energy: 0.5881312044435522
Energy: 0.6230235535514035
Energy: 0.6852348884937822
Energy: 0.5943840585343593
Energy: 0.6230235535484295
Energy: 0.6849569686036053
Energy: 0.8647433465460261
Energy: 0.8838186669483171
Energy: 0.6294456273923456
Energy: 0.790821780124058
Energy: 0.8838186669497771
Energy: 0.6294456273908855
Energy: 0.8647433465490001
Energy: 0.8838186669485875
Energy: 0.6294456273920752
Energy: 0.7908217801273022

minimum gb energy = 0.5386698896393403 eV
minimum distance =  2.39599791918461 Angstroms
sigma value = 33


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

Energy: 1.0079761614528877
Energy: 1.0586920819545502
Energy: 1.0582025996359485
Energy: 1.0079761614545204
Energy: 1.058692081956183
Energy: 1.0582025996359485
Energy: 1.0079761614528877
Energy: 1.0586920819545502
Energy: 1.0582025996359485
Energy: 1.0079761614528877
Energy: 0.952952497071759
Energy: 0.9618907535942255
Energy: 0.960642346112984
Energy: 0.9529524970684938
Energy: 0.9618907535925928
Energy: 0.960642346112984
Energy: 0.9529524970733916
Energy: 0.9618907535942255
Energy: 0.960642346112984
Energy: 0.9529524970733916
Energy: 1.02134527218096
Energy: 0.9699966219889613
Energy: 0.9752545572894039
Energy: 1.022729683119405
Energy: 0.9699966219905939
Energy: 0.975254557292669
Energy: 1.0256944774412564
Energy: 0.9699966219922264
Energy: 0.9752545572894039
Energy: 1.0296688872713837
Energy: 1.0059016420993738
Energy: 0.9611865369415439
Energy: 1.1526086603657566
Energy: 1.0059016420993738
Energy: 0.9611865369415439
Energy: 1.152608660364124
Energy: 1.0059016420993738
Energy: 0.9611865369415439
Energy: 1.1526086603657566
Energy: 1.0059016420977414
Energy: 1.0218902944288137
Energy: 0.9668089088680396
Energy: 0.9739646031819771
Energy: 1.0218902944271813
Energy: 0.9668089088696721
Energy: 0.9739646031819771
Energy: 1.0218902944271813
Energy: 0.9668089088680396
Energy: 0.9739646031819771
Energy: 1.0218902944255488
Energy: 1.1188691435794267
Energy: 1.0182038377970486
Energy: 1.0752890316519568
Energy: 1.1188691435777942
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Energy: 1.0182038377970486
Energy: 1.075289031650324
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Energy: 0.9725690298885583
Energy: 0.9948975229354258
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Energy: 1.138956956383032
Energy: 0.9725690298885583
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Energy: 0.9725690298885583
Energy: 1.1331667314250053
Energy: 0.9677013966260136
Energy: 0.8959242171788999
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Energy: 0.9926602836194474
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Energy: 1.055584803539696
Energy: 1.1006286500337017
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Energy: 0.9822381085049338
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Energy: 1.030291020776578
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Energy: 1.016916100059175
Energy: 1.0460850104061719
Energy: 1.073325524183648
Energy: 1.0169161000608076
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Energy: 1.0733255241820152
Energy: 1.0169161000608076
Energy: 1.0460850104061719
Energy: 1.073325524183648
Energy: 1.0169161000608076
Energy: 0.9599311521183836
Energy: 1.0515987723226572
Energy: 1.131548582506826
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Energy: 1.1315485825084586
Energy: 0.9599311521183836
Energy: 1.0515987723275253
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Energy: 0.9599311521183836
Energy: 0.9690693386453451
Energy: 1.018760909560497
Energy: 0.9951468695221525
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Energy: 1.018760909560497
Energy: 0.9951468695188874
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Energy: 1.018760909560497
Energy: 0.9951468695188874
Energy: 0.9690693386469776
Energy: 0.9643193340548002
Energy: 1.002701469065842
Energy: 0.9743374217131527
Energy: 0.9643193340564328
Energy: 1.002701469065842
Energy: 0.9743374217098876
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Energy: 1.002701469065842
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Energy: 0.9643193340564328
Energy: 1.0594422451648078
Energy: 1.0106633116192798
Energy: 1.0461937777127153
Energy: 1.0594422451664107
Energy: 1.0106633116176473
Energy: 1.0461937777127153
Energy: 1.0594422451664107
Energy: 1.0106633116192798
Energy: 1.0461937777127153
Energy: 1.0594422451648078
Energy: 0.9626000406195375
Energy: 0.9155900233191654
Energy: 0.9646297616551579
Energy: 0.9626000406211701
Energy: 0.9155900233191654
Energy: 0.9646297616551579
Energy: 0.9626000406195375
Energy: 0.9155900233224306
Energy: 0.9646297616551579
Energy: 0.9626000406211701
Energy: 0.9919913119486842
Energy: 1.1009261750740456
Energy: 0.9649431701558285
Energy: 0.9919913119405215
Energy: 1.1009261750740456
Energy: 0.9649431701541958
Energy: 0.991991311945419
Energy: 1.1009261750740456
Energy: 0.9649431701541958
Energy: 0.9919913119437865
Energy: 1.1147453887483603
Energy: 1.0524809046357688
Energy: 0.9675396301865435
Energy: 1.1147453887483603
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Energy: 0.9829676944459279
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Energy: 1.031271989958649
Energy: 0.9878324805940153
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Energy: 1.031271989955384
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Energy: 1.031271989958649
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Energy: 1.1447658131988638
Energy: 0.954854058575993
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Energy: 1.1447658132004963
Energy: 0.9548540585776257

minimum gb energy = 0.8959242171772672 eV
minimum distance =  2.38646067430535 Angstroms
sigma value = 219


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

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Energy: 1.4220655094568435
Energy: 1.4226710043654904
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Energy: 1.3891767589537931
Energy: 1.4114622014098026
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Energy: 1.4215052042385616
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Energy: 1.2897973383506893
Energy: 1.2455896002259887
Energy: 1.4665016946958696
Energy: 1.2897973383485284
Energy: 1.245589600227069

minimum gb energy = 1.2164105808084338 eV
minimum distance =  2.32702576798401 Angstroms
sigma value = 15


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

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Energy: 1.4654089709034912
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minimum gb energy = 1.3617108174094952 eV
minimum distance =  2.30229677745744 Angstroms
sigma value = 293


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

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Energy: 1.4390364380415206
Energy: 1.4843122297148463
Energy: 1.430984565919403
Energy: 1.4390364380395682
Energy: 1.4843122297150684
Energy: 1.569113242903051
Energy: 1.5858474270433753
Energy: 1.4380784785916547
Energy: 1.5691132429045151
Energy: 1.5858474270470138
Energy: 1.4380784785921428
Energy: 1.569113242904293
Energy: 1.5858474270463039
Energy: 1.4380784785921428
Energy: 1.5691132429035388
Energy: 1.4922277642958988
Energy: 1.4908718416345483
Energy: 1.4277603939326722
Energy: 1.4922277642961208
Energy: 1.4908718416357463
Energy: 1.427760393937065
Energy: 1.492227764296387
Energy: 1.4908718416328177
Energy: 1.427760393938263
Energy: 1.4922277642956328
Energy: 1.5694656091013772
Energy: 1.4383460962093002
Energy: 1.5861518145091087
Energy: 1.5694656091011554
Energy: 1.438346096212495
Energy: 1.586151814509375
Energy: 1.5694656091021315
Energy: 1.438346096212229
Energy: 1.586151814509375
Energy: 1.5694656091011554
Energy: 1.4847216377425447
Energy: 1.4387435618567437
Energy: 1.4308044291557915
Energy: 1.4847216377425447
Energy: 1.4387435618562554
Energy: 1.4308044291565014
Energy: 1.4847216377430328
Energy: 1.4387435618559894
Energy: 1.4308044291555253
Energy: 1.4847216377425447
Energy: 1.4395367478583205
Energy: 1.5024964403526566
Energy: 1.6636394124608627
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Energy: 1.663639412461085
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Energy: 1.7102768855836452
Energy: 1.4377204526504572
Energy: 1.4355424892266524
Energy: 1.7102768855836452
Energy: 1.4377204526516552
Energy: 1.4355424892268742
Energy: 1.7102768855834234
Energy: 1.4377204526514336
Energy: 1.4355424892268742
Energy: 1.7102768855841333
Energy: 1.514907217222187
Energy: 1.6365746012306497
Energy: 1.455351174983489
Energy: 1.5149072172219205
Energy: 1.6365746012303837
Energy: 1.455351174983489
Energy: 1.5149072172214326
Energy: 1.6365746012306497
Energy: 1.455351174983489
Energy: 1.5149072172216989
Energy: 1.439550489052956
Energy: 1.4468763571712073
Energy: 1.6382716341661057
Energy: 1.439550489052734
Energy: 1.446876357170941
Energy: 1.6382716341653512
Energy: 1.4395504890534443
Energy: 1.4468763571712073
Energy: 1.6382716341663275
Energy: 1.439550489052956
Energy: 1.683550693158512
Energy: 1.5169746121407244
Energy: 1.516875290904679
Energy: 1.683550693157314
Energy: 1.5169746121405026
Energy: 1.516875290904679
Energy: 1.683550693157536
Energy: 1.5169746121409906
Energy: 1.5168752909049008
Energy: 1.6835506931568258
Energy: 1.439496006537435
Energy: 1.6382333549328982
Energy: 1.4472509114188026
Energy: 1.4394960065354825
Energy: 1.6382333549333863
Energy: 1.4472509114209766
Energy: 1.4394960065364588
Energy: 1.6382333549328982
Energy: 1.447250911421953
Energy: 1.4394960065362368
Energy: 1.5466531586019938
Energy: 1.4554301695223542
Energy: 1.6366435831525932
Energy: 1.5466531586017274
Energy: 1.4554301695225762
Energy: 1.6366435831523714
Energy: 1.5466531586012393
Energy: 1.4554301695228424
Energy: 1.6366435831518833
Energy: 1.5466531586017274
Energy: 1.7107628240456987
Energy: 1.4364944528721002
Energy: 1.4377999109209836
Energy: 1.710762824046675
Energy: 1.436494452874541
Energy: 1.4377999109212052
Energy: 1.7107628240459207
Energy: 1.436494452875783
Energy: 1.4377999109204953
Energy: 1.7107628240459207
Energy: 1.4394763296964663
Energy: 1.663870542025256
Energy: 1.5026012604589944
Energy: 1.4394763296964663
Energy: 1.6638705420242799
Energy: 1.5026012604589944
Energy: 1.4394763296969546
Energy: 1.6638705420247677
Energy: 1.5026012604587282
Energy: 1.4394763296969546

minimum gb energy = 1.4277603939273031 eV
minimum distance =  2.31050724296022 Angstroms
sigma value = 293


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

Energy: 1.570938500014836
Energy: 1.5112103757739141
Energy: 1.5109544688105485
Energy: 1.570938500015718
Energy: 1.511210375774796
Energy: 1.510954468811431
Energy: 1.570938500014836
Energy: 1.5112103757725905
Energy: 1.51095446881099
Energy: 1.570938500015718
Energy: 1.5694147978076023
Energy: 1.5713317390761006
Energy: 1.5723023666566702
Energy: 1.5694147978049557
Energy: 1.5713317390765416
Energy: 1.5723023666584346
Energy: 1.5694147978076023
Energy: 1.5713317390761006
Energy: 1.5723023666562288
Energy: 1.569414797805397
Energy: 1.5093536583471532
Energy: 1.5092232771869993
Energy: 1.461629527056588
Energy: 1.50935365834583
Energy: 1.5092232771839116
Energy: 1.4616210493923085
Energy: 1.50935365834583
Energy: 1.5092232771847935
Energy: 1.4616340591800985
Energy: 1.509353658345389
Energy: 1.4616040758718054
Energy: 1.5092001077687638
Energy: 1.5092478711111457
Energy: 1.461638633770953
Energy: 1.5092001077678814
Energy: 1.5092478711137922
Energy: 1.4616156562367228
Energy: 1.5092001077683226
Energy: 1.5092478711107047
Energy: 1.4616403365060575
Energy: 1.5722454254340028
Energy: 1.571417149102616
Energy: 1.5693685736921745
Energy: 1.5722454254317972
Energy: 1.5714171491021751
Energy: 1.5693685736917335
Energy: 1.5722454254326794
Energy: 1.571417149102616
Energy: 1.5693685736912923
Energy: 1.5722454254340028
Energy: 1.5112103757752373
Energy: 1.5109544688101078
Energy: 1.570938500014836
Energy: 1.511210375774355
Energy: 1.5109544688096666
Energy: 1.5709385000161593
Energy: 1.5112103757752373
Energy: 1.5109544688101078
Energy: 1.570938500014836
Energy: 1.5112103757739141
Energy: 1.571331739076983
Energy: 1.5723023666575522
Energy: 1.5694147978076023
Energy: 1.5713317390761006
Energy: 1.5723023666557878
Energy: 1.569414797805838
Energy: 1.571331739076983
Energy: 1.5723023666575522
Energy: 1.5694147978071613
Energy: 1.5713317390761006
Energy: 1.5092232771830292
Energy: 1.4616097446891732
Energy: 1.5093536583467124
Energy: 1.509223277185676
Energy: 1.4616090188816617
Energy: 1.5093536583467124
Energy: 1.5092232771834704
Energy: 1.4637433224235652
Energy: 1.5093536583462712
Energy: 1.5092232771843528
Energy: 1.5092001077683226
Energy: 1.5092478711129103
Energy: 1.4631011206887439
Energy: 1.5092001077692048
Energy: 1.509247871111587
Energy: 1.4631522325107915
Energy: 1.5092001077678814
Energy: 1.5092478711133512
Energy: 1.463199057487914
Energy: 1.5092001077683226
Energy: 1.571417149102616
Energy: 1.5693685736926157
Energy: 1.572245425434885
Energy: 1.5714171491030573
Energy: 1.5693685736921745
Energy: 1.5722454254322384
Energy: 1.571417149102616
Energy: 1.5693685736926157
Energy: 1.5722454254340028
Energy: 1.5714171491030573
Energy: 1.5109544688101078
Energy: 1.5709385000161593
Energy: 1.5112103757756783
Energy: 1.5109544688105485
Energy: 1.570938500014836
Energy: 1.511210375774355
Energy: 1.5109544688096666
Energy: 1.5709385000161593
Energy: 1.5112103757752373
Energy: 1.5109544688105485
Energy: 1.5723023666557878
Energy: 1.569414797805397
Energy: 1.5713317390765416
Energy: 1.5723023666579934
Energy: 1.5694147978076023
Energy: 1.5713317390761006
Energy: 1.5723023666553468
Energy: 1.569414797805838
Energy: 1.571331739076983
Energy: 1.5723023666575522
Energy: 1.463774845704303
Energy: 1.50935365834583
Energy: 1.5092232771847935
Energy: 1.4616280654335698
Energy: 1.5093536583462712
Energy: 1.5092232771830292
Energy: 1.4637834920198551
Energy: 1.5093536583462712
Energy: 1.509223277185235
Energy: 1.4616230088438216
Energy: 1.5092478711120279
Energy: 1.463420446247557
Energy: 1.5092001077683226
Energy: 1.5092478711120279
Energy: 1.463415894565351
Energy: 1.5092001077696457
Energy: 1.509247871112469
Energy: 1.4634705420514873
Energy: 1.5092001077687638
Energy: 1.5092478711133512
Energy: 1.5693685736908514
Energy: 1.5722454254335616
Energy: 1.571417149102616
Energy: 1.5693685736917335
Energy: 1.5722454254335616
Energy: 1.5714171491030573
Energy: 1.5693685736926157
Energy: 1.5722454254335616
Energy: 1.571417149102616
Energy: 1.569368573693057
Energy: 1.570938500014836
Energy: 1.5112103757734727
Energy: 1.510954468812313
Energy: 1.570938500015718
Energy: 1.511210375774796
Energy: 1.51095446881099
Energy: 1.570938500014395
Energy: 1.5112103757730317
Energy: 1.510954468812313
Energy: 1.5709385000152774
Energy: 1.5694147978076023
Energy: 1.5713317390761006
Energy: 1.5723023666557878
Energy: 1.569414797805397
Energy: 1.5713317390765416
Energy: 1.5723023666575522
Energy: 1.5694147978071613
Energy: 1.5713317390761006
Energy: 1.5723023666557878
Energy: 1.569414797805838
Energy: 1.50935365834583
Energy: 1.5092232771834704
Energy: 1.461612017762989
Energy: 1.5093536583462712
Energy: 1.5092232771834704
Energy: 1.4616126203432689
Energy: 1.5093536583462712
Energy: 1.5092232771847935
Energy: 1.463833820591445
Energy: 1.5093536583467124
Energy: 1.4634773466244642
Energy: 1.509200107770087
Energy: 1.5092478711120279
Energy: 1.463448087588072
Energy: 1.509200107770087
Energy: 1.5092478711129103
Energy: 1.4634997007582689
Energy: 1.509200107770087
Energy: 1.5092478711111457
Energy: 1.4615267889449874
Energy: 1.5722454254340028
Energy: 1.5714171491034985
Energy: 1.569368573693498
Energy: 1.5722454254335616
Energy: 1.5714171491021751
Energy: 1.5693685736926157
Energy: 1.5722454254344438
Energy: 1.571417149102616
Energy: 1.5693685736921745
Energy: 1.5722454254335616
Energy: 1.511210375774796
Energy: 1.510954468811872
Energy: 1.570938500014395
Energy: 1.5112103757739141
Energy: 1.510954468811431
Energy: 1.570938500015718
Energy: 1.511210375774355
Energy: 1.510954468811872
Energy: 1.570938500014836
Energy: 1.5112103757734727
Energy: 1.5713317390765416
Energy: 1.572302366657111
Energy: 1.5694147978080435
Energy: 1.5713317390761006
Energy: 1.5723023666562288
Energy: 1.569414797805397
Energy: 1.5713317390765416
Energy: 1.5723023666575522
Energy: 1.5694147978076023
Energy: 1.5713317390761006

minimum gb energy = 1.4615267889449874 eV
minimum distance =  2.36452571623733 Angstroms
sigma value = 15


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

Energy: 1.5008600573711341
Energy: 1.472141441039318
Energy: 1.4718483860846363
Energy: 1.4505137517200375
Energy: 1.4721414410433171
Energy: 1.471848386078638
Energy: 1.5008600573671353
Energy: 1.4721414410373186
Energy: 1.471848386082637
Energy: 1.4505137517220372
Energy: 1.492305445145677
Energy: 1.3779299840163557
Energy: 1.3715195140779302
Energy: 1.4923054451476765
Energy: 1.3779299840163557
Energy: 1.3715195140799297
Energy: 1.4923054451476765
Energy: 1.3779299840143562
Energy: 1.3715195140799297
Energy: 1.4923054451476765
Energy: 1.5611800330914998
Energy: 1.4712071212036506
Energy: 1.5473320899034317
Energy: 1.5611800330954988
Energy: 1.4712071212056501
Energy: 1.5473320899014322
Energy: 1.5611800330954988
Energy: 1.4712071212056501
Energy: 1.5473320899014322
Energy: 1.5611800330934995
Energy: 1.3755546164370143
Energy: 1.4704662293066597
Energy: 1.3727391784097163
Energy: 1.3755546164390138
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Energy: 1.4704662293046604
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Energy: 1.3755546164370143
Energy: 1.441891046967279
Energy: 1.3758970115686888
Energy: 1.5787306936575252
Energy: 1.4418910469712782
Energy: 1.3758970115666893
Energy: 1.5787306936555259
Energy: 1.4418910469712782
Energy: 1.3758970115686888
Energy: 1.5787306936595247
Energy: 1.441891046967279
Energy: 1.5059677165748218
Energy: 1.618319242967121
Energy: 1.3554687195235364
Energy: 1.505967716576821
Energy: 1.618319242967121
Energy: 1.3554687195195374
Energy: 1.505967716576821
Energy: 1.618319242967121
Energy: 1.355468719521537
Energy: 1.5059677165808203
Energy: 1.4118808707372574
Energy: 1.5335311796548268
Energy: 1.525490720838065
Energy: 1.411943553862131
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Energy: 1.5254907208400648
Energy: 1.4118808707352581
Energy: 1.533531179652827
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Energy: 1.41194355386613
Energy: 1.3893961661287224
Energy: 1.5203061754899487
Energy: 1.537675127267503
Energy: 1.3893961661287224
Energy: 1.5203061754879494
Energy: 1.5376751272655034
Energy: 1.3893961661287224
Energy: 1.5203061754879494
Energy: 1.537675127267503
Energy: 1.3893961661287224
Energy: 1.6035661162369252
Energy: 1.468271733440656
Energy: 1.4514304189735614
Energy: 1.6035661162409243
Energy: 1.449378055436208
Energy: 1.4318021850168368
Energy: 1.6035661162429238
Energy: 1.468271733440656
Energy: 1.4514304189735614
Energy: 1.6035661162409243
Energy: 1.3893619041449194
Energy: 1.608606504630043
Energy: 1.496880483715027
Energy: 1.3891673690675779
Energy: 1.6086065046280436
Energy: 1.522443417712414
Energy: 1.3893619041449194
Energy: 1.6086065046280436
Energy: 1.4968804837170262
Energy: 1.3891673690695772
Energy: 1.4821324380703749
Energy: 1.3386335493814183
Energy: 1.5080021204262295
Energy: 1.4821324380703749
Energy: 1.3386335493774193
Energy: 1.5080021204302285
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Energy: 1.3386335493794188
Energy: 1.5080021204302285
Energy: 1.4821324380723742
Energy: 1.4967958694227546
Energy: 1.3529237766860245
Energy: 1.5733575928856094
Energy: 1.496795869420755
Energy: 1.352782253105067
Energy: 1.5733575928856094
Energy: 1.4967958694227546
Energy: 1.352923776684025
Energy: 1.5733575928856094
Energy: 1.496795869424754
Energy: 1.4823448347130728
Energy: 1.394948471798001
Energy: 1.4991057782519661
Energy: 1.4823448347130728
Energy: 1.394948471798001
Energy: 1.4991057782559651
Energy: 1.4823448347150723
Energy: 1.394948471798001
Energy: 1.4991057782559651
Energy: 1.4823448347130728
Energy: 1.3613520115194164
Energy: 1.3635271836760336
Energy: 1.6462749437534587
Energy: 1.3613520115194164
Energy: 1.3635271836760336
Energy: 1.6462749437534587
Energy: 1.361352011517417
Energy: 1.3635271836740341
Energy: 1.646274943755458
Energy: 1.361352011517417
Energy: 1.5445287687882179
Energy: 1.5525894833627691
Energy: 1.3933494971726983
Energy: 1.544528768794216
Energy: 1.5525894833607696
Energy: 1.3933017312278189
Energy: 1.544528768794216
Energy: 1.5525894833607696
Energy: 1.3933494971706988
Energy: 1.5445287687882179
Energy: 1.3740102095536977
Energy: 1.6920236701880151
Energy: 1.5404872252660944
Energy: 1.3740102095536977
Energy: 1.6920236701880151
Energy: 1.540487225264095
Energy: 1.3740102095536977
Energy: 1.6920236701880151
Energy: 1.5404872252660944
Energy: 1.3740102095516982
Energy: 1.4495235322663533
Energy: 1.5340305346852663
Energy: 1.566593257780193
Energy: 1.4495235322663533
Energy: 1.5340305346852663
Energy: 1.5665932577781938
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Energy: 1.4495235322643538
Energy: 1.6245159990556917
Energy: 1.37763685205612
Energy: 1.4344218450455406
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Energy: 1.4344218450455406
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Energy: 1.4344218450455406
Energy: 1.6245159990556917
Energy: 1.402905316600389
Energy: 1.4756370054291983
Energy: 1.4620075202953482
Energy: 1.4029053165983898
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Energy: 1.4029053165983898
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Energy: 1.3937025519272608
Energy: 1.4406807162997415
Energy: 1.5364102322654478
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Energy: 1.440680716297742
Energy: 1.5364102322654478
Energy: 1.3937025519292603
Energy: 1.4406807162997415
Energy: 1.5364102322674107
Energy: 1.4650709665380526
Energy: 1.3755801133065302
Energy: 1.5954160262901347
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Energy: 1.375580113302531
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Energy: 1.3755801133065302
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Energy: 1.4650709665380526
Energy: 1.5017321645207882
Energy: 1.5888433465892993
Energy: 1.355483647449944
Energy: 1.5017321645207882
Energy: 1.5888433465892993
Energy: 1.355483647445945
Energy: 1.5017321645227877
Energy: 1.5888433465912986
Energy: 1.355483647449944
Energy: 1.5017321645247874
Energy: 1.4191455211429767
Energy: 1.41541482746477
Energy: 1.4608966674609307
Energy: 1.4190068287264679
Energy: 1.4142010208187101
Energy: 1.4608966674609307
Energy: 1.4191455211429767
Energy: 1.4154148274627705
Energy: 1.4608966674629302
Energy: 1.4190068287264679
Energy: 1.3829951298940122
Energy: 1.4439641178466358
Energy: 1.346419669297332
Energy: 1.3829951298920127
Energy: 1.4439641178486353
Energy: 1.3464196692953325
Energy: 1.382995129896012
Energy: 1.4439641178526341
Energy: 1.346419669297332
Energy: 1.3829951298940122
Energy: 1.487795792027202
Energy: 1.485220916224549
Energy: 1.472561283879981
Energy: 1.4877957920312008
Energy: 1.485220916224549
Energy: 1.4725612838779814
Energy: 1.4877957920292015
Energy: 1.4852209162265486
Energy: 1.472561283879981
Energy: 1.487795792027202
Energy: 1.38916288423221
Energy: 1.4751671965323863
Energy: 1.5352619847707805
Energy: 1.3887884107240829
Energy: 1.4751671965343855
Energy: 1.5162695552100682
Energy: 1.3891628842302106
Energy: 1.475167196530423
Energy: 1.5352619847687812
Energy: 1.3887884107220834
Energy: 1.517905905719353
Energy: 1.3388587421087028
Energy: 1.5349309258689157
Energy: 1.517905905715354
Energy: 1.338858742104704
Energy: 1.5349309258669164
Energy: 1.517905905715354
Energy: 1.338858742104704
Energy: 1.5349309258689157
Energy: 1.517905905719353
Energy: 1.572090304551549
Energy: 1.5618533872996978
Energy: 1.5731726682659164
Energy: 1.5720903045495496
Energy: 1.5618533872996978
Energy: 1.5731726682699152
Energy: 1.572090304551549
Energy: 1.5618533872976985
Energy: 1.573172668267916
Energy: 1.572090304551549
Energy: 1.426386425406386
Energy: 1.3535339035940757
Energy: 1.4343266155118495
Energy: 1.4241287522036203
Energy: 1.3534777345439613
Energy: 1.43432661550985
Energy: 1.426386425400424
Energy: 1.3535339035920764
Energy: 1.4343266155078505
Energy: 1.42412875220562
Energy: 1.4644931822217033
Energy: 1.3655805675754287
Energy: 1.544547630035957
Energy: 1.4644931822177047
Energy: 1.3655805675774284
Energy: 1.5445476300339576
Energy: 1.4644931822217033
Energy: 1.3655805675774284
Energy: 1.544547630035957
Energy: 1.464493182219704
Energy: 1.5684803230230933
Energy: 1.5038630380680096
Energy: 1.394891983040086
Energy: 1.568480323025093
Energy: 1.503863038070009
Energy: 1.3948994982850191
Energy: 1.5684803230270925
Energy: 1.5038630380640108
Energy: 1.394891983040086
Energy: 1.568480323025093
Energy: 1.3527636158418728
Energy: 1.5670955841711276
Energy: 1.563615798956229
Energy: 1.352763615839873
Energy: 1.567095584165129
Energy: 1.56361579895223
Energy: 1.352763615839873
Energy: 1.5670955841691279
Energy: 1.563615798956229
Energy: 1.3527636158418728
Energy: 1.499102209988049
Energy: 1.521281271799269
Energy: 1.5099490816377397
Energy: 1.448853862475379
Energy: 1.521281271799269
Energy: 1.5099490816357404
Energy: 1.499102209988049
Energy: 1.5212812717972697
Energy: 1.5099490816357404
Energy: 1.4488538624733796
Energy: 1.498825620352875
Energy: 1.5246409254496527
Energy: 1.4903109468127795
Energy: 1.448164054265719
Energy: 1.5246409254536515
Energy: 1.506022156134479
Energy: 1.4988256203548742
Energy: 1.524640925455651
Energy: 1.4903109468087803
Energy: 1.4481640542677185
Energy: 1.348202413692959
Energy: 1.6698832544042244
Energy: 1.5144395517328182
Energy: 1.3482024136969577
Energy: 1.6698832544002253
Energy: 1.514439551730819
Energy: 1.3482024136949584
Energy: 1.6698832544042244
Energy: 1.5144395517328182
Energy: 1.3482024136949584
Energy: 1.6954139237034842
Energy: 1.394089741163737
Energy: 1.4969544305563582
Energy: 1.695413923701485
Energy: 1.394089741163737
Energy: 1.4969544307661942
Energy: 1.6954139237034842
Energy: 1.3940897411657367
Energy: 1.4969544309700678
Energy: 1.6954139237034842
Energy: 1.4326006824543833
Energy: 1.553151461804641
Energy: 1.3608387581685824
Energy: 1.4326006824523838
Energy: 1.553151461800642
Energy: 1.361576910354483
Energy: 1.4326006824503843
Energy: 1.5531514618026412
Energy: 1.3608387581705819
Energy: 1.4326006824503843
Energy: 1.549793145902309
Energy: 1.4884054040540309
Energy: 1.3526255894957082
Energy: 1.5497931459043086
Energy: 1.4884054040520316
Energy: 1.3526255894996708
Energy: 1.5497931459043086
Energy: 1.4884054040560304
Energy: 1.3526255894996708
Energy: 1.5497931459043086
Energy: 1.5341470444163727
Energy: 1.5436608544057435
Energy: 1.537645609659582
Energy: 1.5341470444163727
Energy: 1.5436608544057435
Energy: 1.5376456096615816
Energy: 1.5341470444183722
Energy: 1.543660854403744
Energy: 1.537645609659582
Energy: 1.5341470444183722
Energy: 1.473400273561479
Energy: 1.4449537070435137
Energy: 1.3477499549401353
Energy: 1.4734002836443578
Energy: 1.4449537070475125
Energy: 1.3477499549401353
Energy: 1.4734003358894339
Energy: 1.4449537070435137
Energy: 1.3477499549441343
Energy: 1.4734003203684203
Energy: 1.3740449505091379
Energy: 1.5715539155518938
Energy: 1.48154269128021
Energy: 1.3740449505111376
Energy: 1.5715539155518938
Energy: 1.4815426912782104
Energy: 1.3740449505131371
Energy: 1.5715539155518938
Energy: 1.4815426912782104
Energy: 1.3740449505131371
Energy: 1.5385548422845963
Energy: 1.449488885761012
Energy: 1.4487150667705115
Energy: 1.5385548422785982
Energy: 1.4321370194826002
Energy: 1.4306518973726985
Energy: 1.5385548422805975
Energy: 1.4494888857590125
Energy: 1.4487150667745103
Energy: 1.5385548422825968
Energy: 1.5141616320019817
Energy: 1.3651447682955846
Energy: 1.4578170695979524
Energy: 1.5141616312205146
Energy: 1.3651447682935853
Energy: 1.4578170695979524
Energy: 1.514161632531588
Energy: 1.3651447682955846
Energy: 1.4578170695979524
Energy: 1.5141616315802744
Energy: 1.4168115768156457
Energy: 1.8617282238759298
Energy: 1.4198498079427133
Energy: 1.4168115768136462
Energy: 1.8617282238779291
Energy: 1.419849807940714
Energy: 1.4168115768136462
Energy: 1.8617282238779291
Energy: 1.419849807940714
Energy: 1.4168115768156457
Energy: 1.4629323202424125
Energy: 1.356980489933875
Energy: 1.6272002824573097
Energy: 1.4629323202424125
Energy: 1.3569727306714776
Energy: 1.6272002825092597
Energy: 1.4629323202424125
Energy: 1.3569804899318756
Energy: 1.6272002824912644
Energy: 1.4629323202424125
Energy: 1.4616249626274411
Energy: 1.4195276696480728
Energy: 1.5351522984400152
Energy: 1.4616249626274411
Energy: 1.4195276696480728
Energy: 1.5351522984420145
Energy: 1.4616249626314401
Energy: 1.419527669650072
Energy: 1.5351522984400152
Energy: 1.4616249626274411
Energy: 1.5194305662551757
Energy: 1.4489090758933938
Energy: 1.3946978220422623
Energy: 1.5194305662551757
Energy: 1.4489090758893948
Energy: 1.3945391984705144
Energy: 1.5194305662531762
Energy: 1.4489090758913945
Energy: 1.3946978220402628
Energy: 1.5194305662531762
Energy: 1.3474527426965182
Energy: 1.3961857432321683
Energy: 1.5455842243681472
Energy: 1.3474527426985174
Energy: 1.3961857432301685
Energy: 1.5455842243641482
Energy: 1.3474527426965182
Energy: 1.3961857432301685
Energy: 1.5455842243681472
Energy: 1.3474527426985174
Energy: 1.4477656155602787
Energy: 1.520186240274656
Energy: 1.5322421680565004
Energy: 1.4477656155602787
Energy: 1.5201862402726567
Energy: 1.5322421680525016
Energy: 1.4477656155602787
Energy: 1.5201862402726567
Energy: 1.5322421680565004
Energy: 1.4477656155602787

minimum gb energy = 1.3386335493774193 eV
minimum distance =  2.341831022848 Angstroms
sigma value = 437


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

Energy: 1.3316852632075709
Energy: 1.437658108535665
Energy: 1.4242313000814377
Energy: 1.3316852632075709
Energy: 1.4376581085378506
Energy: 1.4242313000777955
Energy: 1.3316852632075709
Energy: 1.437658108538579
Energy: 1.4242313000799809
Energy: 1.3316852632075709
Energy: 1.5590580126042621
Energy: 1.2897059295940656
Energy: 1.2815229810113158
Energy: 1.5590580126064475
Energy: 1.2897059295926085
Energy: 1.2815229810076734
Energy: 1.559058012605719
Energy: 1.2897059295940656
Energy: 1.281522981013501
Energy: 1.5590580126042621
Energy: 1.3874928942619766
Energy: 1.2736831861488838
Energy: 1.3885070586224133
Energy: 1.3874928942627052
Energy: 1.2736831861496123
Energy: 1.388507058621685
Energy: 1.3874928942612483
Energy: 1.2736831861496123
Energy: 1.3885070586231418
Energy: 1.3874928942619766
Energy: 1.3927004275364328
Energy: 1.579996868225828
Energy: 1.345397638604085
Energy: 1.3927004275364328
Energy: 1.5799968682250998
Energy: 1.345397638604085
Energy: 1.3927004275393466
Energy: 1.579996868225828
Energy: 1.345397638601171
Energy: 1.392700427534976
Energy: 1.3712312771983992
Energy: 1.3092548579596222
Energy: 1.633337055682356
Energy: 1.3712312771954855
Energy: 1.3092548579588934
Energy: 1.6333370556940112
Energy: 1.3712312771997899
Energy: 1.3092548579588934
Energy: 1.6333370556859983
Energy: 1.3712312771962138
Energy: 1.3719839556049462
Energy: 1.470413899403267
Energy: 1.291879031853649
Energy: 1.3719839556049462
Energy: 1.4704138994083662
Energy: 1.291879031851464
Energy: 1.371983955606403
Energy: 1.4704138994039955
Energy: 1.2918790318529205
Energy: 1.3719839556093167
Energy: 1.4477207363199203
Energy: 1.3280071681619372
Energy: 1.2736612021465092
Energy: 1.4477207363199203
Energy: 1.3280071681626655
Energy: 1.2736612021494227
Energy: 1.4477207363199203
Energy: 1.3280071681619372
Energy: 1.2736612021465092
Energy: 1.4477207363199203
Energy: 1.321528573596396
Energy: 1.4297311584394665
Energy: 1.3832210078322997
Energy: 1.3215285735985816
Energy: 1.4297311584423804
Energy: 1.383221007827929
Energy: 1.321528573596396
Energy: 1.4297311584394665
Energy: 1.383221007834485
Energy: 1.3215285735978528
Energy: 1.5393122004835735
Energy: 1.28213656598516
Energy: 1.3106423078649634
Energy: 1.5393122004647004
Energy: 1.2821365659822463
Energy: 1.310642307864235
Energy: 1.539312200472713
Energy: 1.2821365659837032
Energy: 1.3106423078649634
Energy: 1.539312200477018
Energy: 1.4582714740356353
Energy: 1.486036516406848
Energy: 1.3676051234073907
Energy: 1.4582714740363634
Energy: 1.4860365164112188
Energy: 1.3676051234088475
Energy: 1.4582714740349065
Energy: 1.486036516406848
Energy: 1.3676051234103044
Energy: 1.45827147403345
Energy: 1.33031474257695
Energy: 1.3365544946033459
Energy: 1.3560497795127098
Energy: 1.330314742575493
Energy: 1.3365544946026173
Energy: 1.3560497795185373
Energy: 1.33031474257695
Energy: 1.3365544946033459
Energy: 1.3560497795141666
Energy: 1.33031474257695
Energy: 1.408354260152797
Energy: 1.2873756746675158
Energy: 1.3484404590928438
Energy: 1.4083542601535253
Energy: 1.2873756746675158
Energy: 1.3484404590964858
Energy: 1.408354260154254
Energy: 1.2873756746667873
Energy: 1.348440459093572
Energy: 1.408354260154254
Energy: 1.3098607149256978
Energy: 1.5357856856584464
Energy: 1.309513680509373
Energy: 1.3098607149256978
Energy: 1.5357856856577181
Energy: 1.309513680509373
Energy: 1.309860714926426
Energy: 1.5357856856526189
Energy: 1.3095136805086447
Energy: 1.3098607149256978
Energy: 1.342916180772674
Energy: 1.2885985072031179
Energy: 1.3874341912376873
Energy: 1.3429161807719454
Energy: 1.2885985072009327
Energy: 1.387434191113918
Energy: 1.3429161807741308
Energy: 1.2885985072023896
Energy: 1.3874341911968942
Energy: 1.342916180772674

minimum gb energy = 1.2736612021465092 eV
minimum distance =  2.26226702982025 Angstroms
sigma value = 33