Model name: model_name=EAM_Dynamo_VailheFarkas_1997_CoAl__MO_284963179498_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049696564674378
cohesive_energy=3.3687229668997767
mass=26.981538
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: 0.011732952500889007
Energy: 0.16209829037467818
Energy: 0.16209829037352633
Energy: 0.011732952500889007
Energy: 0.16209829037352633
Energy: 0.16209829037352633
Energy: 0.011732952500889007
Energy: 0.16209829037352633
Energy: 0.16209829037352633
Energy: 0.011732952503192692
Energy: 0.16186713841522835
Energy: 0.012427255651593078
Energy: 0.16223687972551137
Energy: 0.16186713841407652
Energy: 0.012427255650441235
Energy: 0.16223687972435952
Energy: 0.16186713841638017
Energy: 0.012427255651593078
Energy: 0.16223687972551137
Energy: 0.16186713841638017
Energy: 0.4240268903397465
Energy: 0.24882962310463955
Energy: 0.24922154977142913
Energy: 0.28751702902150217
Energy: 0.2488296231057914
Energy: 0.2492215497702773
Energy: 0.287517029022654
Energy: 0.22379402458519643
Energy: 0.24882962310348772
Energy: 0.287517029022654
Energy: 0.16186713841292463
Energy: 0.1622368797266632
Energy: 0.012427255651593078
Energy: 0.16186713841407652
Energy: 0.16223687972551137
Energy: 0.012427255651593078
Energy: 0.1618671384117728
Energy: 0.16223687972551137
Energy: 0.012427255651593078
Energy: 0.16186713841292463
Energy: 0.011732952500889007
Energy: 0.16209829037352633
Energy: 0.1620982903723745
Energy: 0.011732952500889007
Energy: 0.1620982903723745
Energy: 0.1620982903723745
Energy: 0.011732952500889007
Energy: 0.1620982903723745
Energy: 0.1620982903723745
Energy: 0.011732952500889007
Energy: 0.16186713841407652
Energy: 0.012427255651593078
Energy: 0.16223687972551137
Energy: 0.16186713841407652
Energy: 0.012427255651593078
Energy: 0.1622368797266632
Energy: 0.16186713841407652
Energy: 0.012427255651593078
Energy: 0.16223687972551137
Energy: 0.16186713841292463
Energy: 0.28751702902150217
Energy: 0.10177767150116464
Energy: 0.013356352398933931
Energy: 0.28751702902150217
Energy: 0.10177767150116464
Energy: 0.013356352398933931
Energy: 0.2875170290238058
Energy: 0.10177767150116464
Energy: 0.1519491361230377
Energy: 0.28751702902150217

minimum gb energy = 0.011732952500889007 eV
minimum distance =  2.70476841161099 Angstroms
sigma value = 3


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

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Energy: 0.39865258814417487
Energy: 0.4679029527936756
Energy: 0.3443448584910896
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Energy: 0.3577545427742846
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Energy: 0.4462810037634675
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Energy: 0.3881655805091634
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Energy: 0.40836415038737695
Energy: 0.3426167346698044
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Energy: 0.40836415038709484
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Energy: 0.32174878022075815
Energy: 0.3986525881472784
Energy: 0.4679029527953685
Energy: 0.32174878021991166
Energy: 0.39865258814868915
Energy: 0.4679029527959328
Energy: 0.3217487802201938
Energy: 0.3986525881438927
Energy: 0.46790295279621497
Energy: 0.32174878021991166
Energy: 0.3577545427776703
Energy: 0.34214938911365034
Energy: 0.3945389726506846
Energy: 0.3577545427782346
Energy: 0.3421493891139324
Energy: 0.39453897265096677
Energy: 0.35775454277738816
Energy: 0.3421493891184467
Energy: 0.39453897265294174
Energy: 0.3577545427754132
Energy: 0.36583260940586343
Energy: 0.4244928857050161
Energy: 0.46095494894161726
Energy: 0.3788445113037599
Energy: 0.42449288570416965
Energy: 0.4609549489404887
Energy: 0.3658326094021956
Energy: 0.4244928857069911
Energy: 0.4609549489427458
Energy: 0.3788445112995278
Energy: 0.41096699836731554
Energy: 0.40924731337930836
Energy: 0.3233964729464964
Energy: 0.41096699836251904
Energy: 0.4092473133781799
Energy: 0.3233964729496
Energy: 0.4109669983633655
Energy: 0.4092473133767692
Energy: 0.32339647294762497
Energy: 0.4109669983644941

minimum gb energy = 0.31076016892773023 eV
minimum distance =  2.5978586361005 Angstroms
sigma value = 75


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

Energy: 0.4042956287418885
Energy: 0.32073283482977843
Energy: 0.3205360320104088
Energy: 0.37134570930576205
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minimum gb energy = 0.31645896408150953 eV
minimum distance =  2.55061366880887 Angstroms
sigma value = 105


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

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Energy: 0.3550560140034808
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Energy: 0.3871157142574517
Energy: 0.3992159519214263
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Energy: 0.40567143006898765
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Energy: 0.3992159519206639
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Energy: 0.35241089310788654
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Energy: 0.3822870150597734
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Energy: 0.4048627347991337
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Energy: 0.37941421940926195
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Energy: 0.3794142194105044
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Energy: 0.3786898544469753
Energy: 0.38004410864064253
Energy: 0.39104309526166425
Energy: 0.3786898544452527
Energy: 0.3783455558647666
Energy: 0.37748569615867966
Energy: 0.3786898544451115
Energy: 0.38152341746266516
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Energy: 0.3866417481979598
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Energy: 0.36455058967256404
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Energy: 0.3645505896708415
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Energy: 0.3805126600160703
Energy: 0.38454763161416894
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Energy: 0.38038992292727924
Energy: 0.39880509391942487
Energy: 0.4069925963217678
Energy: 0.3804437840599593
Energy: 0.4048502978261119
Energy: 0.3973039744536509
Energy: 0.3800421994989954
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Energy: 0.3921117566905239
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Energy: 0.37239291358512927
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Energy: 0.3799379940035577
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Energy: 0.37239291358264426
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Energy: 0.38219416136060097
Energy: 0.39832592277434503
Energy: 0.38011608161383925
Energy: 0.38219416135873724
Energy: 0.39832592277451445
Energy: 0.38011608161398047
Energy: 0.38219416135935846
Energy: 0.3983259227735826
Energy: 0.35860044712300965
Energy: 0.38587096721721614
Energy: 0.39931866700266827
Energy: 0.35860044712300965
Energy: 0.3858709672173855
Energy: 0.3993186670014257
Energy: 0.358600447127189
Energy: 0.38587096721783737
Energy: 0.399318667002047
Energy: 0.358600447125184
Energy: 0.3769922875349702
Energy: 0.3795138038571786
Energy: 0.37950155803518437
Energy: 0.3769922875377659
Energy: 0.3795957406590939
Energy: 0.37950155803518437
Energy: 0.3769922875354221
Energy: 0.3795138038565573
Energy: 0.3795015580333206
Energy: 0.37699228753417957
Energy: 0.38851483308161805
Energy: 0.38706932998338556
Energy: 0.37685940324053774
Energy: 0.388514833079133
Energy: 0.38710023079649836
Energy: 0.37685940324364403
Energy: 0.3885148330806862
Energy: 0.3870693299812111
Energy: 0.3768594032416108
Energy: 0.3885148330794436
Energy: 0.3909715528225493
Energy: 0.3805297866210896
Energy: 0.3601055295615779
Energy: 0.39097155282300117
Energy: 0.38052978662388526
Energy: 0.36010552956143677
Energy: 0.39097155281896295
Energy: 0.38052978662574904
Energy: 0.36010552955847164
Energy: 0.39097155282161744
Energy: 0.370819147887505
Energy: 0.3814342861730979
Energy: 0.3783689627674717
Energy: 0.3708191478864319
Energy: 0.380654852561639
Energy: 0.3783689627648172
Energy: 0.37081914788626247
Energy: 0.38143428616968095
Energy: 0.37836896276622917
Energy: 0.370819147887505
Energy: 0.3878384152818191
Energy: 0.3785307616344474
Energy: 0.398237747079603
Energy: 0.3878384152828922
Energy: 0.38215486879033583
Energy: 0.39823774707884063
Energy: 0.38756159950928815
Energy: 0.3785307616358311
Energy: 0.39823774707853
Energy: 0.38734299918654747
Energy: 0.389970371230453
Energy: 0.35468670747855735
Energy: 0.3898453164289081
Energy: 0.3899703712293799
Energy: 0.35470142055259496
Energy: 0.3898453164307718
Energy: 0.38997037123093303
Energy: 0.3546867074773148
Energy: 0.3898453164301506
Energy: 0.38997037122906925

minimum gb energy = 0.35241089310788654 eV
minimum distance =  2.56493434673553 Angstroms
sigma value = 165


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

Energy: 0.3549571813508849
Energy: 0.36897645212907126
Energy: 0.3415862825004488
Energy: 0.3365358064712338
Energy: 0.36897645212907126
Energy: 0.341586282500982
Energy: 0.3549571813492853
Energy: 0.3689764521285381
Energy: 0.3415862824977828
Energy: 0.3365358064712338
Energy: 0.36434035096621636
Energy: 0.3419293839053865
Energy: 0.3760299580021341
Energy: 0.36434035096515
Energy: 0.34192938390378697
Energy: 0.3760299580016009
Energy: 0.3643403509656832
Energy: 0.34192938390645294
Energy: 0.3760299580016009
Energy: 0.3643403509656832
Energy: 0.35363108539875815
Energy: 0.35238501328774596
Energy: 0.3435546830486528
Energy: 0.35363108540195737
Energy: 0.3523850132866796
Energy: 0.3436346260717821
Energy: 0.3536310854003578
Energy: 0.35238501328614635
Energy: 0.34355468304918596
Energy: 0.3536310854003578
Energy: 0.37610816238301775
Energy: 0.3432282631437304
Energy: 0.3397099324957015
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Energy: 0.3432282631469295
Energy: 0.3397099324962347
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Energy: 0.34322826314746274
Energy: 0.3397099324962347
Energy: 0.37610816238301775
Energy: 0.37165131560426695
Energy: 0.36514531847729986
Energy: 0.3264453412489398
Energy: 0.37165131560373377
Energy: 0.3651453184767666
Energy: 0.326445341249473
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Energy: 0.36514531847623344
Energy: 0.326445341246807
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Energy: 0.34123375852742716
Energy: 0.38234457409963535
Energy: 0.37505201773027325
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Energy: 0.37505201772974006
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Energy: 0.37013882249747104
Energy: 0.3632565965643173
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Energy: 0.38736240826400886
Energy: 0.3398532976683265
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Energy: 0.38736240826665064
Energy: 0.3398532976683265
Energy: 0.3419604770630927
Energy: 0.3873624082645421
Energy: 0.368480442712449
Energy: 0.38341750845222383
Energy: 0.36294344865872646
Energy: 0.3684804427129822
Energy: 0.383417508455423
Energy: 0.3630780046456432
Energy: 0.368480442715115
Energy: 0.383417508452757
Energy: 0.3629434486581933
Energy: 0.3684804427108494
Energy: 0.358846777459591
Energy: 0.37451684396669
Energy: 0.3899468318229526
Energy: 0.3412328085259452
Energy: 0.3745168439650904
Energy: 0.3899468318229526
Energy: 0.3588467774579914
Energy: 0.37451684396669
Energy: 0.3899468318229526
Energy: 0.34123280852647836
Energy: 0.38014179693884326
Energy: 0.32650133364086825
Energy: 0.3973456944325743
Energy: 0.3561496169711669
Energy: 0.3265013336429768
Energy: 0.3750491496102847
Energy: 0.38014179693884326
Energy: 0.32650133364246786
Energy: 0.3973456944299083
Energy: 0.35614961696903413
Energy: 0.376530700299999
Energy: 0.34015740988607374
Energy: 0.3449452518502715
Energy: 0.3765307003031982
Energy: 0.34015740988820653
Energy: 0.34494525184867186
Energy: 0.3765307003021318
Energy: 0.34015740989033927
Energy: 0.3449452518492051
Energy: 0.376530700299999
Energy: 0.3706743929259134
Energy: 0.3470742461864663
Energy: 0.35535448622314053
Energy: 0.37067439292378057
Energy: 0.3470742461875327
Energy: 0.35535448622687293
Energy: 0.37067439292378057
Energy: 0.3470742461864663
Energy: 0.35535448622314053
Energy: 0.37067439292271415
Energy: 0.36970456500832805
Energy: 0.39216588636475075
Energy: 0.3419927220131257
Energy: 0.36970456500619525
Energy: 0.3921658863626179
Energy: 0.3419927220152585
Energy: 0.36970456500832805
Energy: 0.3921658863642175
Energy: 0.3419927220152585
Energy: 0.36970456500886123
Energy: 0.33653580646963427
Energy: 0.3689764521280049
Energy: 0.34158628249831596
Energy: 0.33653580646963427
Energy: 0.36897645212907126
Energy: 0.341586282500982
Energy: 0.33653580646963427
Energy: 0.3689764521306709
Energy: 0.3415862824993824
Energy: 0.33653580646963427

minimum gb energy = 0.326445341246807 eV
minimum distance =  2.64948508389535 Angstroms
sigma value = 41


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

Energy: 0.3521055413740038
Energy: 0.3237400172336331
Energy: 0.33900689476433704
Energy: 0.3591870264576872
Energy: 0.32374001724006507
Energy: 0.3390068947626821
Energy: 0.35210554137253686
Energy: 0.32374001723965135
Energy: 0.3390068947639233
Energy: 0.35918702645746153
Energy: 0.3411213760317085
Energy: 0.3046392000451581
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Energy: 0.3411213760312947
Energy: 0.30463920004575984
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Energy: 0.3411213760300535
Energy: 0.3046392000424498
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Energy: 0.3411213760329498
Energy: 0.35792685434512983
Energy: 0.31032570251213293
Energy: 0.3316230379729523
Energy: 0.3472011436004097
Energy: 0.31032570251296043
Energy: 0.33728231759043525
Energy: 0.3382322774307733
Energy: 0.3103257025088229
Energy: 0.3307582694522258
Energy: 0.3520578368022619
Energy: 0.3099764581001347
Energy: 0.30974151178544695
Energy: 0.3254162855334432
Energy: 0.3099764580982916
Energy: 0.30974151178379195
Energy: 0.3254481300020109
Energy: 0.3099764580993072
Energy: 0.30974151179123954
Energy: 0.32541628553178825
Energy: 0.3099764581007742
Energy: 0.32394843273001944
Energy: 0.3460117747407925
Energy: 0.3226640476745995
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Energy: 0.3460117747283799
Energy: 0.3225239967185877
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Energy: 0.3460117747246561
Energy: 0.32266404767584084
Energy: 0.32394843273084695
Energy: 0.3193705804869344
Energy: 0.3500855395367577
Energy: 0.33403125765966335
Energy: 0.3193705804826088
Energy: 0.35008553953510263
Energy: 0.33403125765800834
Energy: 0.31937058048426387
Energy: 0.35008553953781085
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Energy: 0.3193705804867464
Energy: 0.32172253623974073
Energy: 0.3029251603033889
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Energy: 0.32172253623582886
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Energy: 0.3217225362378976
Energy: 0.326263813767858
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Energy: 0.30673711652007885
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Energy: 0.32640464431941524
Energy: 0.33203991720739834
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Energy: 0.32769702554083463
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Energy: 0.31016670080363606
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Energy: 0.3393992233299786
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Energy: 0.3440828696027335
Energy: 0.3182699070640076
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Energy: 0.30624703111322465
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Energy: 0.36852987751528204
Energy: 0.3098532371578622
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Energy: 0.3369031884509929
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Energy: 0.3214600927819282
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Energy: 0.33428828281496925
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Energy: 0.337106511909117
Energy: 0.30288635739128106
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Energy: 0.31839428284915233
Energy: 0.3380871854423495
Energy: 0.33978473231612544
Energy: 0.3185558530122658
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Energy: 0.32402997749356016
Energy: 0.335320955510233
Energy: 0.3623983096298957
Energy: 0.3240299774927326
Energy: 0.33532095551956126
Energy: 0.36239830962906827
Energy: 0.3240299774923189
Energy: 0.3353209555185081
Energy: 0.36239830962553254
Energy: 0.32173310524110776
Energy: 0.32776212431725643
Energy: 0.3146361413663816
Energy: 0.32173310524336457
Energy: 0.3277621243147739
Energy: 0.31463614136431284
Energy: 0.32173310524005455
Energy: 0.32776212431311885
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Energy: 0.3217331052479158
Energy: 0.32840847675142226
Energy: 0.32907743335124984
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Energy: 0.32907743335083606
Energy: 0.30579448967914996
Energy: 0.3284084767483003
Energy: 0.33962767516221615
Energy: 0.3245369023001233
Energy: 0.3119864390242168
Energy: 0.3396276751607492
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Energy: 0.31198643902504436
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Energy: 0.3245369023042608
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Energy: 0.33962767516469866
Energy: 0.3636604442678394
Energy: 0.3494509323505836
Energy: 0.3339737301344072
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Energy: 0.36075425806984834
Energy: 0.3397910571625243
Energy: 0.3027609168746125
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Energy: 0.34761231320326486
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Energy: 0.3287340535496996
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Energy: 0.3287340535519565
Energy: 0.3262936069660566
Energy: 0.34340883528620825
Energy: 0.3037397484049067
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Energy: 0.3434088352870358
Energy: 0.30373974840343976
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Energy: 0.3434088352954989
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Energy: 0.3429996009258075
Energy: 0.3434088352921889
Energy: 0.32385200393282204
Energy: 0.3409197428723772
Energy: 0.35153847503612246
Energy: 0.32385200392849645
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Energy: 0.3592695976603174
Energy: 0.32385200392785696
Energy: 0.3409197428707222
Energy: 0.3515384750425545
Energy: 0.3238520039324083
Energy: 0.30838294621454587
Energy: 0.32379531163386494
Energy: 0.32647680276381696
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Energy: 0.3549492476336034
Energy: 0.31995014744814
Energy: 0.30838294621725415
Energy: 0.3237953116359337
Energy: 0.32647680276028124
Energy: 0.30838294621661466
Energy: 0.30994429925326866
Energy: 0.3292805491160886
Energy: 0.32878586244132135
Energy: 0.3099442992549236
Energy: 0.32935622501989126
Energy: 0.3288163128912725
Energy: 0.3099442992524411
Energy: 0.3292805491156749
Energy: 0.32878586243819935
Energy: 0.30994429925409617
Energy: 0.3099799874536435
Energy: 0.32301528347161934
Energy: 0.31003140820006325
Energy: 0.30997998745548666
Energy: 0.32166241498661396
Energy: 0.3100314081973927
Energy: 0.3099799874538316
Energy: 0.32301528347079184
Energy: 0.3100314081953239
Energy: 0.3099799874536435
Energy: 0.3468977296041741
Energy: 0.3235695065082396
Energy: 0.32669983707531713
Energy: 0.34689772960458787
Energy: 0.3237587281425
Energy: 0.32669983707531713
Energy: 0.3468977296051897
Energy: 0.3235695065119635
Energy: 0.32669983707964273
Energy: 0.3468977296031209
Energy: 0.3510617637060656
Energy: 0.33448432332707295
Energy: 0.3189046803931345
Energy: 0.3510617637056895
Energy: 0.3344843233299692
Energy: 0.3189046803895988
Energy: 0.3510617637029812
Energy: 0.3344843233330536
Energy: 0.31890468039147946
Energy: 0.35106176370670505

minimum gb energy = 0.3027609168746125 eV
minimum distance =  2.59451288703081 Angstroms
sigma value = 185


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

Energy: 0.18609871738612657
Energy: 0.18101809627701945
Energy: 0.18105450886534113
Energy: 0.11197648926020465
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Energy: 0.11197648926020465
Energy: 0.17425251552298082
Energy: 0.18621709941583142
Energy: 0.20312697751394457
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Energy: 0.20312697751026096
Energy: 0.1742525155242087
Energy: 0.11223142789014717
Energy: 0.19138284738003347
Energy: 0.15151343756338642
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Energy: 0.11390692457564193
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Energy: 0.18145069243548842
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Energy: 0.18953365375419942
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Energy: 0.2435838156252577
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Energy: 0.2427783313714411
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Energy: 0.24358381562574882
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Energy: 0.112719495682266
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Energy: 0.18150066100320567
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Energy: 0.1815006610056614
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Energy: 0.1815006610036968
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Energy: 0.11378777611754898
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Energy: 0.13056605005935357
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Energy: 0.13056605005886243
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Energy: 0.20780928898494935
Energy: 0.1913429405203924
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Energy: 0.1913429405203924
Energy: 0.17454923246978382
Energy: 0.2078092889820025
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Energy: 0.17454923247052054
Energy: 0.11197648926020465
Energy: 0.1810180962757916
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Energy: 0.181018096272108
Energy: 0.1810545088655867
Energy: 0.11197648926020465
Energy: 0.18101809627456375
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Energy: 0.11197648926020465
Energy: 0.1742525155212618
Energy: 0.18621709941779604
Energy: 0.2221824098329442
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Energy: 0.23724761279486162
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Energy: 0.22218240983073403
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Energy: 0.13274026720333026
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Energy: 0.11390692457441404
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Energy: 0.1814506924386809
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Energy: 0.19819722462324946
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Energy: 0.1895336537537083
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Energy: 0.1820129799901408
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Energy: 0.2435838156250121
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Energy: 0.18888400347919593
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Energy: 0.11217259945317219
Energy: 0.1137877761163211
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Energy: 0.1820129799886674
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Energy: 0.2435838156259944
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Energy: 0.24277833137021326
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Energy: 0.24358381562623999
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Energy: 0.17637042964959634
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Energy: 0.1820890451020085
Energy: 0.17637042964984193
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Energy: 0.24301142738009265
Energy: 0.1535927604250147
Energy: 0.18888400347944154
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Energy: 0.1127194956815293
Energy: 0.18888400347968712
Energy: 0.24301142737864156
Energy: 0.15359276042550585
Energy: 0.18888400347895037
Energy: 0.2430114273805838
Energy: 0.14018607062186575
Energy: 0.1737369137387914
Energy: 0.18150066100492468
Energy: 0.14018607062063787
Energy: 0.1737369137387914
Energy: 0.18150066100590698
Energy: 0.1401860706203923
Energy: 0.173736913739037
Energy: 0.18150066100443352
Energy: 0.14018607062383032
Energy: 0.11217259945366334
Energy: 0.11378777611902242
Energy: 0.19133665930611815
Energy: 0.13056605006107258
Energy: 0.13240123556677902
Energy: 0.19133665930415356
Energy: 0.11217259945415449
Energy: 0.11378777611926799
Energy: 0.19133665930243454
Energy: 0.13056605006009028
Energy: 0.17454923246978382
Energy: 0.20780928898519493
Energy: 0.1913429405203924
Energy: 0.1745492324690471
Energy: 0.20780928898470377
Energy: 0.19134294052014686
Energy: 0.17454923246953824
Energy: 0.20780928898298476
Energy: 0.1913429405186734
Energy: 0.17454923247052054

minimum gb energy = 0.11197648926020465 eV
minimum distance =  2.65856374616338 Angstroms
sigma value = 33


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

Energy: 0.3131371442317526
Energy: 0.3168958143064108
Energy: 0.31981139754595045
Energy: 0.28714143628907984
Energy: 0.31689581430506264
Energy: 0.31981139754729854
Energy: 0.3131371442344489
Energy: 0.3168958143023664
Energy: 0.3198113975446023
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Energy: 0.3312730089536525
Energy: 0.28841015637615136
Energy: 0.30995291322991786
Energy: 0.3312730089550006
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Energy: 0.29415809252875963
Energy: 0.27379686430052663
Energy: 0.30912112390194196
Energy: 0.2907251509150159
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Energy: 0.33898303852434
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Energy: 0.31493045264380837
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Energy: 0.28674270249285283
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Energy: 0.32883899622578017
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Energy: 0.3132068528640982
Energy: 0.27375703368561166
Energy: 0.34507938669992183
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Energy: 0.31188632956882456
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Energy: 0.3142635783364767
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Energy: 0.3023541544173493
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Energy: 0.30235415441600116
Energy: 0.29721471688975054
Energy: 0.3127623188274623
Energy: 0.29172152375479005
Energy: 0.322778938522856
Energy: 0.31894896908010223
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Energy: 0.3092832140615341
Energy: 0.3190067441694635
Energy: 0.29172152375209376
Energy: 0.3227789385242041
Energy: 0.3189489690814503
Energy: 0.29172152375479005
Energy: 0.28889535751685175
Energy: 0.30635896973709886
Energy: 0.3201946958053404
Energy: 0.2888953575114593
Energy: 0.3065862995757069
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Energy: 0.31373320210984534
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Energy: 0.3146258524559566
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Energy: 0.283578296995765
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Energy: 0.2956162662967362
Energy: 0.28357829699711307

minimum gb energy = 0.2728328063715222 eV
minimum distance =  2.58528104404271 Angstroms
sigma value = 219


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

Energy: 0.3362222901344038
Energy: 0.36494242708256996
Energy: 0.3659196355915766
Energy: 0.33622229013529603
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Energy: 0.34201708886714083
Energy: 0.3527405883843958
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Energy: 0.37964628419277596
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Energy: 0.34119075849417546
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Energy: 0.37030597478024246
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Energy: 0.37705980317560395
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Energy: 0.38480464859984853
Energy: 0.37705980317471177
Energy: 0.3460366010619809
Energy: 0.38480464859984853
Energy: 0.37705980317471177

minimum gb energy = 0.3362222901344038 eV
minimum distance =  2.64903340395671 Angstroms
sigma value = 15


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

Energy: 0.41629511229963
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Energy: 0.39100315371158123
Energy: 0.40673263046277347
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Energy: 0.3913592285363243
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Energy: 0.4097585793153402
Energy: 0.40616314039114443
Energy: 0.3913592285363243
Energy: 0.40920831994701656
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minimum gb energy = 0.38550753082106004 eV
minimum distance =  2.58076035900028 Angstroms
sigma value = 293


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

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Energy: 0.3814569027311163
Energy: 0.4062702849782361
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Energy: 0.40233996172019687
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Energy: 0.40233996172019687
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Energy: 0.38631536034960134
Energy: 0.3774667725201748
Energy: 0.40133673975219786
Energy: 0.38631536035000436
Energy: 0.3774667725207794
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Energy: 0.4013367397517948
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Energy: 0.4027962107977994
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Energy: 0.38877717902924275
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Energy: 0.3977283711609383
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Energy: 0.38877717903085496
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Energy: 0.4044077647200505
Energy: 0.38818105749654935
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Energy: 0.419357279153471
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Energy: 0.37682920690795746
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Energy: 0.3814569027315194
Energy: 0.40627028498730494
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Energy: 0.4023399617197938
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Energy: 0.39354924273061337
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Energy: 0.3935492427308149
Energy: 0.38631536034960134
Energy: 0.3774667725201748
Energy: 0.40133673975280243
Energy: 0.38631536034980285
Energy: 0.3774667725167488
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Energy: 0.3774667725183611
Energy: 0.40133673975280243
Energy: 0.38631536035000436
Energy: 0.40279621079719485
Energy: 0.40405339803451024
Energy: 0.40377076611923796
Energy: 0.40279621079719485
Energy: 0.4040533980349133
Energy: 0.4037707661188349
Energy: 0.4027962107969933
Energy: 0.40405339803511475
Energy: 0.4037707661184318
Energy: 0.40279621079739636
Energy: 0.38387261616270724
Energy: 0.4012221077182125
Energy: 0.3774055693483546
Energy: 0.3838726161604904
Energy: 0.40122210771639877
Energy: 0.3774055693459363
Energy: 0.3838726161612965
Energy: 0.4012221077178094
Energy: 0.3774055693455332
Energy: 0.38387261616230417
Energy: 0.39340912749699525
Energy: 0.4021500553566143
Energy: 0.40234297706685473
Energy: 0.3934091274963906
Energy: 0.40215005535641274
Energy: 0.4023429770676609
Energy: 0.3934091274975998
Energy: 0.4021500553566143
Energy: 0.40234297706685473
Energy: 0.39340912749840595
Energy: 0.40618959593524095
Energy: 0.38175854118266805
Energy: 0.37914020980086577
Energy: 0.40618959593524095
Energy: 0.3817585411828696
Energy: 0.37914020980066426
Energy: 0.40618959593584547
Energy: 0.3817585411820635
Energy: 0.37914020980086577
Energy: 0.40618959593745774
Energy: 0.3929716070252622
Energy: 0.3810042109555233
Energy: 0.3772297222178678
Energy: 0.3929716070256652
Energy: 0.3810042109551202
Energy: 0.3772297222170617
Energy: 0.3929716070254637
Energy: 0.3810042109545156
Energy: 0.3772297222170617
Energy: 0.3929716070256652

minimum gb energy = 0.3767694831365392 eV
minimum distance =  2.59117471831604 Angstroms
sigma value = 293


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

Energy: 0.3950911301150299
Energy: 0.3785856859358452
Energy: 0.37856216263776954
Energy: 0.39509113011575836
Energy: 0.3785856859343882
Energy: 0.3785621626388622
Energy: 0.39509113011539415
Energy: 0.3785856859336597
Energy: 0.37856216263740533
Energy: 0.39509113011575836
Energy: 0.3782293559466379
Energy: 0.39414439427784226
Energy: 0.37847727688097615
Energy: 0.3782293559455452
Energy: 0.3941443942763853
Energy: 0.3784772768824331
Energy: 0.3782293559459094
Energy: 0.3941443942760211
Energy: 0.37847727688061195
Energy: 0.3782293559459094
Energy: 0.3783135168889695
Energy: 0.3784590458768665
Energy: 0.42891865620677294
Energy: 0.3783135168904265
Energy: 0.3784590458783235
Energy: 0.42891865620713726
Energy: 0.3783135168900622
Energy: 0.37845904587468104
Energy: 0.42891865620677294
Energy: 0.3783135168922477
Energy: 0.42898620459398834
Energy: 0.3783777474091062
Energy: 0.3783234212348847
Energy: 0.428986204593624
Energy: 0.3783777474091062
Energy: 0.37832342123779866
Energy: 0.428986204593624
Energy: 0.37837774740983465
Energy: 0.37832342123743445
Energy: 0.42898620459398834
Energy: 0.3784781949505489
Energy: 0.3940988172780155
Energy: 0.3781759668005158
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Energy: 0.37817596680124427
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Energy: 0.3940988172765585
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Energy: 0.3784781949498204
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Energy: 0.3785621626366768
Energy: 0.39509113011539415
Energy: 0.3785856859358452
Energy: 0.3785621626359483
Energy: 0.3950911301161226
Energy: 0.3785856859351167
Energy: 0.37856216263740533
Energy: 0.3950911301150299
Energy: 0.37858568593293124
Energy: 0.39414439427711384
Energy: 0.3784772768824331
Energy: 0.3782293559491876
Energy: 0.3941443942782065
Energy: 0.37847727688170457
Energy: 0.37822935594773066
Energy: 0.39414439427747805
Energy: 0.37847727688206884
Energy: 0.37822935594845913
Energy: 0.39414439427929926
Energy: 0.3784590458757738
Energy: 0.42891865620713726
Energy: 0.3783135168889695
Energy: 0.3784590458772308
Energy: 0.42891865620677294
Energy: 0.3783135168900622
Energy: 0.37845904587213136
Energy: 0.42891865620713726
Energy: 0.3783135168904265
Energy: 0.3784590458772308
Energy: 0.37837774740947044
Energy: 0.3783234212399842
Energy: 0.42898620459398834
Energy: 0.378377747410199
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Energy: 0.37837774740947044
Energy: 0.3783234212356133
Energy: 0.42898620459398834
Energy: 0.3783777474076492
Energy: 0.3940988172780155
Energy: 0.3781759667994231
Energy: 0.3784781949505489
Energy: 0.3940988172769228
Energy: 0.37817596680160853
Energy: 0.3784781949490919
Energy: 0.3940988172765585
Energy: 0.37817596680270127
Energy: 0.37847819495091317
Energy: 0.3940988172765585
Energy: 0.3785621626359483
Energy: 0.3950911301161226
Energy: 0.37858568593220276
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Energy: 0.37858568593147424
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Energy: 0.39509113011575836
Energy: 0.378585685934024
Energy: 0.37856216263776954
Energy: 0.37847727688061195
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Energy: 0.3941443942785708
Energy: 0.3784772768824331
Energy: 0.37822935594882334
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Energy: 0.37847727688170457
Energy: 0.3782293559480949
Energy: 0.39414439427784226
Energy: 0.3784772768824331
Energy: 0.42891865620677294
Energy: 0.3783135168918835
Energy: 0.3784590458765023
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Energy: 0.378313516889698
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Energy: 0.3784590458757738
Energy: 0.42891865620713726
Energy: 0.37832342124107693
Energy: 0.4289862045932598
Energy: 0.3783777474091062
Energy: 0.3783234212359775
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Energy: 0.37837774740983465
Energy: 0.3783234212381629
Energy: 0.428986204593624
Energy: 0.3783777474091062
Energy: 0.37832342123743445
Energy: 0.37817596680160853
Energy: 0.3784781949498204
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Energy: 0.37817596680197274
Energy: 0.3784781949465422
Energy: 0.3940988172776513
Energy: 0.37817596680015153
Energy: 0.3784781949505489
Energy: 0.3940988172765585
Energy: 0.37817596680088
Energy: 0.39509113011539415
Energy: 0.37858568593293124
Energy: 0.37856216263776954
Energy: 0.3950911301161226
Energy: 0.37858568593147424
Energy: 0.3785621626388622
Energy: 0.3950911301150299
Energy: 0.37858568593293124
Energy: 0.37856216263813375
Energy: 0.39509113011575836
Energy: 0.37822935594736645
Energy: 0.39414439427747805
Energy: 0.37847727688097615
Energy: 0.3782293559480949
Energy: 0.39414439427929926
Energy: 0.3784772768824331
Energy: 0.37822935594773066
Energy: 0.3941443942763853
Energy: 0.37847727688061195
Energy: 0.37822935594736645
Energy: 0.3783135168922477
Energy: 0.3784590458783235
Energy: 0.42891865620677294
Energy: 0.37831351689151926
Energy: 0.3784590458768665
Energy: 0.4289186562075014
Energy: 0.3783135168900622
Energy: 0.37845904587613804
Energy: 0.42891865620677294
Energy: 0.37831351689261195
Energy: 0.428986204593624
Energy: 0.3783777474091062
Energy: 0.378323421236706
Energy: 0.42898620459398834
Energy: 0.37837774740983465
Energy: 0.3783234212363418
Energy: 0.428986204593624
Energy: 0.378377747410199
Energy: 0.3783234212392557
Energy: 0.42898620459398834
Energy: 0.37847819494763496
Energy: 0.3940988172765585
Energy: 0.3781759667986946
Energy: 0.3784781949520059
Energy: 0.3940988172769228
Energy: 0.37817596680233706
Energy: 0.3784781949490919
Energy: 0.394098817277287
Energy: 0.37817596680124427
Energy: 0.37847819495091317
Energy: 0.378585685934024
Energy: 0.37856216263704107
Energy: 0.39509113011539415
Energy: 0.378585685932567
Energy: 0.3785621626363126
Energy: 0.39509113011575836
Energy: 0.378585685932567
Energy: 0.37856216263704107
Energy: 0.3950911301150299
Energy: 0.3785856859318385
Energy: 0.39414439427893505
Energy: 0.37847727688206884
Energy: 0.37822935594700213
Energy: 0.39414439427784226
Energy: 0.37847727688097615
Energy: 0.37822935594736645
Energy: 0.3941443942785708
Energy: 0.3784772768824331
Energy: 0.37822935594700213
Energy: 0.3941443942785708

minimum gb energy = 0.3781759667986946 eV
minimum distance =  2.61744555160111 Angstroms
sigma value = 15


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

Energy: 0.40439352973162307
Energy: 0.4080650291237353
Energy: 0.4077171031515191
Energy: 0.3985388812155333
Energy: 0.408065029118782
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Energy: 0.4043935297332742
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Energy: 0.3985388812155333
Energy: 0.4038749400125565
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Energy: 0.38620959756497986
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Energy: 0.3888299994524504
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Energy: 0.37693127805003845
Energy: 0.4335113215024488
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Energy: 0.37693065599163106
Energy: 0.43351132150575106
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Energy: 0.37693127805499177
Energy: 0.43351132149914656
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Energy: 0.3889343553336959
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Energy: 0.38695986780048863
Energy: 0.38893435533204473
Energy: 0.39171922042946083
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Energy: 0.3838685160026873
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Energy: 0.39323605712346565
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Energy: 0.39323605712676785
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Energy: 0.3910853974797513
Energy: 0.39323605712676785
Energy: 0.3838685160076406
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Energy: 0.3877921475896276
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Energy: 0.39696208414437617
Energy: 0.38779214759623204
Energy: 0.39583846969156744
Energy: 0.4580370037631996
Energy: 0.3977536554042426
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Energy: 0.4580370037648206
Energy: 0.39775365540259155
Energy: 0.39583846969982306
Energy: 0.45803700377142503
Energy: 0.3977536554009404
Energy: 0.3958384696965208
Energy: 0.40227608420262784
Energy: 0.37829836287945073
Energy: 0.4193734751475507
Energy: 0.40227608420262784
Energy: 0.37830161693293274
Energy: 0.4193734751475507
Energy: 0.4022760842059301
Energy: 0.37829836287945073
Energy: 0.41937347515085294
Energy: 0.40227608420427896
Energy: 0.3890717636517641
Energy: 0.38877399281459835
Energy: 0.42495428012365694
Energy: 0.3890717636517641
Energy: 0.38877399281459835
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Energy: 0.3890717636484619
Energy: 0.3887739928112961
Energy: 0.42495428011870356
Energy: 0.38907176365011303
Energy: 0.3901113714394114
Energy: 0.388701066525587
Energy: 0.3839934476594118
Energy: 0.3901113714361091
Energy: 0.3887010665305104
Energy: 0.38399338966170915
Energy: 0.39011137144106245
Energy: 0.3887010665272381
Energy: 0.3839934476577607
Energy: 0.3901113714394114
Energy: 0.3748787172942924
Energy: 0.3806373138242287
Energy: 0.3905304653514684
Energy: 0.3748787172959435
Energy: 0.3806373138242287
Energy: 0.3905304653547706
Energy: 0.3748787172942924
Energy: 0.38063731382753085
Energy: 0.3905304653564217
Energy: 0.3748787172959435
Energy: 0.3910750474881379
Energy: 0.42390201300375147
Energy: 0.3923517744884654
Energy: 0.39107504748318445
Energy: 0.4239020130004493
Energy: 0.3923517744884654
Energy: 0.3910750474864867
Energy: 0.42390201300375147
Energy: 0.39235177448681435
Energy: 0.3910750474848356

minimum gb energy = 0.3737380662212119 eV
minimum distance =  2.60721092820516 Angstroms
sigma value = 437


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

Energy: 0.37941840217668527
Energy: 0.3900206524994724
Energy: 0.38980035009389286
Energy: 0.3794184021748807
Energy: 0.39002065249706624
Energy: 0.3898003500914867
Energy: 0.37941840217668527
Energy: 0.3900206524982693
Energy: 0.3898003500914867
Energy: 0.3794184021754823
Energy: 0.4344887558138451
Energy: 0.3742806618796229
Energy: 0.3681966719875524
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Energy: 0.3742806618796229
Energy: 0.3681966719881539
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Energy: 0.4168678547692487
Energy: 0.3687982857957785
Energy: 0.4426450773252773
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Energy: 0.3687982857969815
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Energy: 0.4426450773252773
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Energy: 0.40901551612851506
Energy: 0.4166518272463996
Energy: 0.37450244725619064
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Energy: 0.3745024472555891
Energy: 0.40901551612851506
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Energy: 0.37740407699139633
Energy: 0.37433752567091916
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Energy: 0.3709810044137896
Energy: 0.36896272883955455
Energy: 0.3740343671273353
Energy: 0.3709810044125865
Energy: 0.36896272883835146
Energy: 0.37403436713094446
Energy: 0.37325493334677334
Energy: 0.4176813531155513
Energy: 0.41482485471451847
Energy: 0.3732549333521871
Energy: 0.41768135311615284
Energy: 0.41482485471451847
Energy: 0.3732549333521871
Energy: 0.4176813531155513
Energy: 0.41482485471512
Energy: 0.37325493335459325
Energy: 0.4632659865755423
Energy: 0.37431216231667885
Energy: 0.3706004426680247
Energy: 0.46326598657614393
Energy: 0.3743121623160773
Energy: 0.3706004426680247
Energy: 0.4632659865755423
Energy: 0.3743121623172804
Energy: 0.3706004426680247
Energy: 0.4632659865773196
Energy: 0.41305081168192803
Energy: 0.3812063663756125
Energy: 0.42898171832128473
Energy: 0.4130508116813265
Energy: 0.3812063663774171
Energy: 0.4289817183224877
Energy: 0.4130508116813265
Energy: 0.381206366376214
Energy: 0.428981718317074
Energy: 0.4130508116813265
Energy: 0.4104629937767505
Energy: 0.40501646724574986
Energy: 0.3683739315407104
Energy: 0.4104629937779536
Energy: 0.4050164672469529
Energy: 0.3683739315413119
Energy: 0.4104629937767505
Energy: 0.40501646724574986
Energy: 0.3683739315401088
Energy: 0.4104629937779536
Energy: 0.38161446727394843
Energy: 0.36945805232372836
Energy: 0.37528282584555267
Energy: 0.3816144672775576
Energy: 0.3694580523231268
Energy: 0.37528282584555267
Energy: 0.38161446729858384
Energy: 0.36945805232372836
Energy: 0.37528282584495115
Energy: 0.3816144673015915
Energy: 0.3709184589723623
Energy: 0.4497045205296227
Energy: 0.37100198556653796
Energy: 0.37091845897416686
Energy: 0.4497045205296227
Energy: 0.371001985567741
Energy: 0.3709184589723623
Energy: 0.4497045205296227
Energy: 0.37100198556593644
Energy: 0.37091845897416686
Energy: 0.3923172676186458
Energy: 0.369096260085682
Energy: 0.4130146832104605
Energy: 0.39231726761744284
Energy: 0.36909626008628355
Energy: 0.4130146832146713
Energy: 0.39231726761744284
Energy: 0.36909626008508045
Energy: 0.413014683211062
Energy: 0.39231726761744284

minimum gb energy = 0.3681966719875524 eV
minimum distance =  2.5783579874057 Angstroms
sigma value = 33