Model name: model_name=EAM_Dynamo_MendelevHanSrolovitz_2003_Fe__MO_807997826449_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855324894189835
cohesive_energy=4.1227593179916635
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.012772774563998878
Energy: 0.013397316845741228
Energy: 0.42638217750028723
Energy: 0.013397316843758427
Energy: 0.012772774563998878
Energy: 0.01339731684426111
Energy: 0.01339731684426111
Energy: 2.1573243398181523
Energy: 0.013397316843758427
Energy: 2.157324339828457
Energy: 0.013397316843758427
Energy: 2.157324339821084
Energy: 0.4263821775007899
Energy: 0.013397316843758427
Energy: 0.012772774563998878
Energy: 0.01339731684426111
Energy: 0.42638217750028723
Energy: 0.013397316842780992
Energy: 0.013397316843283673
Energy: 2.1573243398230675
Energy: 0.013397316842780992
Energy: 2.1573243398220896
Energy: 0.013397316844763791
Energy: 2.1573243398220896
Energy: 0.012772774563998878
Energy: 0.01339731684426111
Energy: 0.4263821774997846
Energy: 0.013397316844763791
Energy: 0.012772774563998878
Energy: 0.01339731684426111
Energy: 0.01339731684426111
Energy: 2.1573243398181523
Energy: 0.013397316843283673
Energy: 2.157324339824045
Energy: 0.01339731684426111
Energy: 2.157324339825525

minimum gb energy = 0.012772774563998878 eV
minimum distance =  2.45226587959945 Angstroms
sigma value = 1


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

Energy: 1.2684655993825595
Energy: 1.333807080959151
Energy: 1.152886974844205
Energy: 1.333807080959151
Energy: 1.2684655993813496
Energy: 1.333807080957941
Energy: 1.228582089111756
Energy: 1.3021204260771613
Energy: 1.2615420763106406
Energy: 1.3021204260783712
Energy: 1.228582089112966
Energy: 1.3021204260759516
Energy: 1.1185263836729022
Energy: 1.2997156796882412
Energy: 1.2609337310191755
Energy: 1.2997156796882412
Energy: 1.1185263836729022
Energy: 1.2997156796894511
Energy: 1.291099952156348
Energy: 1.277461212338027
Energy: 1.1198279434285239
Energy: 1.277461212338027
Energy: 1.291099952156348
Energy: 1.2774612123331868
Energy: 1.2894972937136133
Energy: 1.3218383216982197
Energy: 1.2498744888762987
Energy: 1.3218383216994298
Energy: 1.2894972937136133
Energy: 1.3218383216982197
Energy: 1.2619873530099486
Energy: 1.3036963314729342
Energy: 1.124428539451307
Energy: 1.303696331474144
Energy: 1.2619873530087384
Energy: 1.303696331474144
Energy: 1.2618418677885739
Energy: 1.2986783018015102
Energy: 1.1244949535860194
Energy: 1.2986783018003005
Energy: 1.2618418677885739
Energy: 1.2986783018015102
Energy: 1.3113965396768634
Energy: 1.3233086786164396
Energy: 1.120914465234863
Energy: 1.3233086786152295
Energy: 1.3113965396768634
Energy: 1.3233086786164396
Energy: 1.326728128463893
Energy: 1.2694924789581223
Energy: 1.1196920519941802
Energy: 1.2694924789665925
Energy: 1.326728128466313
Energy: 1.2694924789702224
Energy: 1.263292598281849
Energy: 1.2973864925830214
Energy: 1.1253307725041237
Energy: 1.2973864925842313
Energy: 1.263292598281849
Energy: 1.2973864925842313
Energy: 1.1906681789243565
Energy: 1.2856112705923681
Energy: 1.2261665650724731
Energy: 1.285611270598418
Energy: 1.190668178927987
Energy: 1.2856112706008378
Energy: 1.1220775167248993
Energy: 1.3214225431165432
Energy: 1.122085204184579
Energy: 1.321422543117753
Energy: 1.1220775167248993
Energy: 1.321422543117753
Energy: 1.2263242346019159
Energy: 1.2856112705923681
Energy: 1.1187340470470306
Energy: 1.285611270605678
Energy: 1.2263242346019159
Energy: 1.2856112706080431
Energy: 1.1255700243332925
Energy: 1.2976055418555847
Energy: 1.2632966758522992
Energy: 1.2976055418567947
Energy: 1.1255700243332925
Energy: 1.2976055418567947
Energy: 1.1195468616075208
Energy: 1.2712404308290743
Energy: 1.3264055646520074
Energy: 1.2712404308314946
Energy: 1.1195468616075208
Energy: 1.2712404308363348
Energy: 1.1208708072983737
Energy: 1.3233129661766534
Energy: 1.3114085198902563
Energy: 1.3233129661766534
Energy: 1.1208708072983737
Energy: 1.3233129661766534
Energy: 1.1243435657535228
Energy: 1.2984633793143812
Energy: 1.2624456749654829
Energy: 1.2984633793143812
Energy: 1.1243435657535228
Energy: 1.2984633793143812
Energy: 1.124788437299135
Energy: 1.303924978782655
Energy: 1.2641972536099535
Energy: 1.303924978782655
Energy: 1.124788437299135
Energy: 1.303924978782655
Energy: 1.1934515254402371
Energy: 1.321939315973888
Energy: 1.289075232553329
Energy: 1.3219393159750976
Energy: 1.1934515254390272
Energy: 1.3219393159750976
Energy: 1.1197533268367725
Energy: 1.2666869855818208
Energy: 1.288970106603597
Energy: 1.266686985576981
Energy: 1.1197533268355626
Energy: 1.2666869855794007
Energy: 1.2608130732963612
Energy: 1.2997344677653775
Energy: 1.1185106026879903
Energy: 1.2997344677653775
Energy: 1.2608130732963612
Energy: 1.2997344677653775
Energy: 1.2630373279151579
Energy: 1.3011922774991902
Energy: 1.2281644344723803
Energy: 1.3011922775004003
Energy: 1.2630373279127383
Energy: 1.3011922775028206
Energy: 1.2250319916413968
Energy: 1.333807080957941
Energy: 1.2684655993825595
Energy: 1.333807080957941
Energy: 1.2250319915663757
Energy: 1.333807080957941

minimum gb energy = 1.1185106026879903 eV
minimum distance =  2.23471711438363 Angstroms
sigma value = 33


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

Energy: 1.6676737186101014
Energy: 1.3908580610202532
Energy: 1.2302811811539365
Energy: 1.3908580610202532
Energy: 1.6676737186101014
Energy: 1.3908580610202532
Energy: 1.2354694109525362
Energy: 1.3564239740995696
Energy: 1.3890164760777124
Energy: 1.3564239741002582
Energy: 1.2354694109552895
Energy: 1.3564239740995696
Energy: 1.163410770245993
Energy: 1.3874017973526234
Energy: 1.3612500110798431
Energy: 1.3874017973539998
Energy: 1.1634107702453047
Energy: 1.3874017973533115
Energy: 1.2635256963055594
Energy: 1.3343537732654334
Energy: 1.3750548800902034
Energy: 1.3343537732661215
Energy: 1.2635256963034946
Energy: 1.3343537732654334
Energy: 1.2631815729921678
Energy: 1.3879128854905762
Energy: 1.3386851355697953
Energy: 1.3879128854898881
Energy: 1.2631815729921678
Energy: 1.3879128854898881
Energy: 1.280868778547336
Energy: 1.3661110987955922
Energy: 1.1700036824269366
Energy: 1.3661110987955922
Energy: 1.280868778547336
Energy: 1.3661110987955922
Energy: 1.2809449201315417
Energy: 1.3660739813419376
Energy: 1.3514834983862283
Energy: 1.3660739813419376
Energy: 1.28094492013223
Energy: 1.3660739813419376
Energy: 1.1958059514674835
Energy: 1.3679568734510492
Energy: 1.3250443434756407
Energy: 1.367956873450361
Energy: 1.1958059514667951
Energy: 1.3679568734496728
Energy: 1.3037674643964345
Energy: 1.3332933710183985
Energy: 1.3721164070553353
Energy: 1.3332933710128922
Energy: 1.3037674643943697
Energy: 1.3332933710142687
Energy: 1.2328736143916639
Energy: 1.3872135843807791
Energy: 1.2378092510750434
Energy: 1.3872135843807791
Energy: 1.2328736143916639
Energy: 1.3872135843807791
Energy: 1.235180653176669
Energy: 1.3582258995952035
Energy: 1.2848807847727124
Energy: 1.35822589959658
Energy: 1.2351806531773573
Energy: 1.3582258995958916
Energy: 1.3599431140770546
Energy: 1.369023737443859
Energy: 1.2351908153236189
Energy: 1.3690237374445473
Energy: 1.3599431140763663
Energy: 1.3690237374445473
Energy: 1.4270917552662745
Energy: 1.3380725479962692
Energy: 1.2349728190153075
Energy: 1.3380725480003985
Energy: 1.427091755267651
Energy: 1.3380725480017752
Energy: 1.3065657392348382
Energy: 1.3871122816494363
Energy: 1.29252938225155
Energy: 1.387112281648748
Energy: 1.3065657392362149
Energy: 1.3871122816494363
Energy: 1.3609841035069095
Energy: 1.3748215965874588
Energy: 1.3421817234600073
Energy: 1.374821596588147
Energy: 1.3609841035075976
Energy: 1.3748215965874588
Energy: 1.3614406903922482
Energy: 1.3878154498265
Energy: 1.2320597211857276
Energy: 1.3878154498271882
Energy: 1.361440690393625
Energy: 1.3878154498271882
Energy: 1.3784422993515957
Energy: 1.3665165640599268
Energy: 1.2407364537008603
Energy: 1.3665165640599268
Energy: 1.3784422993536602
Energy: 1.3665165640599268
Energy: 1.3756941237080818
Energy: 1.3581062865477922
Energy: 1.3731341591530084
Energy: 1.3581062865471036
Energy: 1.3756941237080818
Energy: 1.3581062865464155
Energy: 1.1701408928449568
Energy: 1.3687489439000018
Energy: 1.3040954727235576
Energy: 1.3687489439000018
Energy: 1.1701408928456452
Energy: 1.3687489439000018
Energy: 1.3157251166269115
Energy: 1.3287206758374295
Energy: 1.3725420033180369
Energy: 1.3287206758388057
Energy: 1.3157251166269115
Energy: 1.3287206758360528
Energy: 1.359539681000252
Energy: 1.388070953120155
Energy: 1.2164512377117003
Energy: 1.388070953120155
Energy: 1.35953968100094
Energy: 1.388070953120155
Energy: 1.2357233473847886
Energy: 1.3587253508669694
Energy: 1.4274054948077162
Energy: 1.3587253508697226
Energy: 1.2357233473847886
Energy: 1.3587253508669694
Energy: 1.237577524337846
Energy: 1.3689890690027486
Energy: 1.339308718091024
Energy: 1.3689890690055013
Energy: 1.237577524337846
Energy: 1.368989069004125
Energy: 1.4574205374776446
Energy: 1.3572001672218146
Energy: 1.2827914122710478
Energy: 1.3572001672183733
Energy: 1.4574205374755798
Energy: 1.3572001672183733
Energy: 1.2793922281786174
Energy: 1.3663285220409256
Energy: 1.3612482800235521
Energy: 1.3663285220423025
Energy: 1.2793922281793055
Energy: 1.3663285220423025
Energy: 1.2916764659592985
Energy: 1.3879092197024505
Energy: 1.2468864337480388
Energy: 1.3879092197024505
Energy: 1.2916764659592985
Energy: 1.3879092197017624
Energy: 1.2917519397681736
Energy: 1.3881163678689268
Energy: 1.189037857965588
Energy: 1.3881163678682387
Energy: 1.2917519397674853
Energy: 1.3881163678682387
Energy: 1.2794482132525808
Energy: 1.3663134013502818
Energy: 1.3606944382618624
Energy: 1.3663134013495937
Energy: 1.2794482132532692
Energy: 1.3663134013502818
Energy: 1.4568998996562876
Energy: 1.3574675002421823
Energy: 1.2839251510955536
Energy: 1.3574675002421823
Energy: 1.4568998996542226
Energy: 1.3574675002414942
Energy: 1.238044381692156
Energy: 1.369024925814338
Energy: 1.3019724575607843
Energy: 1.369024925814338
Energy: 1.238044381692156
Energy: 1.3690249258136498
Energy: 1.2357349886237898
Energy: 1.3587253508752286
Energy: 1.4231188382819837
Energy: 1.3587253508752286
Energy: 1.2357349886244782
Energy: 1.358725350873164
Energy: 1.3594685065771037
Energy: 1.3886481894024063
Energy: 1.2164874861200807
Energy: 1.3886481894037832
Energy: 1.3594685065764154
Energy: 1.3886481894030946
Energy: 1.316056371330412
Energy: 1.3324880734791442
Energy: 1.3715836920516764
Energy: 1.3324880734777678
Energy: 1.3160563713290356
Energy: 1.3324880734791442
Energy: 1.1701443350456018
Energy: 1.3687293992473926
Energy: 1.2811931215242187
Energy: 1.3687293992480807
Energy: 1.1701443350462901
Energy: 1.3687293992480807
Energy: 1.3748751820118745
Energy: 1.3578749001175003
Energy: 1.437927785455991
Energy: 1.3578749001181887
Energy: 1.3748751820125626
Energy: 1.3578749001181887
Energy: 1.373696893085841
Energy: 1.3664838225075717
Energy: 1.2400650992351883
Energy: 1.36648382250826
Energy: 1.3736968930872178
Energy: 1.3664838225075717
Energy: 1.3643488958731051
Energy: 1.3880288639530878
Energy: 1.2084048752879157
Energy: 1.3880288639544642
Energy: 1.364348895871729
Energy: 1.3880288639544642
Energy: 1.3629432075380103
Energy: 1.3718990982408301
Energy: 1.3388197137896725
Energy: 1.371899098241518
Energy: 1.3629432075373222
Energy: 1.3718990982408301
Energy: 1.3049208987608498
Energy: 1.387150056374119
Energy: 1.292341029166191
Energy: 1.3871500563734307
Energy: 1.3049208987608498
Energy: 1.3871500563727426
Energy: 1.4284319969840402
Energy: 1.341240824224582
Energy: 1.2360075825167145
Energy: 1.3412408242259581
Energy: 1.4284319969840402
Energy: 1.3412408242259581
Energy: 1.359935496427096
Energy: 1.3689837191359375
Energy: 1.2058249982799718
Energy: 1.3689837191352494
Energy: 1.3599354964264077
Energy: 1.3689837191352494

minimum gb energy = 1.1634107702453047 eV
minimum distance =  2.2279889866229 Angstroms
sigma value = 51


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

Energy: 1.436525688405369
Energy: 1.407243352835438
Energy: 1.3644741233934632
Energy: 1.407243352835438
Energy: 1.436525688405369
Energy: 1.407243352835438
Energy: 1.29008241622455
Energy: 1.4459600516662263
Energy: 1.6384262125987334
Energy: 1.4459600031778392
Energy: 1.2900824162261446
Energy: 1.4459599621587496
Energy: 1.1699074892930093
Energy: 1.4075863768025456
Energy: 1.5019010057002173
Energy: 1.407586376800951
Energy: 1.1699074892914145
Energy: 1.407586376800951
Energy: 1.181720721767001
Energy: 1.3482493427163822
Energy: 1.5056874429340334
Energy: 1.3482493427147877
Energy: 1.181720721767001
Energy: 1.3482493427147877
Energy: 1.1806985507326504
Energy: 1.3521092223207203
Energy: 1.4221045184668775
Energy: 1.352109222322315
Energy: 1.180698550734245
Energy: 1.352109222322315
Energy: 1.437415128311191
Energy: 1.3513232872754213
Energy: 1.5490951095450947
Energy: 1.3513232872786103
Energy: 1.4374151283095962
Energy: 1.3513232872786103
Energy: 1.4381439109515188
Energy: 1.3513019062007399
Energy: 1.3059062315892127
Energy: 1.3513019061991451
Energy: 1.438143910949924
Energy: 1.3513019061991451
Energy: 1.1819959608000663
Energy: 1.3485400382727701
Energy: 1.1618851673230572
Energy: 1.3485400382584543
Energy: 1.1819959608000663
Energy: 1.348540038263202
Energy: 1.438220035526332
Energy: 1.37670718864063
Energy: 1.192485375314233
Energy: 1.3767071886486033
Energy: 1.4382200355215478
Energy: 1.3767071886470088
Energy: 1.1724820409239445
Energy: 1.4361013009619858
Energy: 1.1618123533552374
Energy: 1.4361013009619858
Energy: 1.17248204092235
Energy: 1.4361013009619858
Energy: 1.5086342762526639
Energy: 1.349837257949206
Energy: 1.5189679102658504
Energy: 1.3498372579476114
Energy: 1.5086342762494747
Energy: 1.349837257949206
Energy: 1.43872952615281
Energy: 1.4075468592062617
Energy: 1.549015004445808
Energy: 1.4075468592078564
Energy: 1.43872952615281
Energy: 1.4075468592078564
Energy: 1.3139106881092208
Energy: 1.3634605169741112
Energy: 1.506355353796738
Energy: 1.3634605169788954
Energy: 1.3139106881092208
Energy: 1.3634605169741112
Energy: 1.1726400090849303
Energy: 1.407490113244527
Energy: 1.515898219524322
Energy: 1.407490113244527
Energy: 1.1726400090849303
Energy: 1.407490113244527
Energy: 1.169880781060662
Energy: 1.407881671888092
Energy: 1.5096146790324556
Energy: 1.4078816718864973
Energy: 1.169880781060662
Energy: 1.4078816718864973
Energy: 1.1807127206020465
Energy: 1.3503659695856116
Energy: 1.5035514259449367
Energy: 1.3503659695824224
Energy: 1.1807127206036048
Energy: 1.3503659695856116
Energy: 1.4371721765255612
Energy: 1.408036141786293
Energy: 1.5450699823607699
Energy: 1.4080361417910767
Energy: 1.4371721765239664
Energy: 1.4080361417894822
Energy: 1.4371327239853255
Energy: 1.3517201485439676
Energy: 1.5059364169124851
Energy: 1.351720148547157
Energy: 1.4371327239869203
Energy: 1.351720148547157

minimum gb energy = 1.1618123533552374 eV
minimum distance =  2.20476972498309 Angstroms
sigma value = 19


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

Energy: 1.546337687134189
Energy: 1.5133135897389298
Energy: 1.271949342779288
Energy: 1.5133135897398755
Energy: 1.546337687134189
Energy: 1.5133135897398755
Energy: 1.2930583805153792
Energy: 1.4827918934481017
Energy: 1.4216251765115087
Energy: 1.4827918934490476
Energy: 1.2930583805153792
Energy: 1.482791893447156
Energy: 1.2120970790914383
Energy: 1.4618509735112935
Energy: 1.3741359812262564
Energy: 1.4618509735112935
Energy: 1.2120970790914383
Energy: 1.4618509735112935
Energy: 1.2687257018971705
Energy: 1.4492769436473938
Energy: 1.3763714383993617
Energy: 1.44927694364834
Energy: 1.2687257018971705
Energy: 1.4492769436473938
Energy: 1.2978952664397645
Energy: 1.5272885948676245
Energy: 1.5699185329121894
Energy: 1.5272885948685704
Energy: 1.29789526644071
Energy: 1.5272885948676245
Energy: 1.5697512699729461
Energy: 1.5273455370522377
Energy: 1.2977369719498975
Energy: 1.5273455370512918
Energy: 1.5697512699729461
Energy: 1.5273455370512918
Energy: 1.3743428799941124
Energy: 1.4491504674107971
Energy: 1.2328198213388326
Energy: 1.4491504674098512
Energy: 1.3743428799969502
Energy: 1.4491504674089053
Energy: 1.374263402151356
Energy: 1.4619023013682102
Energy: 1.2120621673775833
Energy: 1.4619023013682102
Energy: 1.374263402151356
Energy: 1.4619023013682102
Energy: 1.4215308853908506
Energy: 1.4828391568712422
Energy: 1.2802411763155377
Energy: 1.4828391568712422
Energy: 1.4215308853899047
Energy: 1.4828391568712422
Energy: 1.313718727364054
Energy: 1.5133135897398755
Energy: 1.5463376871351349
Energy: 1.5133135897389298
Energy: 1.3137187273621622
Energy: 1.5133135897389298
Energy: 1.421625176510563
Energy: 1.4827918934490476
Energy: 1.2930583805163252
Energy: 1.4827918934490476
Energy: 1.4216251765115087
Energy: 1.4827918934490476
Energy: 1.3741359812253107
Energy: 1.4618509735122396
Energy: 1.2120970790914383
Energy: 1.4618509735112935
Energy: 1.3741359812253107
Energy: 1.4618509735112935
Energy: 1.3763714384267718
Energy: 1.4492769436473938
Energy: 1.2332990771902732
Energy: 1.44927694364834
Energy: 1.3763714384031451
Energy: 1.44927694364834
Energy: 1.5699185329150271
Energy: 1.5272885948676245
Energy: 1.29789526644071
Energy: 1.5272885948666786
Energy: 1.5699185329140812
Energy: 1.5272885948666786
Energy: 1.2977369719489515
Energy: 1.5273455370531837
Energy: 1.5176006388388446
Energy: 1.5273455370531837
Energy: 1.2977369719498975
Energy: 1.5273455370522377
Energy: 1.3042742847120008
Energy: 1.4491504674107971
Energy: 1.3743428799893829
Energy: 1.4491504674107971
Energy: 1.304274284713871
Energy: 1.449150467412689
Energy: 1.2120621673775833
Energy: 1.461902301369156
Energy: 1.3742634021523021
Energy: 1.4619023013682102
Energy: 1.2120621673785292
Energy: 1.4619023013682102
Energy: 1.2802411763164834
Energy: 1.482839156872188
Energy: 1.4215308853889803
Energy: 1.482839156873134
Energy: 1.2802411763164834
Energy: 1.482839156872188
Energy: 1.546337687134189
Energy: 1.5133135897398755
Energy: 1.3137187273593245
Energy: 1.5133135897398755
Energy: 1.5463376871351349
Energy: 1.5133135897389298
Energy: 1.2930583805153792
Energy: 1.4827918934481017
Energy: 1.421625176510563
Energy: 1.4827918934490476
Energy: 1.293058380517271
Energy: 1.4827918934490476
Energy: 1.2120970790914383
Energy: 1.4618509735112935
Energy: 1.3741359812272023
Energy: 1.4618509735112935
Energy: 1.2120970790914383
Energy: 1.4618509735112935
Energy: 1.2332990771893273
Energy: 1.4492769436473938
Energy: 1.3763714384759376
Energy: 1.4492769436473938
Energy: 1.2332990771902732
Energy: 1.4492769436473938
Energy: 1.2978952664397645
Energy: 1.5272885948676245
Energy: 1.5699185329131355
Energy: 1.5272885948685704
Energy: 1.2978952664397645
Energy: 1.5272885948676245
Energy: 1.4588838469386278
Energy: 1.5273455370512918
Energy: 1.2977369719498975
Energy: 1.5273455370512918
Energy: 1.4588838469386278
Energy: 1.527345537050346
Energy: 1.3743428799855992
Energy: 1.4491504674089053
Energy: 1.3042742847186006
Energy: 1.4491504674107971
Energy: 1.3743428799865451
Energy: 1.4491504674098512
Energy: 1.374263402151356
Energy: 1.4619023013682102
Energy: 1.2120621673775833
Energy: 1.4619023013682102
Energy: 1.374263402151356
Energy: 1.4619023013682102
Energy: 1.4215308853899047
Energy: 1.482839156870296
Energy: 1.2802411763155377
Energy: 1.482839156870296
Energy: 1.4215308853889803
Energy: 1.482839156870296
Energy: 1.3137187273602702
Energy: 1.5133135897389298
Energy: 1.5463376871351349
Energy: 1.5133135897408216
Energy: 1.3137187273583786
Energy: 1.5133135897417676
Energy: 1.4216251765134007
Energy: 1.4827918934499937
Energy: 1.293058380517271
Energy: 1.4827918934499937
Energy: 1.421625176510563
Energy: 1.4827918934499937
Energy: 1.3741359812243645
Energy: 1.4618509735112935
Energy: 1.2120970790914383
Energy: 1.4618509735112935
Energy: 1.3741359812243645
Energy: 1.4618509735122396

minimum gb energy = 1.2120621673775833 eV
minimum distance =  2.19725329405127 Angstroms
sigma value = 27


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

Energy: 1.1716963472554693
Energy: 1.3584748825876873
Energy: 1.3977836539111654
Energy: 1.3584748825879243
Energy: 1.1716963472559434
Energy: 1.3584748825879243
Energy: 1.163174000558702
Energy: 1.4372408325606825
Energy: 1.2098552478040798
Energy: 1.4372408325609196
Energy: 1.163174000558702
Energy: 1.4372408325611565
Energy: 1.1928346654087894
Energy: 1.4977915762751268
Energy: 1.2076840760888559
Energy: 1.4977915762744423
Energy: 1.1928346654092368
Energy: 1.4977915762748897
Energy: 1.169450832909912
Energy: 1.3583055266741597
Energy: 1.1913110122070696
Energy: 1.3583055266746074
Energy: 1.1694508329094648
Energy: 1.3583055266739228
Energy: 1.2093473367397014
Energy: 1.36533039625002
Energy: 1.193469491411214
Energy: 1.3653303962498096
Energy: 1.209347336739912
Energy: 1.3653303962498096
Energy: 1.191098098517004
Energy: 1.509255407037682
Energy: 1.2074228621020875
Energy: 1.5092554070388404
Energy: 1.191098098517952
Energy: 1.5092554070374449
Energy: 1.2074025778840858
Energy: 1.383151272562948
Energy: 1.1913026179939676
Energy: 1.383151272564554
Energy: 1.2074025778840858
Energy: 1.383151272562948
Energy: 1.1692333977917408
Energy: 1.365332172432685
Energy: 1.2112472721797596
Energy: 1.3653321724322374
Energy: 1.169233397792215
Energy: 1.365332172432448
Energy: 1.19127026749914
Energy: 1.4407442890385875
Energy: 1.207449162931468
Energy: 1.440744289039983
Energy: 1.19127026749914
Energy: 1.4407442890406938
Energy: 1.1911603444446102
Energy: 1.4553118692810236
Energy: 1.1911539053992588
Energy: 1.455311869281708
Energy: 1.1911603444450842
Energy: 1.455311869281708
Energy: 1.2042247420780519
Energy: 1.440222263480211
Energy: 1.1912165117081956
Energy: 1.4402222634813697
Energy: 1.204224742078526
Energy: 1.4402222634811328
Energy: 1.2111501015529107
Energy: 1.3652915427699464
Energy: 1.1691952738023
Energy: 1.365291542770394
Energy: 1.2111501015529107
Energy: 1.365291542770394

minimum gb energy = 1.163174000558702 eV
minimum distance =  2.23073374903331 Angstroms
sigma value = 9


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

Energy: 1.5964530546433604
Energy: 1.5554907860408178
Energy: 1.3091174123949085
Energy: 1.5554907860401668
Energy: 1.5964530546433604
Energy: 1.5554907860401668
Energy: 1.4154138048490919
Energy: 1.506972704107364
Energy: 1.314425510574592
Energy: 1.4900922817509363
Energy: 1.4154138048497429
Energy: 1.5262361930173367
Energy: 1.2845067118752571
Energy: 1.5088425154099823
Energy: 1.305082040223965
Energy: 1.5088425154093315
Energy: 1.2845067118759081
Energy: 1.5088425154093315
Energy: 1.239823511997096
Energy: 1.4746455477931055
Energy: 1.2146950512658985
Energy: 1.4746455477918035
Energy: 1.239823511995794
Energy: 1.4746455477931055
Energy: 1.2384448335397316
Energy: 1.4743778536442391
Energy: 1.2152886712965725
Energy: 1.4743778536455412
Energy: 1.2384448335384297
Energy: 1.4743778536455412
Energy: 1.2208510136937485
Energy: 1.4556888768532528
Energy: 1.2862414246491438
Energy: 1.4427084505000116
Energy: 1.2208510136930975
Energy: 1.4556888768539036
Energy: 1.476852767518065
Energy: 1.5078762335267288
Energy: 1.3086407935778908
Energy: 1.5078762335273799
Energy: 1.476852767517414
Energy: 1.5078762335273799
Energy: 1.420171953678716
Energy: 1.4732830770668148
Energy: 1.3952427126320375
Energy: 1.4732830770642107
Energy: 1.420171953680018
Energy: 1.4732830770642107
Energy: 1.411760963568892
Energy: 1.5007235914997472
Energy: 1.3189334402256239
Energy: 1.5007235915003982
Energy: 1.4117609635682409
Energy: 1.5007235915003982
Energy: 1.422739519900441
Energy: 1.5243308632671442
Energy: 1.2378911153743983
Energy: 1.5243308632671442
Energy: 1.4227395198997896
Energy: 1.5243308632664931
Energy: 1.4059298796348523
Energy: 1.4967421834671886
Energy: 1.3189270211963005
Energy: 1.4967421834678396
Energy: 1.405929879632248
Energy: 1.4967421834684904
Energy: 1.2918217874897502
Energy: 1.472702909164181
Energy: 1.2908536054633317
Energy: 1.4727029091674066
Energy: 1.2918217874897502
Energy: 1.472702909164181
Energy: 1.225062081299408
Energy: 1.4245944575430654
Energy: 1.2212676989925784
Energy: 1.4245944575450182
Energy: 1.225062081301361
Energy: 1.4245944575437162
Energy: 1.478193734657578
Energy: 1.5448242125741705
Energy: 1.221752385420397
Energy: 1.5448242125722174
Energy: 1.47819373465888
Energy: 1.5448242125715663
Energy: 1.2946286428966065
Energy: 1.4954274230235984
Energy: 1.3437423403086413
Energy: 1.4954274230242492
Energy: 1.2946286428979086
Energy: 1.4954274230242492
Energy: 1.3616535253869726
Energy: 1.4772116539582345
Energy: 1.2905063608243976
Energy: 1.4772116539562814
Energy: 1.3616535253856705
Energy: 1.4772116539582345
Energy: 1.4250434913826477
Energy: 1.5175112964505206
Energy: 1.3133022341487774
Energy: 1.5175112964498694
Energy: 1.4250434913826477
Energy: 1.5175112964505206
Energy: 1.2892945758897412
Energy: 1.4284681656961422
Energy: 1.3079580810038225
Energy: 1.4284681656967932
Energy: 1.289294575885835
Energy: 1.428468165693538
Energy: 1.422476474919698
Energy: 1.5397501413930872
Energy: 1.225459243865673
Energy: 1.5397501413930872
Energy: 1.422476474919047
Energy: 1.5397501413937382
Energy: 1.220046581587258
Energy: 1.5779356005339253
Energy: 1.2201296482701314
Energy: 1.5779356005384826
Energy: 1.220046581587909
Energy: 1.5655178318741683
Energy: 1.2253282615837016
Energy: 1.5398170135196196
Energy: 1.4223749007698534
Energy: 1.5398170135170157
Energy: 1.2253282615850039
Energy: 1.5398170135170157
Energy: 1.3080128905684354
Energy: 1.4304880949802288
Energy: 1.289656607830035
Energy: 1.4304880949795777
Energy: 1.3080128905677844
Energy: 1.4304880949802288
Energy: 1.3133578524410925
Energy: 1.5173807539872228
Energy: 1.4248509622293224
Energy: 1.5173807539865718
Energy: 1.3133578524404412
Energy: 1.5173807539865718
Energy: 1.2916063154722832
Energy: 1.4774984049612616
Energy: 1.3621226262879278
Energy: 1.4774984049619124
Energy: 1.2916063154735855
Energy: 1.4774984049619124
Energy: 1.3502784013022977
Energy: 1.4956081828678167
Energy: 1.2942733030156324
Energy: 1.4956081828691188
Energy: 1.350278401302949
Energy: 1.4956081828684678
Energy: 1.2219130043224815
Energy: 1.545370636860213
Energy: 1.4781377422445365
Energy: 1.54537063685826
Energy: 1.2219130043153201
Energy: 1.54537063685826
Energy: 1.220727840559436
Energy: 1.4251226680359825
Energy: 1.2242846935648293
Energy: 1.4251226680333786
Energy: 1.220727840560087
Energy: 1.4251226680340296
Energy: 1.28513588534372
Energy: 1.4726740109379246
Energy: 1.291847703501054
Energy: 1.4726740109366228
Energy: 1.2851358853476262
Energy: 1.4726740109359715
Energy: 1.3189247957011794
Energy: 1.4968365138754047
Energy: 1.3365686812728872
Energy: 1.4968365138754047
Energy: 1.3189247957024814
Energy: 1.4968365138741027
Energy: 1.2384702161185315
Energy: 1.524892164187789
Energy: 1.4228383155030757
Energy: 1.524892164187138
Energy: 1.2384702161191825
Energy: 1.524892164187789
Energy: 1.3221477397530506
Energy: 1.5007235915003982
Energy: 1.4120174592355346
Energy: 1.5007235915010495
Energy: 1.3221477397523995
Energy: 1.5007235915003982
Energy: 1.3400570078489997
Energy: 1.4732513738905288
Energy: 1.4200691358031068
Energy: 1.473251373891831
Energy: 1.3400570078503016
Energy: 1.47325137389118
Energy: 1.3133731755128057
Energy: 1.5078895155069667
Energy: 1.6362086637727362
Energy: 1.5078895155082688
Energy: 1.313373175514759
Energy: 1.5078895155082688
Energy: 1.3147448737278722
Energy: 1.4256985775816482
Energy: 1.2209725104088516
Energy: 1.425698577578393
Energy: 1.3147448737278722
Energy: 1.425698577578393
Energy: 1.2526487059429718
Energy: 1.4741966733705292
Energy: 1.2386178708785638
Energy: 1.4741966733724825
Energy: 1.2526487059488016
Energy: 1.4741966733724825
Energy: 1.2155889049326973
Energy: 1.4763897437977265
Energy: 1.2398223195861602
Energy: 1.4763897437977265
Energy: 1.2155889049320463
Energy: 1.4763897437970754
Energy: 1.3053139790939194
Energy: 1.5087025787342756
Energy: 1.2839124958694585
Energy: 1.5087025787349266
Energy: 1.3053139790932684
Energy: 1.5087025787342756
Energy: 1.3156191106138369
Energy: 1.490092281758068
Energy: 1.4156712234945767
Energy: 1.490092281757417
Energy: 1.3156191106131856
Energy: 1.490092281757417
Energy: 1.4842794856084403
Energy: 1.5554907860408178
Energy: 1.5964530546472666
Energy: 1.5554907860414688
Energy: 1.4842794856090915
Energy: 1.5554907860414688
Energy: 1.3144255105765448
Energy: 1.5262361930160346
Energy: 1.415413804852347
Energy: 1.5262361930173367
Energy: 1.3144255105765448
Energy: 1.5262361930173367
Energy: 1.3050820402278709
Energy: 1.5088425154073781
Energy: 1.2845067118772102
Energy: 1.5088425154054252
Energy: 1.3050820402272199
Energy: 1.5088425154047742
Energy: 1.2146950512685026
Energy: 1.4746455477931055
Energy: 1.239823511997747
Energy: 1.4746455477898506
Energy: 1.2146950512678514
Energy: 1.4746455477898506
Energy: 1.2152886713004787
Energy: 1.474377853642937
Energy: 1.2384448335397316
Energy: 1.4743778536442391
Energy: 1.2152886712991764
Energy: 1.4743778536442391

minimum gb energy = 1.2146950512658985 eV
minimum distance =  2.18516123468869 Angstroms
sigma value = 57


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

Energy: 1.3747090591303706
Energy: 1.4231730437310206
Energy: 1.2514182622061507
Energy: 1.4231730437310206
Energy: 1.3747090591288886
Energy: 1.4231730437310206
Energy: 1.6875264611152991
Energy: 1.454756272970033
Energy: 1.1440587337331447
Energy: 1.4547562729715153
Energy: 1.6875264611152991
Energy: 1.454756272970033
Energy: 1.1149378263942868
Energy: 1.398855520158283
Energy: 1.2581059368005014
Energy: 1.398855520159765
Energy: 1.1149378263942868
Energy: 1.398855520158283
Energy: 1.1361249251466474
Energy: 1.3970599913011352
Energy: 1.2051788641712196
Energy: 1.3970599913011352
Energy: 1.1361249251466474
Energy: 1.3970599913011352
Energy: 1.1364558029004848
Energy: 1.4232507805212669
Energy: 1.2399697556821883
Energy: 1.423250780522749
Energy: 1.1364558029004848
Energy: 1.4232507805212669
Energy: 1.708998905896054
Energy: 1.3955083827999106
Energy: 1.1147893291822333
Energy: 1.3955083827984287
Energy: 1.7089989058945718
Energy: 1.3955083828013926
Energy: 1.7092708253528626
Energy: 1.3983529310987688
Energy: 1.1145358040456552
Energy: 1.398352931100251
Energy: 1.7092708253513806
Energy: 1.3983529310987688
Energy: 1.1364638840676309
Energy: 1.423428179892791
Energy: 1.1376474875012752
Energy: 1.423428179892791
Energy: 1.1364638840676309
Energy: 1.4234281798883448
Energy: 1.1361809207768798
Energy: 1.39514254265374
Energy: 1.1435358945413974
Energy: 1.39514254265374
Energy: 1.1361809207768798
Energy: 1.3951425426552222
Energy: 1.114927071583286
Energy: 1.3961900740895237
Energy: 1.2586926194014207
Energy: 1.3961900740895237
Energy: 1.114927071583286
Energy: 1.3961900740895237
Energy: 1.6875004749822813
Energy: 1.454756272970033
Energy: 1.2051002950738658
Energy: 1.454756272970033
Energy: 1.6875004749837632
Energy: 1.454756272972997
Energy: 1.3747090591303706
Energy: 1.4231730437310206
Energy: 1.1988904471387893
Energy: 1.4231730437325028
Energy: 1.3747090591303706
Energy: 1.4231730437310206
Energy: 1.6875264611152991
Energy: 1.454756272972997
Energy: 1.1440587337331447
Energy: 1.454756272970033
Energy: 1.6875264611152991
Energy: 1.454756272970033
Energy: 1.1149378263928047
Energy: 1.398855520159765
Energy: 1.2581059368005014
Energy: 1.398855520159765
Energy: 1.1149378263942868
Energy: 1.398855520158283
Energy: 1.1361249251466474
Energy: 1.3970599913011352
Energy: 1.1375779818719924
Energy: 1.3970599912996533
Energy: 1.1361249251466474
Energy: 1.3970599913011352
Energy: 1.1364558029004848
Energy: 1.423250780522749
Energy: 1.2399697556821883
Energy: 1.4232507805212669
Energy: 1.1364558029004848
Energy: 1.4232507805212669
Energy: 1.708998905896054
Energy: 1.3955083827984287
Energy: 1.1147893291822333
Energy: 1.3955083827984287
Energy: 1.708998905896054
Energy: 1.3955083827969468
Energy: 1.7092708253528626
Energy: 1.398352931100251
Energy: 1.1145358040456552
Energy: 1.3983529310987688
Energy: 1.7092708253513806
Energy: 1.398352931100251
Energy: 1.1364638840676309
Energy: 1.4234281799031647
Energy: 1.1376474875012752
Energy: 1.4234281798957549
Energy: 1.1364638840676309
Energy: 1.423428179892791

minimum gb energy = 1.1145358040456552 eV
minimum distance =  2.1843759627838 Angstroms
sigma value = 11


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

Energy: 1.243338836871212
Energy: 1.364421050034663
Energy: 1.231637364053902
Energy: 1.364421050032492
Energy: 1.243338836871212
Energy: 1.3644210500335774
Energy: 1.7197715812207348
Energy: 1.310997371374161
Energy: 1.0536178130628802
Energy: 1.3109973713730754
Energy: 1.7197715812207348
Energy: 1.3109973713719898
Energy: 1.2277152762563563
Energy: 1.295081563277953
Energy: 1.1992863557696478
Energy: 1.295081563277953
Energy: 1.2277152762552708
Energy: 1.2950815632768675
Energy: 1.2522975263479523
Energy: 1.2851956414631958
Energy: 1.0540835742147578
Energy: 1.2851956414642811
Energy: 1.2522975263468668
Energy: 1.2851956414631958
Energy: 1.0527486616238757
Energy: 1.364685420647159
Energy: 1.0747867355108685
Energy: 1.364685420644988
Energy: 1.0527486616238757
Energy: 1.364685420644988
Energy: 1.0663890784359102
Energy: 1.3497324908507966
Energy: 1.0531979658366317
Energy: 1.349732490849711
Energy: 1.0663890784369958
Energy: 1.3497324908507966
Energy: 1.0653753812503661
Energy: 1.38268866580764
Energy: 1.0633862186531777
Energy: 1.3826886658065547
Energy: 1.0653753812503661
Energy: 1.38268866580764
Energy: 1.4671999849870832
Energy: 1.3605748861730216
Energy: 1.0755141753845858
Energy: 1.3605748861730216
Energy: 1.4671999849870832
Energy: 1.3605748861730216
Energy: 1.4656992134251214
Energy: 1.3578044116066095
Energy: 1.4963015712119996
Energy: 1.3578044116076948
Energy: 1.465699213426207
Energy: 1.3578044116055237
Energy: 1.0663614628683338
Energy: 1.2965947749763584
Energy: 1.053019024726146
Energy: 1.2965947749785296
Energy: 1.0663614628694194
Energy: 1.2965947749839573
Energy: 1.0656580485216098
Energy: 1.3461055736887353
Energy: 1.0648668534049572
Energy: 1.3461055736887353
Energy: 1.0656580485216098
Energy: 1.3461055736887353
Energy: 1.0536920717595941
Energy: 1.360309680245569
Energy: 1.0543889961174975
Energy: 1.360309680245569
Energy: 1.0536920717595941
Energy: 1.360309680245569
Energy: 1.4689676410382944
Energy: 1.1933664185476174
Energy: 1.0753883179310126
Energy: 1.1933664185487027
Energy: 1.4689676410339523
Energy: 1.1933664185497883
Energy: 1.0559629063254314
Energy: 1.298619916058954
Energy: 1.077901935200128
Energy: 1.2986199160578684
Energy: 1.0559629062852656
Energy: 1.2986199160600396
Energy: 1.716411859874792
Energy: 1.31200803103662
Energy: 1.0641995400698316
Energy: 1.312008031032278
Energy: 1.716411859874792
Energy: 1.3120080310398767
Energy: 1.236541704702388
Energy: 1.3599977713727207
Energy: 1.272658148595961
Energy: 1.359997771371635
Energy: 1.236541704702388
Energy: 1.3599977713727207
Energy: 1.7289402734254802
Energy: 1.3099938121145054
Energy: 1.0755098491304522
Energy: 1.3099938121188477
Energy: 1.728940273428737
Energy: 1.309993812115591
Energy: 1.0584124856253567
Energy: 1.298513674632461
Energy: 1.083980873266975
Energy: 1.2985136746292043
Energy: 1.058412485578727
Energy: 1.298513674632461
Energy: 1.251999678483809
Energy: 1.284965552639932
Energy: 1.0524533662764133
Energy: 1.2849655526377608
Energy: 1.251999678483809
Energy: 1.2849655526377608
Energy: 1.0533133464571656
Energy: 1.3647086975002798
Energy: 1.0711303632633724
Energy: 1.3647086975002798
Energy: 1.0533133464560802
Energy: 1.3647086975002798
Energy: 1.511534682683274
Energy: 1.3468568946319124
Energy: 1.057584185596583
Energy: 1.3468568946319124
Energy: 1.511534682683274
Energy: 1.3468568946319124
Energy: 1.0664649624158355
Energy: 1.3767696837849337
Energy: 1.061150483065293
Energy: 1.3767696837838483
Energy: 1.0664649624169211
Energy: 1.3767696837838483
Energy: 1.4706128084489496
Energy: 1.3576300022232035
Energy: 1.076236122900319
Energy: 1.3576300022210324
Energy: 1.4706128084489496
Energy: 1.3576300022210324
Energy: 1.0541626002905256
Energy: 1.3654130640710882
Energy: 1.4772451715617823
Energy: 1.3654130640700026
Energy: 1.0541626002905256
Energy: 1.365413064068917
Energy: 1.0679135519586354
Energy: 1.2931193171653383
Energy: 1.0550898081509072
Energy: 1.2931193171653383
Energy: 1.0679135519586354
Energy: 1.2931193171642528
Energy: 1.0665706476706178
Energy: 1.3452080026490616
Energy: 1.0607791903585937
Energy: 1.3452080026512327
Energy: 1.0665706476706178
Energy: 1.3452080026512327

minimum gb energy = 1.0524533662764133 eV
minimum distance =  2.23884281147358 Angstroms
sigma value = 41


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

Energy: 1.536957162295278
Energy: 1.295837217371977
Energy: 1.0410893761381756
Energy: 1.29583721736941
Energy: 1.536957162297845
Energy: 1.2958372173711212
Energy: 1.9397947610074169
Energy: 1.193160496941565
Energy: 0.9831810585174945
Energy: 1.1931604969389982
Energy: 1.9397947610074169
Energy: 1.1931604969407097
Energy: 1.1245383677873806
Energy: 1.2516009400286479
Energy: 1.0148946153351976
Energy: 1.2516009400286479
Energy: 1.124538367786525
Energy: 1.2516009400286479
Energy: 1.494750721628581
Energy: 1.1676362690307531
Energy: 0.983061670137915
Energy: 1.1676362690324646
Energy: 1.4947507216294367
Energy: 1.1676362690349924
Energy: 1.1040853088595484
Energy: 1.1796862549078724
Energy: 0.9953370518298871
Energy: 1.1796862549070168
Energy: 1.1040853088569815
Energy: 1.1796862549053055
Energy: 1.292048325093629
Energy: 1.2308102247671644
Energy: 0.9831473506309277
Energy: 1.2308102247680202
Energy: 1.2920483250927735
Energy: 1.2308102247680202
Energy: 0.9833282019323857
Energy: 1.2394369219246726
Energy: 0.9850718774703277
Energy: 1.2394369219238168
Energy: 0.9833282019323857
Energy: 1.2394369219246726
Energy: 1.3391774450809955
Energy: 1.239456189592426
Energy: 1.0034299529056963
Energy: 1.2394561895941372
Energy: 1.3391774450809955
Energy: 1.2394561895932816
Energy: 0.9986463603076341
Energy: 1.180567686895134
Energy: 1.2938043251826774
Energy: 1.1805676868968453
Energy: 0.9986463603076341
Energy: 1.180567686895134
Energy: 1.303927921292235
Energy: 1.239446712351734
Energy: 1.3048638880542185
Energy: 1.239446712351734
Energy: 1.303927921291379
Energy: 1.239446712351734
Energy: 1.2973512094290924
Energy: 1.2969845113957188
Energy: 1.2974013073361974
Energy: 1.2969845113965746
Energy: 1.2973512094299482
Energy: 1.2969845113965746
Energy: 0.9946257066606269
Energy: 1.2394630164235851
Energy: 1.0044095307462695
Energy: 1.2585093491873447
Energy: 0.9946257066606269
Energy: 1.239463016424441
Energy: 0.9985495782240239
Energy: 1.2310354031127237
Energy: 1.2786259387757057
Energy: 1.2310354031110122
Energy: 0.9985495782240239
Energy: 1.2310354031110122
Energy: 0.9823148887805546
Energy: 1.2394751545264153
Energy: 0.9827280252766961
Energy: 1.2394751545281262
Energy: 0.982314888779699
Energy: 1.2394751545281262
Energy: 1.3004828955075312
Energy: 1.2313195133395038
Energy: 0.9843132941593836
Energy: 1.2313195133377925
Energy: 1.3004828955075312
Energy: 1.2313195133386483
Energy: 0.9859192811725168
Energy: 1.240299467914865
Energy: 0.9828598660948713
Energy: 1.240299467914865
Energy: 0.9859192811759392
Energy: 1.240299467914865
Energy: 1.2789215295748944
Energy: 1.257358004522602
Energy: 0.9964125985451514
Energy: 1.257358004520891
Energy: 1.2789215295663385
Energy: 1.2573580045217463
Energy: 1.004681176737334
Energy: 1.2394086248415925
Energy: 0.9942952790600812
Energy: 1.239408624842448
Energy: 1.0046811767364787
Energy: 1.2394086248415925
Energy: 1.7094643804909269
Energy: 1.1948455990768294
Energy: 0.9844239289021292
Energy: 1.1948455990759737
Energy: 1.7094643804909269
Energy: 1.1948455990836742
Energy: 1.2939077205500777
Energy: 1.2394184577094276
Energy: 1.2964348538260253
Energy: 1.2394184577077163
Energy: 1.2939077205500777
Energy: 1.2394184577077163
Energy: 1.6950663927946
Energy: 1.1936399851396247
Energy: 0.9960322907686885
Energy: 1.1936399851387691
Energy: 1.695066392798878
Energy: 1.1936399851379134
Energy: 1.00670965268946
Energy: 1.2398717928586374
Energy: 0.9957345845478589
Energy: 1.2398717928577818
Energy: 1.0067096526860377
Energy: 1.2398717928577818
Energy: 1.5130350491635753
Energy: 1.168193431675464
Energy: 0.9846333115352227
Energy: 1.1681934316737532
Energy: 1.5130350491635753
Energy: 1.1681934316746085
Energy: 0.9856578338468788
Energy: 1.2305829465129232
Energy: 1.1442041158108534
Energy: 1.2305829465137788
Energy: 0.9856578338468788
Energy: 1.2305829465137788
Energy: 1.143319534250076
Energy: 1.2303005956069046
Energy: 0.9830351252130084
Energy: 1.2303005956077602
Energy: 1.143319534250076
Energy: 1.2303005956077602
Energy: 0.9821785920984191
Energy: 1.167649080052199
Energy: 1.1304070424568409
Energy: 1.167649080052199
Energy: 0.9821785920984191
Energy: 1.1676490800530548
Energy: 1.3400820970811635
Energy: 1.239341458949759
Energy: 1.003507538215072
Energy: 1.239341458949759
Energy: 1.340082097082019
Energy: 1.239341458949759
Energy: 0.9948939029281606
Energy: 1.242697302102321
Energy: 1.4855676267010236
Energy: 1.242697302102321
Energy: 0.994893902927305
Energy: 1.242697302102321
Energy: 1.305237513414024
Energy: 1.2391441652155093
Energy: 1.2924826103431033
Energy: 1.2391441652146535
Energy: 1.305237513414024
Energy: 1.2391441652146535
Energy: 0.982466939513494
Energy: 1.2092742972848205
Energy: 1.2928306558071994
Energy: 1.2092742972848205
Energy: 0.9824669395143494
Energy: 1.2092742972848205
Energy: 0.9954383128883935
Energy: 1.2393286440446967
Energy: 1.0036804139848194
Energy: 1.2393286440429854
Energy: 0.9954383128883935
Energy: 1.2393286440429854
Energy: 0.9950204175534003
Energy: 1.2990754002220903
Energy: 1.282126877428531
Energy: 1.299075400220379
Energy: 0.9950204175534003
Energy: 1.299075400220379
Energy: 0.984699693858704
Energy: 1.2393601755341854
Energy: 0.9848408674212418
Energy: 1.23936017553333
Energy: 0.984699693858704
Energy: 1.23936017553333

minimum gb energy = 0.9821785920984191 eV
minimum distance =  2.23502205431074 Angstroms
sigma value = 33


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

Energy: 1.270589791375288
Energy: 1.1224290818303908
Energy: 0.9126517515534543
Energy: 1.1224290818309912
Energy: 1.2705897913644792
Energy: 1.1224290818309912
Energy: 1.84575221423738
Energy: 1.0305459074680283
Energy: 0.8861871746222515
Energy: 1.0305459074740335
Energy: 1.84575221423738
Energy: 1.03054590746983
Energy: 1.263259934664726
Energy: 1.1204575949891706
Energy: 1.0356659507885793
Energy: 1.120457594990972
Energy: 1.2632599346671278
Energy: 1.120457594990972
Energy: 1.7047095239123136
Energy: 1.0146583124871333
Energy: 0.8862198500995438
Energy: 1.0146583124871333
Energy: 1.7047095239123136
Energy: 1.0146583124871333
Energy: 0.9423817905848667
Energy: 1.0948477996621009
Energy: 0.8874349294388058
Energy: 1.0948477996645027
Energy: 0.9423817905806634
Energy: 1.0948477996651034
Energy: 1.3669253001908
Energy: 1.0657408510251614
Energy: 0.8861369030191717
Energy: 1.0657408510251614
Energy: 1.3669253001920008
Energy: 1.0657408510251614
Energy: 0.923227137755678
Energy: 1.079707592880592
Energy: 0.8834939024459227
Energy: 1.0797075928787905
Energy: 0.9232271377514747
Energy: 1.0797075928793909
Energy: 1.2263624572222749
Energy: 1.069254294120149
Energy: 0.8944494883061855
Energy: 1.0692542941219505
Energy: 1.226362457201258
Energy: 1.0692542941219505
Energy: 0.9017538589408635
Energy: 1.0943468711990667
Energy: 1.1094896396692133
Energy: 1.0943468711978657
Energy: 0.9017538589414639
Energy: 1.0943468711984663
Energy: 1.085500287340542
Energy: 1.0980192314755692
Energy: 1.1270036654772542
Energy: 1.09801923147677
Energy: 1.0855002873387405
Energy: 1.09801923147677
Energy: 0.8958752131704798
Energy: 1.0798654181131768
Energy: 1.116178815950035
Energy: 1.0798654181119758
Energy: 0.8958752131716808
Energy: 1.0798654181119758
Energy: 1.3867257183999204
Energy: 1.1138952280436425
Energy: 1.112680400363849
Energy: 1.1138952280448435
Energy: 1.386725718405925
Energy: 1.113895228045444
Energy: 1.0900665966576157
Energy: 1.0944287645246633
Energy: 1.3180476943326838
Energy: 1.0944287645258644
Energy: 1.0900665966630199
Energy: 1.094428764525264
Energy: 1.098972645548991
Energy: 1.1150333955986949
Energy: 1.3931985445264365
Energy: 1.1150333955956926
Energy: 1.0989726455447877
Energy: 1.1150333955956926
Energy: 1.0983122156339606
Energy: 1.0711923498720053
Energy: 1.3944454509272324
Energy: 1.0711923498726055
Energy: 1.0983122156345613
Energy: 1.0711923498731517
Energy: 1.0940289765986795
Energy: 1.1145557355717888
Energy: 1.1149210971244445
Energy: 1.1145557355711881
Energy: 1.0940289765980793
Energy: 1.1145557355711881
Energy: 1.087193881394605
Energy: 1.095248743392295
Energy: 1.313960212426799
Energy: 1.095248743392295
Energy: 1.0871938813940043
Energy: 1.0952487433910942
Energy: 0.8830921166470568
Energy: 1.1141139932324773
Energy: 1.1026418751002338
Energy: 1.1141139932342787
Energy: 0.8830921166470568
Energy: 1.1141139932336785
Energy: 1.0975513512286912
Energy: 1.0927081668372423
Energy: 1.0994703061917452
Energy: 1.0927081668360417
Energy: 1.0975513512328945
Energy: 1.0927081668360417
Energy: 0.891918816680092
Energy: 1.114801635243232
Energy: 0.8951782899418811
Energy: 1.1148016352438321
Energy: 0.891918816680092
Energy: 1.1148016352438321
Energy: 1.090483844890433
Energy: 1.092568452911296
Energy: 1.0832220131152308
Energy: 1.0925684529124966
Energy: 1.0904838448898324
Energy: 1.0925684529106952
Energy: 0.8968301279738524
Energy: 1.1142888524112826
Energy: 0.8864247702580806
Energy: 1.1142888524100816
Energy: 0.8968301279744529
Energy: 1.1142888524100816
Energy: 1.3747629845836666
Energy: 1.1036873756289967
Energy: 0.8831628327528569
Energy: 1.103687375629597
Energy: 1.3747629845836666
Energy: 1.1036873756271952
Energy: 0.9238548021538844
Energy: 1.1141559262099008
Energy: 0.8861696084654607
Energy: 1.1141559262093004
Energy: 0.9238548021550855
Energy: 1.1141559262093004
Energy: 1.3698895298524083
Energy: 1.0945187493412534
Energy: 1.0916897998135673
Energy: 1.094518749339452
Energy: 1.369889529856011
Energy: 1.0945187493430548
Energy: 1.1247790876311785
Energy: 1.1142299704406466
Energy: 0.8903892949058956
Energy: 1.1142299704400462
Energy: 1.1247790876257744
Energy: 1.1142299704400462
Energy: 1.8463096645441073
Energy: 1.0444745962183688
Energy: 0.8831491797560631
Energy: 1.0444745962189692
Energy: 1.8463096645447077
Energy: 1.0444745962189692
Energy: 1.141280028201793
Energy: 1.1141700925322924
Energy: 1.1071406495951606
Energy: 1.114170092532893
Energy: 1.1412800280391184
Energy: 1.114170092532893
Energy: 1.5241282150963795
Energy: 1.0853398532974508
Energy: 1.0911836744487293
Energy: 1.0853398532939025
Energy: 1.524128215095779
Energy: 1.085339853295704
Energy: 1.114731047396392
Energy: 1.1137266507838939
Energy: 1.1062066778111106
Energy: 1.1137266507826926
Energy: 1.1147310473993945
Energy: 1.1137266507826926
Energy: 1.5306333567627644
Energy: 1.0152468268947512
Energy: 0.8830253969183947
Energy: 1.0152468268839427
Energy: 1.5306333567639654
Energy: 1.0152468268833421
Energy: 0.9265540245471044
Energy: 1.097956081823479
Energy: 1.115033543465328
Energy: 1.0979560818264815
Energy: 0.9265540245471044
Energy: 1.0979560818264815
Energy: 1.2268762253890633
Energy: 1.0662875441537318
Energy: 0.8914813071758987
Energy: 1.0662875441555333
Energy: 1.2268762253896637
Energy: 1.0662875441561335
Energy: 0.9029333542545401
Energy: 1.068868046868361
Energy: 1.4065763884852258
Energy: 1.0688680468647582
Energy: 0.9029333542539396
Energy: 1.0688680468653586
Energy: 1.4066822823704725
Energy: 1.069006966429093
Energy: 0.9030264453288457
Energy: 1.0690069664320954
Energy: 1.406682282371073
Energy: 1.069006966431495
Energy: 0.8914549381686183
Energy: 1.0657606989814854
Energy: 1.2265797320631173
Energy: 1.0657606989790835
Energy: 0.8914549381704199
Energy: 1.065760698978483
Energy: 1.1153540293074924
Energy: 1.0979388443300078
Energy: 0.9236991770515558
Energy: 1.0979388443294074
Energy: 1.1153540293086932
Energy: 1.0979388443294074
Energy: 0.8830544277040122
Energy: 1.014446043788637
Energy: 1.529653735946092
Energy: 1.0144460437904383
Energy: 0.8830544277034117
Energy: 1.0144460437922398
Energy: 1.10620667781051
Energy: 1.1137098913452568
Energy: 1.1256409701386103
Energy: 1.113709891342855
Energy: 1.1062066778099096
Energy: 1.113709891342855
Energy: 0.9954261633934146
Energy: 1.0850211278589321
Energy: 1.5238140906344342
Energy: 1.0850211278571307
Energy: 0.9954261633922135
Energy: 1.0850211278571307
Energy: 1.100306177032261
Energy: 1.114205715314787
Energy: 1.1436079109513664
Energy: 1.114205715315988
Energy: 1.1003061769469937
Energy: 1.1142057153165885
Energy: 0.8830812715886258
Energy: 1.0452466057988654
Energy: 1.8467096202874325
Energy: 1.0452466057982648
Energy: 0.8830812715892262
Energy: 1.0452466057976646
Energy: 0.890014552261758
Energy: 1.1141689372046415
Energy: 1.122286393141054
Energy: 1.1141689372040413
Energy: 0.8900145522623585
Energy: 1.1141689372046415
Energy: 0.9985937026443612
Energy: 1.0944787734422783
Energy: 1.3686466595212015
Energy: 1.0944787734416779
Energy: 0.9985937026413589
Energy: 1.0944787734416779
Energy: 0.8861189578583134
Energy: 1.1141001855136339
Energy: 0.9266575151581455
Energy: 1.1141001855118324
Energy: 0.8861189578589138
Energy: 1.114100185510031
Energy: 0.8830915975126715
Energy: 1.1036873756283962
Energy: 1.3736419644792242
Energy: 1.1036873756277956
Energy: 0.8830915975138726
Energy: 1.1036873756271952
Energy: 0.8863097977459552
Energy: 1.1143087655137474
Energy: 0.9032276773159993
Energy: 1.1143087655149482
Energy: 0.8863097977459552
Energy: 1.1143087655149482

minimum gb energy = 0.8830253969183947 eV
minimum distance =  2.23346214537243 Angstroms
sigma value = 67


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

Energy: 0.3398250657656527
Energy: 0.29428150214099585
Energy: 1.6955389297198562
Energy: 0.29428150214179394
Energy: 0.3398250657656527
Energy: 0.29428150214179394
Energy: 0.2781358653340223
Energy: 0.7048493277146429
Energy: 0.7148208923808996
Energy: 0.7048493277154411
Energy: 0.2781358653340223
Energy: 0.7048493277154411
Energy: 0.33982506576485455
Energy: 0.2942815021401977
Energy: 1.5709955885896736
Energy: 0.2942815021422044
Energy: 0.33982506576485455
Energy: 0.2942815021422044
Energy: 0.27813586533482043
Energy: 0.7048493277146429
Energy: 0.714820986174754
Energy: 0.7048493277158515
Energy: 0.27813586533441
Energy: 0.7048493277158515
Energy: 0.3398250657656527
Energy: 0.2942815021401977
Energy: 1.570995589446508
Energy: 0.294281502142592
Energy: 0.3398250657656527
Energy: 0.2942815021430024
Energy: 0.2781358653336119
Energy: 0.7048493277150306
Energy: 0.7148209314032704
Energy: 0.7048493277154411
Energy: 0.27813586533441
Energy: 0.7048493277154411
Energy: 0.33982506576485455
Energy: 0.2942815021393997
Energy: 1.7409025994180114
Energy: 0.2942815021422044
Energy: 0.33982506576485455
Energy: 0.29428150214179394

minimum gb energy = 0.2781358653336119 eV
minimum distance =  2.4005827713645 Angstroms
sigma value = 3


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

Energy: 1.421966319919246
Energy: 1.111574656806443
Energy: 0.9541684748131235
Energy: 1.1115746568075353
Energy: 1.4219663199170616
Energy: 1.1115746568080813
Energy: 1.8136158926967818
Energy: 0.8824240508350273
Energy: 0.8701537771558427
Energy: 0.8824240508355734
Energy: 1.8136158926962356
Energy: 0.8824240508350273
Energy: 1.286304059960915
Energy: 1.0918426231397043
Energy: 1.051569756522045
Energy: 1.091842623138612
Energy: 1.2863040599625535
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Energy: 0.8656730763121586
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Energy: 0.8685216418979854
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Energy: 1.358797792470204
Energy: 1.0761697689289744
Energy: 0.8506758058014044
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Energy: 0.8702491212372483
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Energy: 1.36839340172336
Energy: 1.0773286237480235
Energy: 0.9838663908253447
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Energy: 1.390321662714215
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Energy: 0.8577234687402546
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Energy: 0.8589474985474553
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Energy: 0.8480901886393827
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Energy: 1.3588020207147384
Energy: 1.0831939822490018
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Energy: 1.0607030360919516
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Energy: 0.8770900973636423
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Energy: 1.0807843712702365
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Energy: 0.8742148282780717
Energy: 1.0627761162879097
Energy: 1.0961164671538537
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Energy: 0.8742148282797101
Energy: 1.062776116289548
Energy: 1.0742122464431207
Energy: 1.0826695439571106
Energy: 1.0885447807614974
Energy: 1.082669543957657
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Energy: 1.082669543957657
Energy: 0.8657323032607988
Energy: 1.0294365405935584
Energy: 1.3762715172965112
Energy: 1.0294365405919201
Energy: 0.8657323032607988
Energy: 1.0294365405935584
Energy: 0.8694659836220338
Energy: 1.0667635051613102
Energy: 1.103867004287051
Energy: 1.066763505160218
Energy: 0.869465983618757
Energy: 1.0667635051634947
Energy: 0.8759539831025649
Energy: 1.0417934965584654
Energy: 1.3734710172878908
Energy: 1.041793496560054
Energy: 0.8759539831036572
Energy: 1.0417934965595081
Energy: 0.8720114282274817
Energy: 1.0791788196809333
Energy: 1.379727414051745
Energy: 1.0791788196782024
Energy: 0.8720114282280278
Energy: 1.0791788196803873
Energy: 0.8731836518409561
Energy: 0.8814021486753443
Energy: 1.540736853483431
Energy: 0.8814021486747983
Energy: 0.8731836518415022
Energy: 0.8814021486747983
Energy: 0.863196365647731
Energy: 1.097737175550244
Energy: 1.4051763042488792
Energy: 1.0977371755524288
Energy: 0.8631963656471849
Energy: 1.0977371755524288
Energy: 0.8601084290399131
Energy: 0.8818423635129503
Energy: 1.5263352890738027
Energy: 0.8818423635151348
Energy: 0.8601084290382748
Energy: 0.8818423635145887
Energy: 0.8605562661097805
Energy: 1.0852798389331137
Energy: 1.3825387787394166
Energy: 1.0852798389336595
Energy: 0.8605562661092345
Energy: 1.0852798389331137
Energy: 0.8727051619026698
Energy: 0.8676135339081693
Energy: 1.5276468770953124
Energy: 0.8676135339076231
Energy: 0.8727051619021237
Energy: 0.867613533906531
Energy: 0.8535765799569114
Energy: 1.0688619035299058
Energy: 1.10487605444757
Energy: 1.0688619035282676
Energy: 0.8535765799574575
Energy: 1.0688619035282676
Energy: 0.8694053950777224
Energy: 1.0292017291118911
Energy: 1.2541024208999403
Energy: 1.0292017291124373
Energy: 0.8694053950771762
Energy: 1.0292017291107989
Energy: 1.1064707720441354
Energy: 1.0582404328885848
Energy: 1.0880857002327702
Energy: 1.0582404328874926
Energy: 1.1064707720446816
Energy: 1.0582404328874926

minimum gb energy = 0.8480901886393827 eV
minimum distance =  2.26271115814088 Angstroms
sigma value = 81


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

Energy: 1.3954563411300762
Energy: 1.2483908077161132
Energy: 1.0799990913155595
Energy: 1.2483908077183616
Energy: 1.3954563411293266
Energy: 1.2483908077183616
Energy: 1.6727903714398962
Energy: 0.9859519717767992
Energy: 0.9722375485813204
Energy: 0.985951971773801
Energy: 1.6727903714398962
Energy: 0.9859519717767992
Energy: 1.3069678617938008
Energy: 1.2450036851122095
Energy: 0.9841071879247171
Energy: 1.2450036851137087
Energy: 1.3069678617923017
Energy: 1.2450036851129591
Energy: 1.2590772556383445
Energy: 0.9696389728139723
Energy: 0.9718865179370579
Energy: 0.9696389728132228
Energy: 1.2590772556300995
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Energy: 1.0009572360658652
Energy: 1.2010499901329108
Energy: 0.9769768646151079
Energy: 1.2010499901336602
Energy: 1.0009572360666146
Energy: 1.2010499901336602
Energy: 1.1069984760345508
Energy: 1.184449960115454
Energy: 0.9648286428618031
Energy: 1.1844499601162035
Energy: 1.1069984760367995
Energy: 1.1844499601169527
Energy: 0.9769218853588746
Energy: 1.2063911391626336
Energy: 1.1203962965754635
Energy: 1.2063911391611344
Energy: 0.9769218853588746
Energy: 1.2063911391641327
Energy: 0.9540692710438022
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Energy: 0.9605414214205992
Energy: 1.227821974404984
Energy: 0.9659726630189825
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Energy: 1.4604842159301035
Energy: 1.2173039828386847
Energy: 0.9659726630189825
Energy: 1.217303982839434
Energy: 0.972692929703798
Energy: 1.207780044049342
Energy: 1.2825621110804575
Energy: 1.2077800440485924
Energy: 0.9726929297030484
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Energy: 0.9724019567091585
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Energy: 1.2575993034425135
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Energy: 0.972401956709908
Energy: 1.2414436630621946
Energy: 0.966610388605591
Energy: 1.228125120267725
Energy: 0.988614318647624
Energy: 1.228125120267725
Energy: 0.9666103886048415
Energy: 1.228125120267725
Energy: 0.9659520677586005
Energy: 1.1847699051843343
Energy: 1.1219684868926754
Energy: 1.1847699051843343
Energy: 0.9659520677578511
Energy: 1.1847699051843343
Energy: 1.2572616105334584
Energy: 1.2073395006246674
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Energy: 1.257261610534208
Energy: 1.2073395006261665
Energy: 1.2574887904146503
Energy: 1.2271605591393517
Energy: 0.951231415184706
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Energy: 1.2574887904161496
Energy: 1.2271605591393517
Energy: 1.2752475178565668
Energy: 1.228001435252634
Energy: 0.9720018697239037
Energy: 1.2280014352518847
Energy: 1.2752475178565668
Energy: 1.228001435252634
Energy: 1.2749545639424693
Energy: 1.20735031279308
Energy: 1.1999170250465416
Energy: 1.2073503127945788
Energy: 1.2749545639439686
Energy: 1.2073503127945788
Energy: 1.6580424648247043
Energy: 1.2174853433702613
Energy: 0.960708277573265
Energy: 1.2174853433710107
Energy: 1.6580424648247043
Energy: 1.2174853433710107
Energy: 1.6581303933526876
Energy: 1.2176718176303734
Energy: 0.9606139537869731
Energy: 1.217671817631123
Energy: 1.6581303933526876
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Energy: 1.2749755860811567
Energy: 1.2073245841751954
Energy: 1.290572758580603
Energy: 1.2073245841751954
Energy: 1.2749755860804073
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Energy: 1.2755571983591893
Energy: 1.2280037348248705
Energy: 0.9720144967274855
Energy: 1.2280037348248705
Energy: 1.2755571983591893
Energy: 1.2280037348256199
Energy: 1.257415080493247
Energy: 1.2278979117885207
Energy: 0.9511312550659393
Energy: 1.2278979117877713
Energy: 1.2574150804924975
Energy: 1.2278979117870217
Energy: 1.257187534162367
Energy: 1.2071811577552056
Energy: 0.9647753342044868
Energy: 1.2071811577582041
Energy: 1.2571875341608678
Energy: 1.2071811577559552
Energy: 0.9659511820637231
Energy: 1.1840778925310629
Energy: 1.2697673368794722
Energy: 1.1840778925333115
Energy: 0.9659511820644727
Energy: 1.184077892532562
Energy: 0.9666272943484603
Energy: 1.228005761072537
Energy: 0.9886510430716117
Energy: 1.2280057610732864
Energy: 0.9666272943484603
Energy: 1.228005761072537
Energy: 0.972434670056623
Energy: 1.241443663061445
Energy: 1.257491090501621
Energy: 1.241443663061445
Energy: 0.9724346700595871
Energy: 1.2414436630621946
Energy: 0.9727175652608057
Energy: 1.207775086319667
Energy: 1.2778387398880777
Energy: 1.2077750863181675
Energy: 0.972717565260056
Energy: 1.2077750863181675
Energy: 0.9659845618237675
Energy: 1.2176212792194265
Energy: 1.6625671312125898
Energy: 1.2176212792194265
Energy: 0.965984561823018
Energy: 1.217621279218677
Energy: 0.960336723361669
Energy: 1.227856318206717
Energy: 1.3727503083000643
Energy: 1.2278563182059674
Energy: 0.9603367233624184
Energy: 1.2278563182059674
Energy: 0.9727431090819946
Energy: 1.0911953741183529
Energy: 1.4962004063906744
Energy: 1.0911953741176035
Energy: 0.972743109081245
Energy: 1.0911953741183529
Energy: 0.972686436430803
Energy: 1.2070619738424062
Energy: 1.2768406336583094
Energy: 1.2070619738416566
Energy: 0.9726864364300535
Energy: 1.2070619738416566
Energy: 0.9661678802024841
Energy: 1.0883688124671498
Energy: 1.4859811916842418
Energy: 1.0883688103603433
Energy: 0.9661678802024841
Energy: 1.0883688124049373
Energy: 0.9540608977992178
Energy: 1.179518558816542
Energy: 0.9888064822743802
Energy: 1.1795185588172914
Energy: 0.9540608977999673
Energy: 1.1795185588157924
Energy: 0.97700784009842
Energy: 1.2076666898667348
Energy: 1.1203437514409147
Energy: 1.2076666898667348
Energy: 0.97700784009842
Energy: 1.2076666898682338

minimum gb energy = 0.9511312550659393 eV
minimum distance =  2.21796971384843 Angstroms
sigma value = 43


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

Energy: 1.5305155667171595
Energy: 1.3495234585904121
Energy: 1.1791971012660605
Energy: 1.3495234585913332
Energy: 1.53051556671808
Energy: 1.3495234585913332
Energy: 1.6755150139718302
Energy: 1.0777458448703665
Energy: 1.0402288700463411
Energy: 1.0777458448694666
Energy: 1.6755150139709094
Energy: 1.077745844868546
Energy: 1.093496412663721
Energy: 1.3193417941916132
Energy: 1.23317574338061
Energy: 1.3193417941906926
Energy: 1.093496412663721
Energy: 1.3193417941906926
Energy: 1.2156289306387258
Energy: 1.0392812223484336
Energy: 1.0407701284880644
Energy: 1.0392812223493542
Energy: 1.2156289306396464
Energy: 1.0392812223493542
Energy: 1.0481797842285752
Energy: 1.323917381314449
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Energy: 1.0237150821099579
Energy: 1.2970303623834634
Energy: 1.033247378905108
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Energy: 1.033015300012733
Energy: 1.1832395609323298
Energy: 1.2360285965773135
Energy: 1.1832395609323298
Energy: 1.033015300012733
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Energy: 1.058416049710365
Energy: 1.2900329037177016
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Energy: 1.290032903725067
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Energy: 1.1929116121809686
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Energy: 1.0428296649240985
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Energy: 1.4382310561309073
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Energy: 1.0334797773867141
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Energy: 1.0330035972991145
Energy: 1.3271770678465233
Energy: 1.4051637409097502
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Energy: 1.3271770678465233
Energy: 1.0406533127505966
Energy: 1.2904627464272522
Energy: 1.0742788356332251
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Energy: 1.0406533127505966
Energy: 1.290462746430014
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Energy: 1.2281849099522935
Energy: 1.0246358689384305
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Energy: 1.3136626641289413
Energy: 1.033352621229153
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Energy: 1.0316247958298745
Energy: 1.3136626641298619
Energy: 1.0331625819571706
Energy: 1.2969053759156974
Energy: 1.0236886202262512
Energy: 1.2969053759147768
Energy: 1.0331625819580912
Energy: 1.2969053759156974
Energy: 1.4045869813354748
Energy: 1.1758650916683961
Energy: 1.0409094305605369
Energy: 1.1758650916674753
Energy: 1.4045869813354748
Energy: 1.1758650916683961
Energy: 1.4055600496269876
Energy: 1.290113412942331
Energy: 1.2198186951155034
Energy: 1.290113412942331
Energy: 1.4055600496260667
Energy: 1.290113412942331
Energy: 1.4380592161354182
Energy: 1.321601489116854
Energy: 1.033412697790963
Energy: 1.3216014891177748
Energy: 1.4380592161354182
Energy: 1.3216014891177748
Energy: 1.4388945925447088
Energy: 1.3229009600814867
Energy: 1.0337790161817484
Energy: 1.3229009600814867
Energy: 1.4388945925456298
Energy: 1.3229009600814867
Energy: 1.4046229976124396
Energy: 1.3386810881976736
Energy: 1.032594402438226
Energy: 1.338681088199515
Energy: 1.40462299761336
Energy: 1.3386810881985942
Energy: 1.4055266724808826
Energy: 1.3561424766245738
Energy: 1.032547951479471
Energy: 1.3561424766245738
Energy: 1.405526672481803
Energy: 1.3561424766245738
Energy: 1.031642178433702
Energy: 1.2971739377658908
Energy: 1.0251455669828706
Energy: 1.2971739377668117
Energy: 1.0316421784327814
Energy: 1.2971739377668117
Energy: 1.0331517489341726
Energy: 1.3131482555250154
Energy: 1.0319235297921794
Energy: 1.3131482555240948
Energy: 1.033151748933252
Energy: 1.3131482555250154
Energy: 1.0409982583880986
Energy: 1.3227677980936476
Energy: 1.031318455133229
Energy: 1.3227677980936476
Energy: 1.0409982583880986
Energy: 1.3227677980936476
Energy: 1.043073018072886
Energy: 1.3561808655077625
Energy: 1.0762757791072843
Energy: 1.356180865508683
Energy: 1.043073018072886
Energy: 1.3561808655077625
Energy: 1.0338363131194526
Energy: 1.3256750071275158
Energy: 1.4047870940397058
Energy: 1.3256750071275158
Energy: 1.0338363131194526
Energy: 1.3256750071275158
Energy: 1.0332858286881443
Energy: 1.3232401146098374
Energy: 1.4381310334571782
Energy: 1.3232401146089168
Energy: 1.0332858286881443
Energy: 1.3232401146089168
Energy: 1.0437923607950679
Energy: 1.3284225407246397
Energy: 1.2960972915104598
Energy: 1.3284225407246397
Energy: 1.0437923607950679
Energy: 1.3284225407246397
Energy: 1.0605448153632278
Energy: 1.28997939204795
Energy: 1.0762676851128952
Energy: 1.289979392046109
Energy: 1.060544815362307
Energy: 1.2899793920470295
Energy: 1.0335563295534325
Energy: 1.1775642026515751
Energy: 1.2249117544013957
Energy: 1.1775642026515751
Energy: 1.0335563295534325
Energy: 1.1775642026515751
Energy: 1.0461535818062664
Energy: 1.2973257889007883
Energy: 1.0316519142923677
Energy: 1.2973257888989471
Energy: 1.0461535818062664
Energy: 1.2973257888989471

minimum gb energy = 1.0236886202262512 eV
minimum distance =  2.23092381079044 Angstroms
sigma value = 57


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

Energy: 1.2070474038576062
Energy: 1.4583185126573517
Energy: 1.1681253140890695
Energy: 1.4583185126585436
Energy: 1.207047403856414
Energy: 1.4583185126585436
Energy: 1.409764774388639
Energy: 1.2023896510683114
Energy: 1.120617892488454
Energy: 1.2023896510671193
Energy: 1.409764774388639
Energy: 1.2023896510683114
Energy: 1.1366484690119087
Energy: 1.4483182586046772
Energy: 1.3312472243991642
Energy: 1.448318258602293
Energy: 1.1366484690119087
Energy: 1.4483182586034853
Energy: 1.1440366397055608
Energy: 1.134307440637499
Energy: 1.1240627471242859
Energy: 1.134307440638691
Energy: 1.1440366397055608
Energy: 1.134307440638691
Energy: 1.1203452879682583
Energy: 1.1477316275529932
Energy: 1.1421835854517315
Energy: 1.1477316275518008
Energy: 1.1203452879682583
Energy: 1.1477316275529932
Energy: 1.1539648806600575
Energy: 1.4350751123351297
Energy: 1.1241961331898578
Energy: 1.4350751123351297
Energy: 1.1539648806600575
Energy: 1.4350751123339378
Energy: 1.1344554806384093
Energy: 1.3163913759478891
Energy: 1.4090019155296711
Energy: 1.3163913759478891
Energy: 1.1344554806384093
Energy: 1.3163913759478891
Energy: 1.1324640024083152
Energy: 1.4451208075996236
Energy: 1.1859705109789902
Energy: 1.4451208075984312
Energy: 1.1324640024083152
Energy: 1.4451208075984312
Energy: 1.1206298411174218
Energy: 1.1972586533435203
Energy: 1.2837789822473622
Energy: 1.1972586533423282
Energy: 1.1206298411174218
Energy: 1.1972586533435203
Energy: 1.139789352784852
Energy: 1.4305465721029986
Energy: 1.1241701718252801
Energy: 1.4305465721041908
Energy: 1.139789352784852
Energy: 1.4343876247314817
Energy: 1.1339563868656497
Energy: 1.1324861029325546
Energy: 1.12609455851397
Energy: 1.1324861029325546
Energy: 1.1339563868644578
Energy: 1.1324861029325546
Energy: 1.1209925692868004
Energy: 1.3067193065102003
Energy: 1.1239935939134382
Energy: 1.3067193065125846
Energy: 1.1209925692868004
Energy: 1.3067193065125846
Energy: 1.1208357549289578
Energy: 1.435064530385736
Energy: 1.1798943422550845
Energy: 1.435064530385736
Energy: 1.1208357549289578
Energy: 1.435064530385736
Energy: 1.3923151777668799
Energy: 1.4575017417595824
Energy: 1.1309666333745625
Energy: 1.4575017417619667
Energy: 1.3923151777668799
Energy: 1.3034764290714638
Energy: 1.6475986110131795
Energy: 1.442022539107849
Energy: 1.1314406712203326
Energy: 1.442022539106657
Energy: 1.6475986110119871
Energy: 1.442022539106657
Energy: 1.1212323307492593
Energy: 1.4665019395151566
Energy: 1.1208607582855306
Energy: 1.4665019395139645
Energy: 1.1212323307492593
Energy: 1.4665019395139645
Energy: 1.1210963182025981
Energy: 1.3163601908683573
Energy: 1.1333045738539107
Energy: 1.3163601908683573
Energy: 1.1210963182025981
Energy: 1.3163601908683573
Energy: 1.1321422626376216
Energy: 1.3985027243027803
Energy: 1.1320169619417955
Energy: 1.4561812713048752
Energy: 1.1321422626376216
Energy: 1.3305879659427666
Energy: 1.1332873237293568
Energy: 1.3167680488985802
Energy: 1.1211179214413118
Energy: 1.3167680488962232
Energy: 1.1332873237293568
Energy: 1.316768048895031
Energy: 1.1207798530518462
Energy: 1.466681867887825
Energy: 1.1214832791469138
Energy: 1.466681867889017
Energy: 1.120779853050654
Energy: 1.466681867887825
Energy: 1.131887342131784
Energy: 1.4421700343860326
Energy: 1.6475813870695803
Energy: 1.4421700343848678
Energy: 1.131887342131784
Energy: 1.4421700343848678
Energy: 1.1312700409796925
Energy: 1.3032213164361413
Energy: 1.3925273018836841
Energy: 1.3032213164385251
Energy: 1.1312700409796925
Energy: 1.3137349773802371
Energy: 1.1798943422491242
Energy: 1.4352173076870314
Energy: 1.1207325647223674
Energy: 1.4352173076882238
Energy: 1.1798943422491242
Energy: 1.4352173076870314
Energy: 1.1239945117777947
Energy: 1.3063023529941238
Energy: 1.1209914063078845
Energy: 1.3063023529941238
Energy: 1.1239945117777947
Energy: 1.306302352995316

minimum gb energy = 1.1203452879682583 eV
minimum distance =  2.22170964380116 Angstroms
sigma value = 17


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

Energy: 1.241152520398454
Energy: 1.241437443655446
Energy: 1.7849303775645984
Energy: 1.24143744365376
Energy: 1.241152520398454
Energy: 1.24143744365376
Energy: 1.2663330061204063
Energy: 1.2575656227939955
Energy: 1.24144111712004
Energy: 1.2575656227923098
Energy: 1.2663330061204063
Energy: 1.2575656227923098
Energy: 1.2575986262163419
Energy: 1.2573574922169024
Energy: 1.4360749704083742
Energy: 1.2573574922185882
Energy: 1.2575986262146557
Energy: 1.2573574922185882
Energy: 1.2543293785592318
Energy: 1.2510283677549299
Energy: 1.2406977422794636
Energy: 1.2510283677549299
Energy: 1.2543293785592318
Energy: 1.2510283677583016
Energy: 1.2416470877610835
Energy: 1.256598117482094
Energy: 1.5053888073917998
Energy: 1.256598117482094
Energy: 1.2416470877610835
Energy: 1.2565981174837797
Energy: 1.2438242309594145
Energy: 1.2415089546962572
Energy: 1.2254348693359076
Energy: 1.2415089546962572
Energy: 1.2438242309577288
Energy: 1.2415089546962572
Energy: 1.2463469869463337
Energy: 1.3813231717087155
Energy: 1.264978037956104
Energy: 1.3813231717070296
Energy: 1.2463469869463337
Energy: 1.3813231717070296
Energy: 1.2459170355635152
Energy: 1.3539088835023148
Energy: 1.2404466005674128
Energy: 1.3539088835023148
Energy: 1.2459170355635152
Energy: 1.3539088835023148
Energy: 1.2416886388997925
Energy: 1.2515139724409958
Energy: 1.3590871664638273
Energy: 1.2515139724426816
Energy: 1.2416886388997925
Energy: 1.2515139724426816
Energy: 1.2255766974039812
Energy: 1.2146469742069828
Energy: 1.2485536439854379
Energy: 1.2146469742086685
Energy: 1.2255766974022952
Energy: 1.2146469742069828
Energy: 1.2264633871359867
Energy: 1.4483341247903647
Energy: 1.2412820480922135
Energy: 1.448334124792051
Energy: 1.2264633871359867
Energy: 1.448334124792051
Energy: 1.248197671381829
Energy: 1.2491055048060409
Energy: 1.2422365903300265
Energy: 1.2491055048077266
Energy: 1.2481976713835148
Energy: 1.2491055048060409
Energy: 1.2417890652268604
Energy: 1.3554856369112112
Energy: 1.2429585518946051
Energy: 1.3554856369095252
Energy: 1.2417890652251744
Energy: 1.3554856369112112
Energy: 1.2452849211605892
Energy: 1.2503045249074516
Energy: 1.2524465734851424
Energy: 1.2503045249074516
Energy: 1.2452849211605892
Energy: 1.2503045249074516
Energy: 1.2470598463428846
Energy: 1.4609998817167966
Energy: 1.2256714398909485
Energy: 1.4609998817167966
Energy: 1.2470598463428846
Energy: 1.4609998817167966
Energy: 1.2435202675975354
Energy: 1.4495827493276512
Energy: 1.2273432193183669
Energy: 1.4495827493360804
Energy: 1.2435202675958876
Energy: 1.4495827493394522
Energy: 1.2420966059043557
Energy: 1.2499011675111122
Energy: 1.2482627597097555
Energy: 1.2499011675111122
Energy: 1.2420966059043557
Energy: 1.2499011675111122

minimum gb energy = 1.2146469742069828 eV
minimum distance =  2.23297328142469 Angstroms
sigma value = 17


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

Energy: 1.683232440852771
Energy: 1.6711705968797939
Energy: 1.384545774446238
Energy: 1.6711705968804451
Energy: 1.6832324408573283
Energy: 1.6711705968797939
Energy: 1.5047853652750334
Energy: 1.2911469065522156
Energy: 1.2761549526633058
Energy: 1.2911469065515646
Energy: 1.5047853652808922
Energy: 1.291146906552867
Energy: 1.2823984216533675
Energy: 1.3605441649431909
Energy: 1.302239909051636
Energy: 1.3605441649444927
Energy: 1.2823984216527167
Energy: 1.3605441649425398
Energy: 1.3117372270382552
Energy: 1.5476641801319981
Energy: 1.3236797875986435
Energy: 1.5476641801319981
Energy: 1.3117372270382552
Energy: 1.5476641801313469
Energy: 1.2847293457142386
Energy: 1.3414252354582195
Energy: 1.518713499416743
Energy: 1.341425235439991
Energy: 1.2847293457129367
Energy: 1.341425235441944
Energy: 1.3403257436808091
Energy: 1.5567171440281486
Energy: 1.3408520541121467
Energy: 1.5567171440301018
Energy: 1.3403257436788563
Energy: 1.5567171440301018
Energy: 1.2752706240759135
Energy: 1.3448422162709863
Energy: 1.5085581978932563
Energy: 1.3448422162703353
Energy: 1.2752706240765646
Energy: 1.3448422162722886
Energy: 1.6009657170660545
Energy: 1.4164949122601613
Energy: 1.2787402258903264
Energy: 1.4164949122640673
Energy: 1.6009657170673566
Energy: 1.4164949122608121
Energy: 1.3505651939741377
Energy: 1.6218090306548996
Energy: 1.3015179844106337
Energy: 1.6218090306562019
Energy: 1.3505651939754397
Energy: 1.6218090306548996
Energy: 1.6011621776088805
Energy: 1.3305299330570908
Energy: 1.2757288891670309
Energy: 1.3305299330603457
Energy: 1.6011621776088805
Energy: 1.3415740344671403
Energy: 1.319973208340139
Energy: 1.617473872112894
Energy: 1.3220767486613259
Energy: 1.617473872112894
Energy: 1.319973208341441
Energy: 1.617473872112894
Energy: 1.2966353902751762
Energy: 1.5650653742409217
Energy: 1.2753888850435557
Energy: 1.5650653742389686
Energy: 1.2966353902751762
Energy: 1.5650653742389686
Energy: 1.2795686103523416
Energy: 1.4209731113028818
Energy: 1.6650535255851713
Energy: 1.4209731113054858
Energy: 1.2795686103510395
Energy: 1.4209731113028818
Energy: 1.2899198177943478
Energy: 1.53104880129255
Energy: 1.6680911338158815
Energy: 1.5310488012808314
Energy: 1.2899198177943478
Energy: 1.531048801297107
Energy: 1.2888136124304204
Energy: 1.6406823598470537
Energy: 1.3248438040262966
Energy: 1.6406823598490068
Energy: 1.2888136124304204
Energy: 1.6406823598490068
Energy: 1.3216533550217957
Energy: 1.6807651874068068
Energy: 1.2754703599040405
Energy: 1.6807651874061555
Energy: 1.3216533550224467
Energy: 1.640154505342982
Energy: 1.3166225127326616
Energy: 1.6428394557330737
Energy: 1.2882677781859988
Energy: 1.6428394557330737
Energy: 1.3166225127339635
Energy: 1.6428394557330737
Energy: 1.6557099056561675
Energy: 1.5151910622423022
Energy: 1.2999275800505303
Energy: 1.5151910622449063
Energy: 1.6557099056561675
Energy: 1.515191062245557
Energy: 1.6526359941714823
Energy: 1.5171193932592302
Energy: 1.2756365244207772
Energy: 1.5171193932605322
Energy: 1.6526359941714823
Energy: 1.5171193932598812
Energy: 1.2787243832660466
Energy: 1.507873062955184
Energy: 1.2790857269273301
Energy: 1.5078730629460693
Energy: 1.2787243832660466
Energy: 1.5880475619252705
Energy: 1.275420363485115
Energy: 1.5167937048084106
Energy: 1.4920613614849643
Energy: 1.5167937048058062
Energy: 1.2754203634844636
Energy: 1.516793704803202
Energy: 1.2979170070229074
Energy: 1.5132884552992574
Energy: 1.6556209301739613
Energy: 1.513288455297955
Energy: 1.2979170070242094
Energy: 1.5132884552960022
Energy: 1.2926869056015213
Energy: 1.643082421869596
Energy: 1.3166705673758596
Energy: 1.643082421869596
Energy: 1.2926869056021724
Energy: 1.6430824218702471
Energy: 1.2755360984992528
Energy: 1.6144573321537627
Energy: 1.3223455532068238
Energy: 1.614457332153112
Energy: 1.2755360984992528
Energy: 1.6144573321537627
Energy: 1.3223213819106678
Energy: 1.640838259327689
Energy: 1.2802616521836148
Energy: 1.640838259329642
Energy: 1.3223213819119701
Energy: 1.640838259329642
Energy: 1.6684274280287625
Energy: 1.5369843312343054
Energy: 1.2898824564413764
Energy: 1.5369843312388625
Energy: 1.6684274280287625
Energy: 1.5369843312629505
Energy: 1.6654117018869345
Energy: 1.417990424023428
Energy: 1.2795705217008977
Energy: 1.4179904240201728
Energy: 1.6654117018869345
Energy: 1.4179904240169177
Energy: 1.2754065031843747
Energy: 1.5581427781098738
Energy: 1.2972236166664308
Energy: 1.5581427781098738
Energy: 1.2754065031850255
Energy: 1.5581427781072694
Energy: 1.3233351620198688
Energy: 1.6172306479412175
Energy: 1.3198912610455764
Energy: 1.6172306479386134
Energy: 1.3233351620198688
Energy: 1.6172306479379623
Energy: 1.2756604187459148
Energy: 1.3415740344723486
Energy: 1.6012639734992242
Energy: 1.3415740344697442
Energy: 1.275660418744613
Energy: 1.3415740344736504
Energy: 1.2955219255970254
Energy: 1.6195295809059262
Energy: 1.3506540330217174
Energy: 1.6195295809059262
Energy: 1.2955219255963746
Energy: 1.6195295809059262
Energy: 1.278782558728816
Energy: 1.4162361693509173
Energy: 1.6011407208945938
Energy: 1.4162361693541725
Energy: 1.278782558728816
Energy: 1.4162361693548235
Energy: 1.508311574161027
Energy: 1.3381238282884524
Energy: 1.275525691016632
Energy: 1.3381238282799892
Energy: 1.5083115741623292
Energy: 1.338123828276083
Energy: 1.3436566459944004
Energy: 1.5579913490156465
Energy: 1.3399648533676203
Energy: 1.5579913490130424
Energy: 1.3436566459911454
Energy: 1.5579913490149955
Energy: 1.5186368137525912
Energy: 1.341425235444548
Energy: 1.2805964565183856
Energy: 1.3414252354478031
Energy: 1.5186368137551953
Energy: 1.3414252354484542
Energy: 1.3246554805923523
Energy: 1.5659212781569884
Energy: 1.3097953667198043
Energy: 1.5659212781569884
Energy: 1.3246554805903994
Energy: 1.5659212781563376
Energy: 1.300484587652519
Energy: 1.3392289052105721
Energy: 1.2824087527801005
Energy: 1.3392289052112232
Energy: 1.300484589266965
Energy: 1.3392289052118742
Energy: 1.2761158541590853
Energy: 1.2913889270709007
Energy: 1.5151944084473385
Energy: 1.2913889270709007
Energy: 1.2761158541577833
Energy: 1.2913889270702499
Energy: 1.5308008072615222
Energy: 1.671170596882398
Energy: 1.683232440855375
Energy: 1.671170596881747
Energy: 1.5308008072634751
Energy: 1.671170596882398
Energy: 1.276154952667212
Energy: 1.291146906553518
Energy: 1.50478536526657
Energy: 1.2911469065509138
Energy: 1.276154952667863
Energy: 1.291146906552867
Energy: 1.3022399091661567
Energy: 1.3605441649431909
Energy: 1.2823984216527167
Energy: 1.3605441649431909
Energy: 1.3022399091583445
Energy: 1.3605441649425398
Energy: 1.3236797876005966
Energy: 1.547664180128092
Energy: 1.311737227027839
Energy: 1.5476641801306958
Energy: 1.3236797875992945
Energy: 1.5476641801300448
Energy: 1.5187134994193474
Energy: 1.3414252354458502
Energy: 1.2847293457161915
Energy: 1.341425235441293
Energy: 1.5187134994180451
Energy: 1.3414252354543132

minimum gb energy = 1.2752706240759135 eV
minimum distance =  2.206066941687 Angstroms
sigma value = 57


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

Energy: 1.4044121322283172
Energy: 1.6415882753896267
Energy: 1.5800477770084271
Energy: 1.6415882753864466
Energy: 1.4044121322283172
Energy: 1.6415882753853865
Energy: 1.359222983866533
Energy: 1.2959908748353715
Energy: 1.2953095137214152
Energy: 1.2959908748343116
Energy: 1.359222983867593
Energy: 1.2959908748343116
Energy: 1.2662662163184248
Energy: 1.3824615659482768
Energy: 1.5837219828246294
Energy: 1.3824615302605503
Energy: 1.2662662163194847
Energy: 1.3824615670777762
Energy: 1.3780427551052032
Energy: 1.3569436081521973
Energy: 1.3531706913086363
Energy: 1.3569436081500772
Energy: 1.3780427551052032
Energy: 1.356943608140537
Energy: 1.2698571744894476
Energy: 1.409248693682511
Energy: 1.3806956026724264
Energy: 1.4092486936867512
Energy: 1.2698571744894476
Energy: 1.409248693683571
Energy: 1.3684372021714648
Energy: 1.3658783857241097
Energy: 1.349746752875831
Energy: 1.3658783857367818
Energy: 1.3684372021714648
Energy: 1.3658783857346615
Energy: 1.2697051142885247
Energy: 1.4530656235005135
Energy: 1.318089698373001
Energy: 1.4530656235015735
Energy: 1.269705114286453
Energy: 1.4530656235015735
Energy: 1.6245526884892898
Energy: 1.3306704613288947
Energy: 1.295240979704555
Energy: 1.330670466238809
Energy: 1.6245526884892898
Energy: 1.3306704817898258
Energy: 1.386213509679297
Energy: 1.6774126725253549
Energy: 1.313708175627596
Energy: 1.6774126725211147
Energy: 1.386213509678237
Energy: 1.6774126725201026
Energy: 1.3564863977954975
Energy: 1.3024474119185057
Energy: 1.2988738541380989
Energy: 1.3024474119216858
Energy: 1.3564863977944372
Energy: 1.3024474119185057
Energy: 1.2695115226829623
Energy: 1.471187877311826
Energy: 1.3530856208796924
Energy: 1.4711878772419131
Energy: 1.2695115226829623
Energy: 1.4711878774061198
Energy: 1.3648280472971124
Energy: 1.3490290779649967
Energy: 1.342540026518353
Energy: 1.3490290779639367
Energy: 1.3648280472981726
Energy: 1.3490290779618164
Energy: 1.2747499750403464
Energy: 1.5159589814403478
Energy: 1.355543972661097
Energy: 1.515958981444588
Energy: 1.2747499750414064
Energy: 1.5159589814371677
Energy: 1.3577552673528728
Energy: 1.4115493517387765
Energy: 1.3430074292689562
Energy: 1.4115493517419564
Energy: 1.357755267353933
Energy: 1.4115493517419564
Energy: 1.2741551970330742
Energy: 1.3656448095213864
Energy: 1.3146524433977593
Energy: 1.3656448095203262
Energy: 1.2741551970320142
Energy: 1.3656448095203262
Energy: 1.629407101120139
Energy: 1.5596258714209845
Energy: 1.2983801670329662
Energy: 1.5596258714199247
Energy: 1.6294071011487596
Energy: 1.5596258714209845
Energy: 1.3860853570929859
Energy: 1.5369900443062294
Energy: 1.3099493411790408
Energy: 1.5369900442648887
Energy: 1.386085357091926
Energy: 1.5369900442542888
Energy: 1.3564125800150062
Energy: 1.4114907831477561
Energy: 1.305675912817565
Energy: 1.411490783138216
Energy: 1.3564125800160662
Energy: 1.4114907832028287
Energy: 1.2743384046447515
Energy: 1.5190513754907595
Energy: 1.3420649860113532
Energy: 1.5190513754907595
Energy: 1.2743384046468713
Energy: 1.5190513754886394
Energy: 1.3640542610280018
Energy: 1.528611779919588
Energy: 1.3401614836153566
Energy: 1.5286117799174677
Energy: 1.3640542610280018
Energy: 1.5286117799258998
Energy: 1.2837046036960207
Energy: 1.5237607176969048
Energy: 1.3427817614318913
Energy: 1.5237607176311836
Energy: 1.2837046036960207
Energy: 1.5237607176311836
Energy: 1.26765903529148
Energy: 1.5114660144445657
Energy: 1.340836428908347
Energy: 1.5114660144424454
Energy: 1.2676590352904198
Energy: 1.5114660144445657
Energy: 1.267046658317236
Energy: 1.3901485221698389
Energy: 1.309462460410754
Energy: 1.3901485223669063
Energy: 1.267046658317236
Energy: 1.3901485221401586
Energy: 1.3763383115435508
Energy: 1.5290945124895203
Energy: 1.3057002443217132
Energy: 1.5290945125106723
Energy: 1.3763383115446106
Energy: 1.5290945121674189
Energy: 1.3783592250824392
Energy: 1.5291938692787723
Energy: 1.300846357500462
Energy: 1.5291938692777125
Energy: 1.3783592250834995
Energy: 1.5291938692766525
Energy: 1.2672140686263584
Energy: 1.3756159099481524
Energy: 1.3110002560465548
Energy: 1.3756159099407326
Energy: 1.2672140686252984
Energy: 1.3756159099343723
Energy: 1.2680337088861355
Energy: 1.5190725122068642
Energy: 1.3401222318588653
Energy: 1.5190725122079243
Energy: 1.2680337088871956
Energy: 1.5190725122079243

minimum gb energy = 1.2662662163184248 eV
minimum distance =  2.23848295867426 Angstroms
sigma value = 43


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

Energy: 1.4451298582805734
Energy: 1.6318371693818565
Energy: 1.4195303610337615
Energy: 1.6318371693834013
Energy: 1.4451298582805734
Energy: 1.6318371693834013
Energy: 1.377841957116621
Energy: 1.345750001000441
Energy: 1.311471467792178
Energy: 1.345750001002758
Energy: 1.3778419571150764
Energy: 1.3457500010012133
Energy: 1.314078546607554
Energy: 1.4364686864237681
Energy: 1.4663035010779653
Energy: 1.4364686864222234
Energy: 1.3140785466067817
Energy: 1.436468686419134
Energy: 1.4287436803396205
Energy: 1.601742446670712
Energy: 1.3950246031100708
Energy: 1.6017424466691672
Energy: 1.4287436803373033
Energy: 1.601742446670712
Energy: 1.3149800894979955
Energy: 1.3943647729456243
Energy: 1.4029650611658897
Energy: 1.3943647729016364
Energy: 1.3149800894979955
Energy: 1.3943647729294055
Energy: 1.3964769384725713
Energy: 1.4069466680868365
Energy: 1.3118267347699988
Energy: 1.406946668093015
Energy: 1.3964769384725713
Energy: 1.4069466680961045
Energy: 1.3131029323952919
Energy: 1.418903734867519
Energy: 1.3469854231140472
Energy: 1.4189037347887763
Energy: 1.3131029323952919
Energy: 1.4189037348451567
Energy: 1.4212447137015927
Energy: 1.391788531860567
Energy: 1.3152891484962683
Energy: 1.3917885318096281
Energy: 1.4212447137031374
Energy: 1.3917885318567051
Energy: 1.3936676946062416
Energy: 1.6021117234305557
Energy: 1.409969330817325
Energy: 1.6021117234274664
Energy: 1.3936676946085584
Energy: 1.6021117234297833
Energy: 1.5177908010206576
Energy: 1.4125299421568431
Energy: 1.3142827781289874
Energy: 1.412529942188509
Energy: 1.517790801019113
Energy: 1.4125299423259143
Energy: 1.312796362936277
Energy: 1.3659082100800686
Energy: 1.608939037736149
Energy: 1.3659082100800686
Energy: 1.312796362935505
Energy: 1.3659082100823856
Energy: 1.3450527648450459
Energy: 1.5746556697114673
Energy: 1.433433871066089
Energy: 1.5746556697122396
Energy: 1.3450527648450459
Energy: 1.5746556697145568
Energy: 1.3167664951233744
Energy: 1.349502205165014
Energy: 1.4004759769292807
Energy: 1.3495022051642416
Energy: 1.3167664951233744
Energy: 1.349502205165014
Energy: 1.3987226098709775
Energy: 1.4705789192339696
Energy: 1.314518391789422
Energy: 1.470578919232425
Energy: 1.3987226098640269
Energy: 1.4705789192308802
Energy: 1.388742927046953
Energy: 1.6009600008640719
Energy: 1.3448203804097163
Energy: 1.6009600008632994
Energy: 1.388742927046953
Energy: 1.6009600008617548
Energy: 1.3925011663636087
Energy: 1.5313313259904777
Energy: 1.3186362821479
Energy: 1.5313313259758032
Energy: 1.3925011663620641
Energy: 1.531331325975031
Energy: 1.3178353770133566
Energy: 1.4808353081639807
Energy: 1.3979778138145371
Energy: 1.480835307484607
Energy: 1.3178353770125846
Energy: 1.4808353118185638
Energy: 1.3638031640028674
Energy: 1.3984124599189902
Energy: 1.311491315914
Energy: 1.3984124600957497
Energy: 1.3638031640020951
Energy: 1.3984124599452143
Energy: 1.3449944143017947
Energy: 1.4548170635951465
Energy: 1.3898811987517063
Energy: 1.4548170635959188
Energy: 1.3449944143017947
Energy: 1.4548170635959188
Energy: 1.322905240242568
Energy: 1.565853952657504
Energy: 1.388889516563878
Energy: 1.5658539526613657
Energy: 1.322905240242568
Energy: 1.565853952666772
Energy: 1.3207777611236435
Energy: 1.4181016206479875
Energy: 1.3485526873725928
Energy: 1.41810162072982
Energy: 1.3207777611236435
Energy: 1.4181016207043329
Energy: 1.7078452256596226
Energy: 1.470936415056813
Energy: 1.3192120275281414
Energy: 1.4709364150583575
Energy: 1.7078452256588503
Energy: 1.4709364150575854
Energy: 1.8041158277812224
Energy: 1.5262779793764931
Energy: 1.3463589939825216
Energy: 1.5262779793772654
Energy: 1.8041158277819944
Energy: 1.5262779793757206
Energy: 1.3259029138219411
Energy: 1.6027312859308984
Energy: 1.3446093948755888
Energy: 1.6027312859308984
Energy: 1.3259029138219411
Energy: 1.602731285930126
Energy: 1.3203075838777207
Energy: 1.5660721242187425
Energy: 1.3985169638388077
Energy: 1.5660721242187425
Energy: 1.3203075838784928
Energy: 1.5660721242187425
Energy: 1.351005817903779
Energy: 1.5486817693585146
Energy: 1.394348041177795
Energy: 1.5486817693577424
Energy: 1.3510058179030067
Energy: 1.5486817693585146
Energy: 1.3587066632710514
Energy: 1.5235548149394325
Energy: 1.3889454808622073
Energy: 1.52355481493866
Energy: 1.3587066632702791
Energy: 1.5235548149371154
Energy: 1.3852983931001095
Energy: 1.712112067330496
Energy: 1.3852263563927667
Energy: 1.7121120673297234
Energy: 1.3852983931001095
Energy: 1.7121120673297234
Energy: 1.3887323637094406
Energy: 1.5277724739458203
Energy: 1.348897433724665
Energy: 1.5277724739937049
Energy: 1.3887323637086684
Energy: 1.5277724739937049
Energy: 1.394445549300668
Energy: 1.549624348405976
Energy: 1.3514875946112317
Energy: 1.549624348403659
Energy: 1.394445549300668
Energy: 1.5496243484044312
Energy: 1.397312888314019
Energy: 1.5661088800775032
Energy: 1.3200086886808007
Energy: 1.566108880079048
Energy: 1.397312888314019
Energy: 1.566108880079048
Energy: 1.344572281248745
Energy: 1.412301046902538
Energy: 1.3267223524989147
Energy: 1.4123010382979209
Energy: 1.3445722812495176
Energy: 1.4123010563949536
Energy: 1.3464278329481445
Energy: 1.515229132651037
Energy: 1.6092846393463514
Energy: 1.5152291326502647
Energy: 1.3464278329481445
Energy: 1.5152291326525817
Energy: 1.319181955688673
Energy: 1.467394424090208
Energy: 1.7079038184138042
Energy: 1.467394424090208
Energy: 1.319181955688673
Energy: 1.4673944240917527
Energy: 1.3487713330032465
Energy: 1.4227694800421329
Energy: 1.3207525871048926
Energy: 1.4227694817513097
Energy: 1.3487713330024742
Energy: 1.4227694811229101
Energy: 1.388759843315453
Energy: 1.5663695746282087
Energy: 1.3225252168182444
Energy: 1.5663695746282087
Energy: 1.388759843315453
Energy: 1.5663695746282087

minimum gb energy = 1.311471467792178 eV
minimum distance =  2.23941842408529 Angstroms
sigma value = 81


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

Energy: 1.3578196259381763
Energy: 1.3605627811386383
Energy: 1.874573820488487
Energy: 1.3605627811417338
Energy: 1.3578196259381763
Energy: 1.360562781140315
Energy: 1.5491419206146408
Energy: 1.360521430763618
Energy: 1.357841538651829
Energy: 1.3605214307633278
Energy: 1.5491419206126738
Energy: 1.360521430763618
Energy: 1.3578050811026765
Energy: 1.3608287001967219
Energy: 1.5490453822970334
Energy: 1.3608287001967219
Energy: 1.3578050811026765
Energy: 1.3608287001961736
Energy: 1.631820526042925
Energy: 1.3605627811400571
Energy: 1.357819625937596
Energy: 1.3605627811397667
Energy: 1.631820526041216
Energy: 1.360562781140315
Energy: 1.3578415386509908
Energy: 1.3605214307641662
Energy: 1.5491419206135122
Energy: 1.360521430763908
Energy: 1.357841538651539
Energy: 1.3605214307641662
Energy: 1.5490453822970334
Energy: 1.3608287001975925
Energy: 1.3578050811023863
Energy: 1.3608287001967219
Energy: 1.5490453822973234
Energy: 1.360828700197302
Energy: 1.3578196259381763
Energy: 1.3605627811391863
Energy: 1.6318205260434733
Energy: 1.3605627811406051
Energy: 1.3578196259384343
Energy: 1.3605627811411858
Energy: 1.549141920613222
Energy: 1.360521430763908
Energy: 1.3578415386521192
Energy: 1.360521430763618
Energy: 1.549141920612093
Energy: 1.360521430763908
Energy: 1.357805081101838
Energy: 1.3608287001961736
Energy: 1.5490453822967432
Energy: 1.3608287001964638
Energy: 1.3578050811023863
Energy: 1.3608287001967219
Energy: 1.6938716472431334
Energy: 1.3605627811397667
Energy: 1.3578196259378863
Energy: 1.3605627811397667
Energy: 1.6938716472428752
Energy: 1.3605627811372192

minimum gb energy = 1.357805081101838 eV
minimum distance =  2.23139700666654 Angstroms
sigma value = 3


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

Energy: 1.6644795813283944
Energy: 1.6796768983905785
Energy: 1.6338873742956745
Energy: 1.6796768983888801
Energy: 1.6644795813241484
Energy: 1.6796768983854833
Energy: 1.5528982555306534
Energy: 1.3618892863333307
Energy: 1.290745233104614
Energy: 1.361889286370657
Energy: 1.5528982555306534
Energy: 1.361889286370657
Energy: 1.3287814697186422
Energy: 1.348164684900622
Energy: 1.560195520476507
Energy: 1.348164684900622
Energy: 1.3287814697186422
Energy: 1.348164684900622
Energy: 1.7074705140060056
Energy: 1.6549323684013775
Energy: 1.3471971281140487
Energy: 1.6549323684251551
Energy: 1.7074705140060056
Energy: 1.654932368424306
Energy: 1.3348994822779339
Energy: 1.334329710257878
Energy: 1.6443091725232697
Energy: 1.3343297102638223
Energy: 1.3348994822779339
Energy: 1.334329710266331
Energy: 1.485176347832143
Energy: 1.3939971049379685
Energy: 1.2900583019289482
Energy: 1.393997104939667
Energy: 1.4851763478380875
Energy: 1.393997104939667
Energy: 1.3348666020662723
Energy: 1.3335267548251892
Energy: 1.4746339423429264
Energy: 1.333526754827737
Energy: 1.3348666020662723
Energy: 1.333526754827737
Energy: 1.330692639429983
Energy: 1.7261799406033218
Energy: 1.3444786541849354
Energy: 1.7261799406016234
Energy: 1.3306926394316814
Energy: 1.726179940600774
Energy: 1.329769315840489
Energy: 1.508762694379449
Energy: 1.6106652250220144
Energy: 1.5087626943828456
Energy: 1.329769315840489
Energy: 1.5087626943828456
Energy: 1.3285350208038345
Energy: 1.3516769166356823
Energy: 1.2926956907143332
Energy: 1.3516769166399285
Energy: 1.328535020802136
Energy: 1.3516769166365317
Energy: 1.6448817201408015
Energy: 1.5452590442774439
Energy: 1.361667238411006
Energy: 1.5452590442774439
Energy: 1.6448817201391033
Energy: 1.545259044278293
Energy: 1.6472173152226812
Energy: 1.3127287125598943
Energy: 1.2921985254795314
Energy: 1.3127287126227352
Energy: 1.64721731522353
Energy: 1.3127287127186562
Energy: 1.3309594210855662
Energy: 1.41853394345403
Energy: 1.2921356987953678
Energy: 1.4185339436356823
Energy: 1.3309594210855662
Energy: 1.4185339434523319
Energy: 1.329234638541046
Energy: 1.4014262388764112
Energy: 1.3406351127865577
Energy: 1.401426238880657
Energy: 1.329234638540197
Energy: 1.4014262388815064
Energy: 1.3319549733965028
Energy: 1.3403243276405217
Energy: 1.3408446385739594
Energy: 1.3403243276651484
Energy: 1.3319549733982012
Energy: 1.3403243276710928
Energy: 1.3304921956849047
Energy: 1.3495800921721202
Energy: 1.2941209112131113
Energy: 1.349580092100826
Energy: 1.3304921956857538
Energy: 1.349580092158533
Energy: 1.3315171741854912
Energy: 1.4803536745946018
Energy: 1.294086677107059
Energy: 1.4803536745929033
Energy: 1.3315171741846419
Energy: 1.4803536745895065
Energy: 1.329851169932813
Energy: 1.428208554652803
Energy: 1.3406932155593294
Energy: 1.4282085546545011
Energy: 1.3298511699336621
Energy: 1.4282085546545011
Energy: 1.3290290634938255
Energy: 1.4019274729763522
Energy: 1.3411422752941693
Energy: 1.4019274729721063
Energy: 1.329029063495524
Energy: 1.4019274729729554
Energy: 1.329017083310364
Energy: 1.343482177554857
Energy: 1.2923716858706567
Energy: 1.3434821775608015
Energy: 1.329017083309515
Energy: 1.34348217758373
Energy: 1.6464540943561918
Energy: 1.3163224783717102
Energy: 1.2921770600324591
Energy: 1.3163224783691625
Energy: 1.6464540943578905
Energy: 1.3163224783751073
Energy: 1.6437314673721113
Energy: 1.5498828962708726
Energy: 1.355339884551466
Energy: 1.5498828962615312
Energy: 1.6437314673721113
Energy: 1.5498828962632296
Energy: 1.3285044854313848
Energy: 1.351754160681824
Energy: 1.2927155006457665
Energy: 1.3517541606776164
Energy: 1.3285044854322337
Energy: 1.3517541606767671
Energy: 1.3288306976046715
Energy: 1.5149447730768675
Energy: 1.6105813498655002
Energy: 1.514944773075169
Energy: 1.3288306976038222
Energy: 1.514944773075169
Energy: 1.3303399387588908
Energy: 1.4292388147025368
Energy: 1.3432851423750427
Energy: 1.4292388147050845
Energy: 1.3303399387571924
Energy: 1.4292388147042352
Energy: 1.3335267981534138
Energy: 1.514357437792082
Energy: 1.4246336714843932
Energy: 1.5143574377258828
Energy: 1.3335267981534138
Energy: 1.5143574378531857
Energy: 1.331445265031161
Energy: 1.5447070874172575
Energy: 1.2911660317280835
Energy: 1.5447070874206543
Energy: 1.331445265031161
Energy: 1.544707087418956
Energy: 1.333380379448298
Energy: 1.3938987837501666
Energy: 1.6103677785292894
Energy: 1.393898783751865
Energy: 1.3333803794474486
Energy: 1.3938987837527144
Energy: 1.4314055573501998
Energy: 1.7178857352878805
Energy: 1.347154804190433
Energy: 1.7178857352844836
Energy: 1.431405557351898
Energy: 1.7178857352827852
Energy: 1.3274739946219372
Energy: 1.3515681671414725
Energy: 1.4674264531122765
Energy: 1.3515681671423214
Energy: 1.3274739946219372
Energy: 1.3515681671414725
Energy: 1.5530177376647536
Energy: 1.3544919645839628
Energy: 1.2899917862565402
Energy: 1.354491964588209
Energy: 1.5530177376647536
Energy: 1.3544919645865103
Energy: 1.646455739368522
Energy: 1.7392853804300306
Energy: 1.3586321633934872
Energy: 1.7392853804334274
Energy: 1.646455739368522
Energy: 1.7392853804342767
Energy: 1.5524815059174544
Energy: 1.3603482523363501
Energy: 1.2890008216565922
Energy: 1.3603482523414454
Energy: 1.5524815059149066
Energy: 1.3603482523414454

minimum gb energy = 1.2890008216565922 eV
minimum distance =  2.19464066023308 Angstroms
sigma value = 67


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

Energy: 1.3164463240736164
Energy: 1.7274912181978763
Energy: 1.764656824784898
Energy: 1.7274912181978763
Energy: 1.3164463240736164
Energy: 1.727491218199086
Energy: 1.7325069085098133
Energy: 1.2805684453869386
Energy: 1.2681316441287702
Energy: 1.2805684453833084
Energy: 1.7325069085110232
Energy: 1.2805684453833084
Energy: 1.2883132978172296
Energy: 1.391609902925655
Energy: 1.5048499057367226
Energy: 1.391609902925655
Energy: 1.2883132978172296
Energy: 1.3916099029268654
Energy: 1.6591426304960928
Energy: 1.64812307564018
Energy: 1.273083920388046
Energy: 1.6481230756413898
Energy: 1.659142630494883
Energy: 1.64812307564018
Energy: 1.2685029028968917
Energy: 1.7510222628314642
Energy: 1.6347106323509157
Energy: 1.751022262827834
Energy: 1.2685029028968917
Energy: 1.7510222628302543
Energy: 1.266737172928921
Energy: 1.5417535814569872
Energy: 1.2690167481332275
Energy: 1.5417535814569872
Energy: 1.2667371729277108
Energy: 1.541753581455777
Energy: 1.269941605787375
Energy: 1.2823633413834654
Energy: 1.2936878028985415
Energy: 1.2823633413810456
Energy: 1.269941605788585
Energy: 1.2823633413822555
Energy: 1.2880546803534791
Energy: 1.5246621273298788
Energy: 1.670646719255831
Energy: 1.524662127335929
Energy: 1.288054680351059
Energy: 1.5246621273383492
Energy: 1.2905721292559282
Energy: 1.3111800565987344
Energy: 1.6682818623369446
Energy: 1.3111800566035192
Energy: 1.290572129254718
Energy: 1.3111800566035192
Energy: 1.2916894803589465
Energy: 1.3330068878462087
Energy: 1.2966635749188553
Energy: 1.333006887855889
Energy: 1.2916894803613665
Energy: 1.3330068878305337
Energy: 1.2688586757771703
Energy: 1.4329792787951547
Energy: 1.2953051873812684
Energy: 1.4329792787927345
Energy: 1.2688586757771703
Energy: 1.4329792787939446
Energy: 1.2706103374560236
Energy: 1.3229684728150926
Energy: 1.2707613644429183
Energy: 1.3229684728163025
Energy: 1.2706103374560236
Energy: 1.3229684728175126
Energy: 1.2961631287100994
Energy: 1.4338470773621501
Energy: 1.268876215846318
Energy: 1.4338470773621501
Energy: 1.2961631287125193
Energy: 1.43384707735973
Energy: 1.2966311475317331
Energy: 1.3321942273773046
Energy: 1.2917882492056207
Energy: 1.3321942273724645
Energy: 1.2966311475305232
Energy: 1.3321942273821448
Energy: 1.6688776177821363
Energy: 1.3108739882339437
Energy: 1.2906158597889266
Energy: 1.310873988235154
Energy: 1.6688776177809261
Energy: 1.310873988237574
Energy: 1.6719874285836107
Energy: 1.5265682219836187
Energy: 1.2885188678774735
Energy: 1.5265682219884589
Energy: 1.6719874285824006
Energy: 1.5265682219848284
Energy: 1.29373635724563
Energy: 1.281967992769475
Energy: 1.2901431199154119
Energy: 1.281967992773105
Energy: 1.2937363572468403
Energy: 1.281967992773105
Energy: 1.2690767090717863
Energy: 1.5414694027085916
Energy: 1.2667898882025967
Energy: 1.5414694027110118
Energy: 1.2690767090717863
Energy: 1.5414694027110118
Energy: 1.6334034544987155
Energy: 1.7491049335185376
Energy: 1.2684644177345472
Energy: 1.7491049335209576
Energy: 1.6334034544975056
Energy: 1.7491049335185376
Energy: 1.2730852289752141
Energy: 1.6594659882340619
Energy: 1.6586232364090432
Energy: 1.6594659882340619
Energy: 1.273085228976424
Energy: 1.659465988230432
Energy: 1.478459304150017
Energy: 1.391609902925655
Energy: 1.2895272804231932
Energy: 1.391609902925655
Energy: 1.4784593039806697
Energy: 1.391609902924445
Energy: 1.2681500668114694
Energy: 1.2820956371702275
Energy: 1.732430191556494
Energy: 1.2820956371847478
Energy: 1.2681500668114694
Energy: 1.2820956371738579
Energy: 1.5363000670783185
Energy: 1.7274912181978763
Energy: 1.3164463240736164
Energy: 1.727491218199086
Energy: 1.5363000670771088
Energy: 1.727491218199086

minimum gb energy = 1.2667371729277108 eV
minimum distance =  2.1884593988177 Angstroms
sigma value = 33


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

Energy: 1.5279485749521795
Energy: 1.7745530761777837
Energy: 1.7396301724394017
Energy: 1.7745530761816217
Energy: 1.5279485749506443
Energy: 1.774553076177016
Energy: 1.7129207273588516
Energy: 1.5173724021502164
Energy: 1.2293364443217842
Energy: 1.517372402149449
Energy: 1.7129207275399032
Energy: 1.5173724021502164
Energy: 1.2263222786846926
Energy: 1.3080798446449242
Energy: 1.5720722603253292
Energy: 1.3080798446449242
Energy: 1.2263222786846926
Energy: 1.3080798446449242
Energy: 1.296860629881869
Energy: 1.3403926458126683
Energy: 1.2365584151304323
Energy: 1.3403926464656262
Energy: 1.296860629881869
Energy: 1.3403926434732691
Energy: 1.4469938679127423
Energy: 1.5959087033056174
Energy: 1.4356588541933655
Energy: 1.595908703306385
Energy: 1.4469938679142775
Energy: 1.5959087033071524
Energy: 1.4484831225594152
Energy: 1.406722148054198
Energy: 1.23045651821771
Energy: 1.4067221480526626
Energy: 1.4484831225609505
Energy: 1.4067221480511276
Energy: 1.2226127530356152
Energy: 1.2436769425273766
Energy: 1.240030275620229
Energy: 1.243676942526609
Energy: 1.2226127530363828
Energy: 1.243676942526609
Energy: 1.2446399626567315
Energy: 1.2199395237483075
Energy: 1.4485541670875213
Energy: 1.2199395236738841
Energy: 1.2446399626574993
Energy: 1.2199395236784552
Energy: 1.432050853172069
Energy: 1.420201716904919
Energy: 1.4458577333216451
Energy: 1.420201716904919
Energy: 1.4320508531728366
Energy: 1.4202017169079897
Energy: 1.2338330219191656
Energy: 1.380971260190611
Energy: 1.220208497582577
Energy: 1.3809712601929138
Energy: 1.2338330219183982
Energy: 1.2394849001746981
Energy: 1.2171881220910326
Energy: 1.4215245767771794
Energy: 1.2458116580510823
Energy: 1.4215245767779472
Energy: 1.217188122090265
Energy: 1.4215245767779472
Energy: 1.2207035416959995
Energy: 1.2832066101268933
Energy: 1.706697564775321
Energy: 1.2832066101268933
Energy: 1.2207035416975347
Energy: 1.2832066101276611
Energy: 1.4619171964946087
Energy: 1.5433461844264371
Energy: 1.5142374185481091
Energy: 1.5433461844264371
Energy: 1.4619171964961437
Energy: 1.5433461844264371
Energy: 1.229343703477287
Energy: 1.4157669235264307
Energy: 1.2257604491019098
Energy: 1.4157669235264307
Energy: 1.2293437034780543
Energy: 1.4157669235264307
Energy: 1.4351865564905284
Energy: 1.3048640538685874
Energy: 1.220296365300573
Energy: 1.3048640538210303
Energy: 1.4351865564866904
Energy: 1.3048640538701228
Energy: 1.236560557647277
Energy: 1.4639593856815276
Energy: 1.630857422683923
Energy: 1.463959385682295
Energy: 1.2365605576480443
Energy: 1.463959385684598
Energy: 1.7026014745860099
Energy: 1.7693670670579584
Energy: 1.4927145954544159
Energy: 1.769367067058726
Energy: 1.7026014745867775
Energy: 1.7693670670602613
Energy: 1.219352805728877
Energy: 1.2447511966759497
Energy: 1.5793206281378627
Energy: 1.244751196677485
Energy: 1.2193528057296448
Energy: 1.244751196677485
Energy: 1.4667220324618697
Energy: 1.2423962534245712
Energy: 1.2227488003977032
Energy: 1.2423962534238036
Energy: 1.4667220324695458
Energy: 1.2423962534245712
Energy: 1.4825673643731192
Energy: 1.5292522214582438
Energy: 1.2418459588502826
Energy: 1.5292522214559412
Energy: 1.4825673643723514
Energy: 1.5292522214590116
Energy: 1.691216180979743
Energy: 1.3898737810587969
Energy: 1.2322704260730084
Energy: 1.3898737796401122
Energy: 1.6912161809789754
Energy: 1.3898737793324398
Energy: 1.2266424361240702
Energy: 1.4267494617368823
Energy: 1.4344411087163431
Energy: 1.4267494617384173
Energy: 1.2266424361233024
Energy: 1.4267494617376497
Energy: 1.2432308857733563
Energy: 1.4228880399589716
Energy: 1.2228914525182406
Energy: 1.4228880399605068
Energy: 1.2432308857741239
Energy: 1.4228880399605068
Energy: 1.5007667872778905
Energy: 1.5591546677264272
Energy: 1.217612231397512
Energy: 1.5591546677256596
Energy: 1.5007667872778905
Energy: 1.5591546677241241
Energy: 1.7059520680401157
Energy: 1.2851247423596373
Energy: 1.2177759290034569
Energy: 1.2851247423627077
Energy: 1.7059520680393483
Energy: 1.2851247423627077
Energy: 1.263149973345173
Energy: 1.4284642969624535
Energy: 1.2203020794256059
Energy: 1.4284642969624535
Energy: 1.2631499733459406
Energy: 1.4284642969624535
Energy: 1.2207219398053866
Energy: 1.4335655802663885
Energy: 1.4310836757902599
Energy: 1.433565580267924
Energy: 1.2207219398053866
Energy: 1.4335655802686913
Energy: 1.448586965468011
Energy: 1.411445860882044
Energy: 1.2359822798277624
Energy: 1.411445860880509
Energy: 1.448586965468011
Energy: 1.4114458608812765
Energy: 1.4478900596874276
Energy: 1.219813924924266
Energy: 1.242880684136577
Energy: 1.2198139249234983
Energy: 1.4478900596828217
Energy: 1.219813924925801
Energy: 1.244162531897154
Energy: 1.24507588252786
Energy: 1.2241131239034782
Energy: 1.2450758825270924
Energy: 1.2441625318979217
Energy: 1.2450758825309305
Energy: 1.222670037698531
Energy: 1.4072109040293728
Energy: 1.6874044733824891
Energy: 1.407210904030908
Energy: 1.222670037698531
Energy: 1.407210904030908
Energy: 1.4687776509448551
Energy: 1.7662818991378828
Energy: 1.4605281207050567
Energy: 1.76628189913558
Energy: 1.4687776509440873
Energy: 1.7662818991363476
Energy: 1.2350767491511414
Energy: 1.4690460109330754
Energy: 1.5306910510259444
Energy: 1.4690460109315402
Energy: 1.2350767491519088
Energy: 1.4690460109606747
Energy: 1.6177217013681653
Energy: 1.3056344712762633
Energy: 1.2269769796239423
Energy: 1.305634471275496
Energy: 1.6177217014080811
Energy: 1.305634471275496
Energy: 1.226036416947403
Energy: 1.4884108853303588
Energy: 1.5694188172419754
Energy: 1.4884108853295914
Energy: 1.2260364169481708
Energy: 1.4884108853288236
Energy: 1.4665131074357987
Energy: 1.5422147671421076
Energy: 1.533780050973388
Energy: 1.5422147670400854
Energy: 1.466513107435031
Energy: 1.5422147671367343
Energy: 1.2227561846535246
Energy: 1.6191040330896325
Energy: 1.705837361656017
Energy: 1.6191040330973085
Energy: 1.2227561846535246
Energy: 1.6191040330904

minimum gb energy = 1.217188122090265 eV
minimum distance =  2.18666469434063 Angstroms
sigma value = 41


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

Energy: 1.0843932732728012
Energy: 1.0549009375494154
Energy: 1.7531808764608836
Energy: 1.054900937553607
Energy: 1.0843932732665134
Energy: 1.054900937553607
Energy: 1.614694771141612
Energy: 1.0582231166542255
Energy: 1.0515726543071084
Energy: 1.0582231166500338
Energy: 1.614694771141612
Energy: 1.0582231166500338
Energy: 1.0850978069807857
Energy: 1.23384959277989
Energy: 1.0532925819501162
Energy: 1.2338495927819857
Energy: 1.0850978069870731
Energy: 1.2338495927819857
Energy: 1.6474348639827554
Energy: 1.0570564979460662
Energy: 1.051593464835414
Energy: 1.0570564979460662
Energy: 1.6474348639827554
Energy: 1.0570564979460662
Energy: 1.0822764978900339
Energy: 1.441835346532853
Energy: 1.0539710867970584
Energy: 1.4418353465370448
Energy: 1.0822764978942254
Energy: 1.4418353465370448
Energy: 1.0802560557885441
Energy: 1.088914854936509
Energy: 1.0515024953489
Energy: 1.088914854936509
Energy: 1.0802560954487823
Energy: 1.088914854936509
Energy: 1.6441771472803626
Energy: 1.0584153569341204
Energy: 1.0556070577908108
Energy: 1.0584153569341204
Energy: 1.6441771472803626
Energy: 1.0584153569341204
Energy: 1.0865458245624604
Energy: 1.05548510860571
Energy: 1.0522949551600174
Energy: 1.0554851086078054
Energy: 1.0865458245603647
Energy: 1.0554851086078054
Energy: 1.5862645244375522
Energy: 1.092662570867977
Energy: 1.0571437052522905
Energy: 1.0926625708721687
Energy: 1.5862645244396478
Energy: 1.0926625708721687
Energy: 1.0867998248762405
Energy: 1.4398200771543834
Energy: 1.0565434629518622
Energy: 1.4398200771522875
Energy: 1.0867998248783362
Energy: 1.4398200771543834
Energy: 1.6024657755894935
Energy: 1.0553197045614788
Energy: 1.0586800297693708
Energy: 1.055319704557287
Energy: 1.6024657755915892
Energy: 1.055319704557287
Energy: 1.096333028943522
Energy: 1.2293117832763198
Energy: 1.6505473880995174
Energy: 1.2293117832784157
Energy: 1.096333028943522
Energy: 1.2293117832763198
Energy: 1.6024870333032037
Energy: 1.0552686543986722
Energy: 1.0587030972991571
Energy: 1.0552686543944805
Energy: 1.6024870333032037
Energy: 1.0552686543944805
Energy: 1.0867789361230433
Energy: 1.4402237456058948
Energy: 1.0565933224483899
Energy: 1.4402237456037987
Energy: 1.0867789361188516
Energy: 1.4402237456058948

minimum gb energy = 1.0515024953489 eV
minimum distance =  2.21525223140952 Angstroms
sigma value = 11


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

Energy: 1.5827294087929364
Energy: 1.27122896632558
Energy: 1.66276199109799
Energy: 1.2712289663237386
Energy: 1.5827294087929364
Energy: 1.27122896632558
Energy: 1.5332853150876935
Energy: 1.5757108886082485
Energy: 1.2541066199598714
Energy: 1.5757108886064068
Energy: 1.533285315086773
Energy: 1.5757108886054862
Energy: 1.2561545043069438
Energy: 1.3735419577704222
Energy: 1.2585097900223792
Energy: 1.373541957771343
Energy: 1.2561545043078644
Energy: 1.3735419577704222
Energy: 1.2743130194801393
Energy: 1.277901300331375
Energy: 1.2565595894083195
Energy: 1.277901300331375
Energy: 1.2743130194819805
Energy: 1.277901300331375
Energy: 1.4882318805374641
Energy: 1.451111043522022
Energy: 1.273112536763755
Energy: 1.4511110435229428
Energy: 1.4882318805374641
Energy: 1.4511110435229428
Energy: 1.2914039957032422
Energy: 1.478925047670155
Energy: 1.4731399265881278
Energy: 1.4789250476692342
Energy: 1.2914039957050836
Energy: 1.4789250476683138
Energy: 1.277602384738902
Energy: 1.5237644485690804
Energy: 1.31252472013688
Energy: 1.5237644485663182
Energy: 1.2776023847352194
Energy: 1.5237644485690804
Energy: 1.2563299709311868
Energy: 1.281654728272691
Energy: 1.3978101027157979
Energy: 1.281654728272691
Energy: 1.2563299709311868
Energy: 1.28165472827177
Energy: 1.5428864631225756
Energy: 1.336674602726155
Energy: 1.2573657928724369
Energy: 1.3366746027279963
Energy: 1.5428864631225756
Energy: 1.3366746027270757
Energy: 1.2579700983780775
Energy: 1.4574573751855242
Energy: 1.3536907535477705
Energy: 1.4574573751873658
Energy: 1.2579700983780775
Energy: 1.4574573751873658
Energy: 1.4261761239978636
Energy: 1.5960516736025745
Energy: 1.5431648497938826
Energy: 1.5960516736044157
Energy: 1.4261761239969428
Energy: 1.5960516736044157
Energy: 1.2560482142153022
Energy: 1.4829823408629343
Energy: 1.4801133890831257
Energy: 1.4829823408629343
Energy: 1.2560482142125402
Energy: 1.4829823408629343
Energy: 1.2558994377739552
Energy: 1.3713898132549707
Energy: 1.372309911681229
Energy: 1.3713898132577327
Energy: 1.2558994377739552
Energy: 1.3713898132577327
Energy: 1.2723388718521298
Energy: 1.3421192460133349
Energy: 1.2720727945495254
Energy: 1.3421192460133349
Energy: 1.2723388718530506
Energy: 1.3421192460133349
Energy: 1.2546231824224074
Energy: 1.5208651219199685
Energy: 1.4731102342441227
Energy: 1.5208651219190477
Energy: 1.2546231824224074
Energy: 1.5208651219199685
Energy: 1.6090626872483438
Energy: 1.5513986789733578
Energy: 1.2926900351432662
Energy: 1.551398678971516
Energy: 1.6090626872474232
Energy: 1.551398678972437
Energy: 1.3124450135093084
Energy: 1.524510410196086
Energy: 1.4381889055065944
Energy: 1.5245104101979274
Energy: 1.3124450135083878
Energy: 1.5245104101988478
Energy: 1.473087047106188
Energy: 1.5206946804394146
Energy: 1.2561990804760257
Energy: 1.5206946804394146
Energy: 1.4730870471052673
Energy: 1.5206946804394146
Energy: 1.2719313372472303
Energy: 1.3716975845381454
Energy: 1.269937251585418
Energy: 1.3716975845427488
Energy: 1.271931337248151
Energy: 1.3716975845427488
Energy: 1.2590782008709656
Energy: 1.3725037538858296
Energy: 1.2544506180394703
Energy: 1.3725037538876501
Energy: 1.2590782008718866
Energy: 1.3725037538867504
Energy: 1.4706742240712816
Energy: 1.3972760905574
Energy: 1.2548554697709677
Energy: 1.3972760904626114
Energy: 1.4706742240740436
Energy: 1.3972760905951271
Energy: 1.533513271933314
Energy: 1.5975977564830208
Energy: 1.4824493928192775
Energy: 1.5975977564784172
Energy: 1.5335132719250486
Energy: 1.597597756479338
Energy: 1.270592924210798
Energy: 1.4574474634198724
Energy: 1.2787000932531756
Energy: 1.4574474634207932
Energy: 1.2705929242135603
Energy: 1.4574474634198724
Energy: 1.2564802231565586
Energy: 1.3421325348750217
Energy: 1.5438353872458541
Energy: 1.3421325348731805
Energy: 1.2564802231602414
Energy: 1.3421325348731805
Energy: 1.2553219052805833
Energy: 1.2806174731239328
Energy: 1.255650866577051
Energy: 1.2806174731248536
Energy: 1.255321905275059
Energy: 1.2806174731248536
Energy: 1.2912864201241387
Energy: 1.4385157701211784
Energy: 1.2767715584473656
Energy: 1.4385157701220992
Energy: 1.2912864201250596
Energy: 1.4385157701202578
Energy: 1.4736129581828743
Energy: 1.4815253479360957
Energy: 1.4877284331094964
Energy: 1.4815253479379162
Energy: 1.4736129581837745
Energy: 1.4815253479342543
Energy: 1.2712824977561017
Energy: 1.440488265627506
Energy: 1.2915605739239275
Energy: 1.4404882656284268
Energy: 1.2712824977570223
Energy: 1.440488265627506
Energy: 1.2590995952985775
Energy: 1.2790851606061542
Energy: 1.2745106309834675
Energy: 1.2790851606043336
Energy: 1.259099595299498
Energy: 1.2790851606043336
Energy: 1.259998495098982
Energy: 1.3735319843592104
Energy: 1.2569209089863551
Energy: 1.3735319843592104
Energy: 1.259998495098982
Energy: 1.3735319843592104
Energy: 1.2584893518658162
Energy: 1.5747748372781982
Energy: 1.6154534820892088
Energy: 1.5747748372781982
Energy: 1.2584893518667368
Energy: 1.5747748372772776

minimum gb energy = 1.2541066199598714 eV
minimum distance =  2.19087743134935 Angstroms
sigma value = 57


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

Energy: 1.3664015697734926
Energy: 1.3548460614158064
Energy: 1.8049754882607087
Energy: 1.3548460614158064
Energy: 1.3664015697734926
Energy: 1.3548460614158064
Energy: 1.3228942518296525
Energy: 1.44878661515742
Energy: 1.3111200951838633
Energy: 1.3591507084027845
Energy: 1.3228942518280142
Energy: 1.3345552127358482
Energy: 1.3131100508845315
Energy: 1.3603503719547163
Energy: 1.3116406473040796
Energy: 1.3603503719547163
Energy: 1.313110050868148
Energy: 1.3603503719547163
Energy: 1.3120250070457429
Energy: 1.3498163509140955
Energy: 1.3125736774629309
Energy: 1.3899207882882212
Energy: 1.3120250070457429
Energy: 1.4593989775284655
Energy: 1.3116060455377812
Energy: 1.3602830463079496
Energy: 1.3125021206370002
Energy: 1.3602830463079496
Energy: 1.3116060455361427
Energy: 1.3602830463079496
Energy: 1.3174115358493501
Energy: 1.3346583455877645
Energy: 1.3226811021972824
Energy: 1.3346583455877645
Energy: 1.3174115358493501
Energy: 1.334658345589403
Energy: 1.8049754882590703
Energy: 1.3548460614142053
Energy: 1.3664015697734926
Energy: 1.3548460614142053
Energy: 1.8049754882590703
Energy: 1.3548460614142053
Energy: 1.3111200951855015
Energy: 1.359150708404423
Energy: 1.3228942518263758
Energy: 1.3591507084027845
Energy: 1.3111200951855015
Energy: 1.3591507084027845
Energy: 1.311640647305718
Energy: 1.3603503719547163
Energy: 1.3131100508894467
Energy: 1.3603503719547163
Energy: 1.311640647305718
Energy: 1.3603503719547163
Energy: 1.3125736774629309
Energy: 1.389920786721009
Energy: 1.3120250070424662
Energy: 1.3899207864901106
Energy: 1.3125736774612926
Energy: 1.3844547138182215
Energy: 1.3125021206370002
Energy: 1.3602830463079496
Energy: 1.3116060455361427
Energy: 1.3602830463079496
Energy: 1.3125021206353618
Energy: 1.3602830463063111
Energy: 1.3226811021972824
Energy: 1.3346583455910415
Energy: 1.3174115358509886
Energy: 1.334658345589403
Energy: 1.3226811021972824
Energy: 1.3346583455910415
Energy: 1.3664015697734926
Energy: 1.3548460614158064
Energy: 1.61531233096252
Energy: 1.3548460614142053
Energy: 1.3664015697751308
Energy: 1.3548460614158064
Energy: 1.3228942518296525
Energy: 1.3591507084027845
Energy: 1.3111200951855015
Energy: 1.3591507084027845
Energy: 1.3228942518296525
Energy: 1.3591507084027845
Energy: 1.3131100509107456
Energy: 1.3603503719547163
Energy: 1.311640647305718
Energy: 1.3603503719563543
Energy: 1.3131100509009155
Energy: 1.3603503719563543
Energy: 1.3120250070441046
Energy: 1.3844547154362232
Energy: 1.3125736774629309
Energy: 1.3844547155328497
Energy: 1.3120250070441046
Energy: 1.3899207845019865
Energy: 1.3116060455361427
Energy: 1.3602830463079496
Energy: 1.3125021206370002
Energy: 1.3602830463079496
Energy: 1.3116060455361427
Energy: 1.3602830463079496

minimum gb energy = 1.3111200951838633 eV
minimum distance =  2.2227937544318 Angstroms
sigma value = 9


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

Energy: 1.4632756836557381
Energy: 1.4304384658911133
Energy: 1.566475091008866
Energy: 1.4304384658951261
Energy: 1.4632756836570757
Energy: 1.4304384658951261
Energy: 1.371268819852424
Energy: 1.4373499382138826
Energy: 1.3452523874930262
Energy: 1.4373499382178958
Energy: 1.371268819852424
Energy: 1.4373499382152204
Energy: 1.3493778771209723
Energy: 1.407707473660581
Energy: 1.3468813730928706
Energy: 1.4077074736632564
Energy: 1.3493778771236475
Energy: 1.4077074736645943
Energy: 1.349412034405509
Energy: 1.3377342665573524
Energy: 1.37665264631147
Energy: 1.3377342665533396
Energy: 1.349412034405509
Energy: 1.3377342665533396
Energy: 1.3704613528593665
Energy: 1.4318144476442634
Energy: 1.3479568443937997
Energy: 1.4318144476389125
Energy: 1.3704613528567215
Energy: 1.4318144476389125
Energy: 1.3488430596774166
Energy: 1.3644105427364652
Energy: 1.5650081457833203
Energy: 1.3644105427351274
Energy: 1.348843059676079
Energy: 1.3644105427351274
Energy: 1.3517985567615702
Energy: 1.4085938871673678
Energy: 1.3485473619404245
Energy: 1.4085938871687056
Energy: 1.351798556762908
Energy: 1.4085938871687056
Energy: 1.3979473346264677
Energy: 1.4768061719878052
Energy: 1.3455855893052031
Energy: 1.4768061719891428
Energy: 1.3979473346278057
Energy: 1.4768061719864674
Energy: 1.397676745304247
Energy: 1.4050113958120694
Energy: 1.3532368551697365
Energy: 1.405011395806749
Energy: 1.397676745304247
Energy: 1.405011395806749
Energy: 1.3510496792111562
Energy: 1.4472427498832574
Energy: 1.3632458176646187
Energy: 1.4472427498819502
Energy: 1.351049679216507
Energy: 1.4472427498819502
Energy: 1.351648895921008
Energy: 1.3516810833009012
Energy: 1.346239103947359
Energy: 1.3516810832995636
Energy: 1.351648895921008
Energy: 1.3516810832995636
Energy: 1.3484794599207461
Energy: 1.4081281499611074
Energy: 1.4104247416361706
Energy: 1.4081281499664278
Energy: 1.3484794599207461
Energy: 1.4081281499664278
Energy: 1.3508111876535724
Energy: 1.4097070823670492
Energy: 1.4008431996501534
Energy: 1.4097070823643738
Energy: 1.3508111876535724
Energy: 1.4097070823657118
Energy: 1.348423500177967
Energy: 1.377283459133839
Energy: 1.35122850996875
Energy: 1.377283459128488
Energy: 1.3484235001793048
Energy: 1.377283459128488
Energy: 1.5376062549281462
Energy: 1.446784729791035
Energy: 1.360927791993277
Energy: 1.4467847297937104
Energy: 1.5376062549281462
Energy: 1.4467847297950482
Energy: 1.3976241995878729
Energy: 1.4050328427758103
Energy: 1.3849548412315684
Energy: 1.4050328427811611
Energy: 1.3976241995878729
Energy: 1.4050328427811611
Energy: 1.4034990103158047
Energy: 1.404661014792816
Energy: 1.3777909677315943
Energy: 1.4046610147888028
Energy: 1.403499010314467
Energy: 1.4046610147901406
Energy: 1.4383094907627672
Energy: 1.4450755903219867
Energy: 1.3628345546158573
Energy: 1.4450755903206487
Energy: 1.4383094907627672
Energy: 1.4450755903206487
Energy: 1.3512021376869998
Energy: 1.339513462638111
Energy: 1.3533687144457933
Energy: 1.3395134626340979
Energy: 1.3512021376883374
Energy: 1.3395134626340979
Energy: 1.349352442419485
Energy: 1.4305120327013645
Energy: 1.3465959943223085
Energy: 1.4305120327040397
Energy: 1.3493524424208228
Energy: 1.4305120327040397
Energy: 1.3511697488975407
Energy: 1.3388684358811425
Energy: 1.3806892171809089
Energy: 1.3388684358851557
Energy: 1.351169748896203
Energy: 1.3388684358838177

minimum gb energy = 1.3377342665533396 eV
minimum distance =  2.22358182362712 Angstroms
sigma value = 27


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

Energy: 1.5112915192993321
Energy: 1.5735517894429412
Energy: 1.5355942888722178
Energy: 1.573551789444069
Energy: 1.5112915192982044
Energy: 1.573551789444069
Energy: 1.4211237096380422
Energy: 1.429907774162302
Energy: 1.3791401605388542
Energy: 1.4299077741645574
Energy: 1.4211237096380422
Energy: 1.4299077741690678
Energy: 1.3451981512365918
Energy: 1.4540165291086384
Energy: 1.3789532057147273
Energy: 1.4540165291210165
Energy: 1.3451981512365918
Energy: 1.4540165291176337
Energy: 1.3780429009543222
Energy: 1.3884492152091181
Energy: 1.4092916016795274
Energy: 1.3884492152068628
Energy: 1.37804290095545
Energy: 1.3884492152057353
Energy: 1.317897063396751
Energy: 1.4137108635820406
Energy: 1.3434397656243837
Energy: 1.4137108635865512
Energy: 1.317897063396751
Energy: 1.4137108635854234
Energy: 1.3710165246155757
Energy: 1.3592873856512573
Energy: 1.3584282459206711
Energy: 1.3592873856512573
Energy: 1.3710165246155757
Energy: 1.3592873856501297
Energy: 1.3520824873401949
Energy: 1.3754032552234938
Energy: 1.3655084637431374
Energy: 1.375403255225749
Energy: 1.3520824873390673
Energy: 1.3754032552246216
Energy: 1.3488308733079355
Energy: 1.410512492768925
Energy: 1.366059839706795
Energy: 1.4105124927711803
Energy: 1.3488308733079355
Energy: 1.4105124927711803
Energy: 1.4425319958068497
Energy: 1.3966408364846
Energy: 1.5539687920242717
Energy: 1.396640836486855
Energy: 1.4425319958057221
Energy: 1.396640836486855
Energy: 1.3639157962237196
Energy: 1.4818868038549178
Energy: 1.3986381821741487
Energy: 1.481886803162877
Energy: 1.363915796222592
Energy: 1.4818868019106477
Energy: 1.3490559183727595
Energy: 1.4414387272251672
Energy: 1.3985568626121205
Energy: 1.4414387272229119
Energy: 1.3490559183727595
Energy: 1.4414387272229119
Energy: 1.4424775056688108
Energy: 1.396409317342468
Energy: 1.3564720168128774
Energy: 1.3964093173458507
Energy: 1.442477505667683
Energy: 1.3964093173458507
Energy: 1.3643783809303547
Energy: 1.4849711387740019
Energy: 1.3655145958710508
Energy: 1.4849711387751297
Energy: 1.3643783809303547
Energy: 1.4849711387751297
Energy: 1.3494360966231802
Energy: 1.4280840054508863
Energy: 1.3661446484561257
Energy: 1.4280840054553967
Energy: 1.3494360966231802
Energy: 1.4280840054553967
Energy: 1.3775472236539388
Energy: 1.3602038593315777
Energy: 1.3584207803311863
Energy: 1.3602038593338328
Energy: 1.3775472236550665
Energy: 1.3602038593338328
Energy: 1.317714361999728
Energy: 1.4137108635854234
Energy: 1.3429695750355615
Energy: 1.4137108635854234
Energy: 1.3177143619986003
Energy: 1.4137108635888065
Energy: 1.3779616200406386
Energy: 1.3885342897247395
Energy: 1.3287540797986608
Energy: 1.3885342897281223
Energy: 1.3779616200417664
Energy: 1.3885342897281223
Energy: 1.3448907021364154
Energy: 1.4596795706710224
Energy: 1.3791391699937505
Energy: 1.4596795706744055
Energy: 1.3448907021364154
Energy: 1.459679570673278
Energy: 1.385043976889315
Energy: 1.5557522778991442
Energy: 1.3791872687353224
Energy: 1.5557522779013737
Energy: 1.385043976889315
Energy: 1.555752277903629
Energy: 1.5112915193004597
Energy: 1.5735517894418136
Energy: 1.5350685051280333
Energy: 1.5735517894462985
Energy: 1.5112915193004597
Energy: 1.5735517894462985
Energy: 1.4211237096380422
Energy: 1.4299077741634298
Energy: 1.3791401605399816
Energy: 1.4299077741656852
Energy: 1.421123709636915
Energy: 1.4299077741690678
Energy: 1.345198151234337
Energy: 1.454016529090597
Energy: 1.3789532057158551
Energy: 1.4540165291187612
Energy: 1.3451981512354647
Energy: 1.4540165291243994
Energy: 1.3780429009531945
Energy: 1.3884492152057353
Energy: 1.4092916016806551
Energy: 1.38844921520348
Energy: 1.3780429009543222
Energy: 1.38844921520348
Energy: 1.317897063396751
Energy: 1.4137108635820406
Energy: 1.3434397656266388
Energy: 1.4137108635854234
Energy: 1.317897063396751
Energy: 1.4137108635854234
Energy: 1.3710165246133204
Energy: 1.3592873856490022
Energy: 1.3584282459229262
Energy: 1.3592873856512573
Energy: 1.371016524614448
Energy: 1.3592873856501297

minimum gb energy = 1.3177143619986003 eV
minimum distance =  2.22475532664769 Angstroms
sigma value = 19


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

Energy: 1.4701415065013144
Energy: 1.2715802384629025
Energy: 1.3749677984715614
Energy: 1.2715802384658226
Energy: 1.4701415065013144
Energy: 1.2715802384677692
Energy: 1.274328229605734
Energy: 1.3985961697603904
Energy: 1.2561408951074338
Energy: 1.3985961697642835
Energy: 1.2743282296047607
Energy: 1.398596169762337
Energy: 1.272463120451948
Energy: 1.3469006768213756
Energy: 1.256390185649628
Energy: 1.3469006768213756
Energy: 1.2724631204509749
Energy: 1.3469006768213756
Energy: 1.3199519682717697
Energy: 1.3757982732072154
Energy: 1.2963221573954393
Energy: 1.3757982732081886
Energy: 1.319951968269823
Energy: 1.3757982732081886
Energy: 1.2852070439551775
Energy: 1.305670711688856
Energy: 1.3011825423628787
Energy: 1.3056707116898292
Energy: 1.2852070439561507
Energy: 1.3056707116898292
Energy: 1.2746472718902508
Energy: 1.3580157856841022
Energy: 1.2997409831545272
Energy: 1.358015785681182
Energy: 1.2746472718902508
Energy: 1.3580157856802089
Energy: 1.2937726025876541
Energy: 1.3685298487691386
Energy: 1.2950511394821969
Energy: 1.3685298487681654
Energy: 1.2937726025886274
Energy: 1.3685298487681654
Energy: 1.2851515164560139
Energy: 1.3049159108621822
Energy: 1.3005400177893134
Energy: 1.3049159108592623
Energy: 1.2851515164560139
Energy: 1.3049159108592623
Energy: 1.2935188255144245
Energy: 1.3580201522074118
Energy: 1.3459504806772513
Energy: 1.3580201522054651
Energy: 1.293518825513451
Energy: 1.3580201522044917
Energy: 1.284832844412849
Energy: 1.3783040348255369
Energy: 1.2564577098926706
Energy: 1.3783040348294302
Energy: 1.2848328444118757
Energy: 1.3783040348284568
Energy: 1.283592611415497
Energy: 1.3606632049398228
Energy: 1.2571261787722579
Energy: 1.3606632049417695
Energy: 1.283592611415497
Energy: 1.3606632049417695
Energy: 1.299369414310293
Energy: 1.4548252980010583
Energy: 1.256917564250405
Energy: 1.4548252979971652
Energy: 1.299369414310293
Energy: 1.4548252979971652
Energy: 1.2990122508530062
Energy: 1.4551029049409465
Energy: 1.2564082741496747
Energy: 1.455102905004191
Energy: 1.299012250852033
Energy: 1.455102904966231
Energy: 1.2722353381959948
Energy: 1.361098373204988
Energy: 1.3707029973340348
Energy: 1.3610983732040147
Energy: 1.2722353381959948
Energy: 1.361098373204988
Energy: 1.2934287335029828
Energy: 1.3753911208864433
Energy: 1.256738065236858
Energy: 1.3753911208883902
Energy: 1.2934287335029828
Energy: 1.3753911208883902
Energy: 1.2919254839160734
Energy: 1.3047984346880679
Energy: 1.2582893379465676
Energy: 1.3047984346900148
Energy: 1.2919254839160734
Energy: 1.3047984346880679
Energy: 1.2724542492062314
Energy: 1.3042778669978388
Energy: 1.2580336883417693
Energy: 1.3042778670007587
Energy: 1.2724542492052577
Energy: 1.3042778669997852
Energy: 1.2919775516816532
Energy: 1.4457410231711638
Energy: 1.2564314941307693
Energy: 1.4457410231731105
Energy: 1.2919775516816532
Energy: 1.4457410231731105
Energy: 1.2724127176468447
Energy: 1.3042448609762505
Energy: 1.258043101012696
Energy: 1.3042448609762505
Energy: 1.2724127176468447
Energy: 1.3042448609762505
Energy: 1.2919330214957334
Energy: 1.3048136032763455
Energy: 1.2582595092478026
Energy: 1.3048136032763455
Energy: 1.2919330214957334
Energy: 1.304813603274399
Energy: 1.2935468954978198
Energy: 1.3761565001102856
Energy: 1.2576643609635305
Energy: 1.3761565001093121
Energy: 1.2935468954978198
Energy: 1.376156500108339
Energy: 1.2720755489186812
Energy: 1.361316665241772
Energy: 1.3706696384380725
Energy: 1.3613166652408208
Energy: 1.2720755489177078
Energy: 1.361316665241772
Energy: 1.298933344301887
Energy: 1.4545966726845216
Energy: 1.256205251213848
Energy: 1.4545966380063113
Energy: 1.298933344301887
Energy: 1.454596651686335
Energy: 1.2990555650825917
Energy: 1.4548889987493296
Energy: 1.2571901524338256
Energy: 1.4548889987493296
Energy: 1.2990555650816185
Energy: 1.454888998756143
Energy: 1.283565437422548
Energy: 1.3602431130568864
Energy: 1.296485053658452
Energy: 1.3602431130539663
Energy: 1.2835654374235215
Energy: 1.3602431130549395
Energy: 1.2846184593382477
Energy: 1.3782730549823947
Energy: 1.2564569093811173
Energy: 1.3782730549853146
Energy: 1.2846184593372745
Energy: 1.3782730549853146
Energy: 1.293587229304875
Energy: 1.3580896757115888
Energy: 1.3098671477011057
Energy: 1.3580896757106153
Energy: 1.2935872293077948
Energy: 1.3580896757115888
Energy: 1.285075754920466
Energy: 1.3050625776314095
Energy: 1.3006265463749986
Energy: 1.3050625776343296
Energy: 1.285075754920466
Energy: 1.3050625776343296
Energy: 1.293929399326853
Energy: 1.368529848770112
Energy: 1.2950782473711506
Energy: 1.3685298487691386
Energy: 1.2939293993278262
Energy: 1.3685298487681654

minimum gb energy = 1.2561408951074338 eV
minimum distance =  2.21873451521323 Angstroms
sigma value = 101


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

Energy: 1.4516479272634508
Energy: 1.3275259285964223
Energy: 1.411105293911532
Energy: 1.327525928597278
Energy: 1.4516479272625948
Energy: 1.3275259285964223
Energy: 1.2340904180657817
Energy: 1.329739929837413
Energy: 1.2335051537196973
Energy: 1.3297399298408357
Energy: 1.234090418064926
Energy: 1.3297399298408357
Energy: 1.2181209202711503
Energy: 1.3364905885734708
Energy: 1.2596521334888522
Energy: 1.3364905885734708
Energy: 1.2181209202711503
Energy: 1.3364905885734708
Energy: 1.2523781065139912
Energy: 1.3261480078848487
Energy: 1.2408808265503835
Energy: 1.3495177750526501
Energy: 1.2523781065139912
Energy: 1.2944762947392594
Energy: 1.2069605067532627
Energy: 1.2773898562012156
Energy: 1.230711917845397
Energy: 1.2773898562012156
Energy: 1.2069605067541187
Energy: 1.2773898562012156
Energy: 1.2210055750149453
Energy: 1.3412041090415956
Energy: 1.2060440579171903
Energy: 1.3412041090424511
Energy: 1.2210055750140896
Energy: 1.3412041090424511
Energy: 1.2183269657658797
Energy: 1.3483450414294524
Energy: 1.206894927344306
Energy: 1.3483450414277414
Energy: 1.2183269657658797
Energy: 1.3483450414294524
Energy: 1.2177943222739875
Energy: 1.3074829774900392
Energy: 1.2179880011062865
Energy: 1.3294259094542449
Energy: 1.2177943222731322
Energy: 1.307482977490895
Energy: 1.2064363249532228
Energy: 1.3144411287611926
Energy: 1.2185692966251633
Energy: 1.3144411287611926
Energy: 1.2064363249540786
Energy: 1.3144411287620479
Energy: 1.2064258150813094
Energy: 1.303191855270815
Energy: 1.2070377895393156
Energy: 1.3031918552691035
Energy: 1.2064258150813094
Energy: 1.303191855270815
Energy: 1.2422926396649876
Energy: 1.292301150880771
Energy: 1.2863290916797125
Energy: 1.292301150883338
Energy: 1.242292639664132
Energy: 1.292301150883338
Energy: 1.2333850204033994
Energy: 1.3350054553349577
Energy: 1.2059704252831163
Energy: 1.3350054553349577
Energy: 1.233385020402544
Energy: 1.3350054553358135
Energy: 1.235047973334439
Energy: 1.3365203139491673
Energy: 1.2522408822127133
Energy: 1.3365203139491673
Energy: 1.2350479733352946
Energy: 1.3365203139491673
Energy: 1.2584102753923645
Energy: 1.2772037544820274
Energy: 1.2341380216252824
Energy: 1.2871717002417886
Energy: 1.25841027539322
Energy: 1.277203754463204
Energy: 1.2160391474648513
Energy: 1.5181417105036226
Energy: 1.2335240479303948
Energy: 1.5181417105036226
Energy: 1.2160391474648513
Energy: 1.5181417105036226
Energy: 1.2779212880952235
Energy: 1.3359673312453648
Energy: 1.2173736059203653
Energy: 1.3359673312436537
Energy: 1.2779212880943678
Energy: 1.3359673312453648
Energy: 1.207253723246427
Energy: 1.345078321476299
Energy: 1.2513409289372095
Energy: 1.3450783214839996
Energy: 1.2072537232455716
Energy: 1.3450783214865665
Energy: 1.2178764034165495
Energy: 1.2774942049401583
Energy: 1.2060013474540896
Energy: 1.2774942049418696
Energy: 1.2178764034156937
Energy: 1.2774942049401583
Energy: 1.2163707242305837
Energy: 1.3010543117870865
Energy: 1.2190590784602946
Energy: 1.3010543117845197
Energy: 1.2163707242297281
Energy: 1.3010543117853752
Energy: 1.2067451245023297
Energy: 1.423457367711334
Energy: 1.2065840570661428
Energy: 1.423457367710478
Energy: 1.2067451245023297
Energy: 1.423457367710478
Energy: 1.228998990970367
Energy: 1.2766515334081783
Energy: 1.2184750565831073
Energy: 1.2766515334081783
Energy: 1.2289989909695114
Energy: 1.2766515334073225
Energy: 1.2060735579729387
Energy: 1.3001353381039265
Energy: 1.206152017275053
Energy: 1.3001353381099159
Energy: 1.2060735579737942
Energy: 1.3001353381013598
Energy: 1.218628994704131
Energy: 1.3018039675457482
Energy: 1.2066544592689747
Energy: 1.3018039675457482
Energy: 1.218628994704131
Energy: 1.3018039675457482
Energy: 1.252226417437605
Energy: 1.3721794048591955
Energy: 1.2655216819982469
Energy: 1.3721794048591955
Energy: 1.2522264174384605
Energy: 1.3721794048591955
Energy: 1.20675192067004
Energy: 1.449114873468566
Energy: 1.2161427957604585
Energy: 1.4491148734694217
Energy: 1.20675192067004
Energy: 1.4491148734694217
Energy: 1.2324195352002296
Energy: 1.3355052430305578
Energy: 1.2781659935179541
Energy: 1.335505243034836
Energy: 1.2324195352002296
Energy: 1.335505243034836
Energy: 1.2343398393204095
Energy: 1.3987728773398695
Energy: 1.206406249530753
Energy: 1.3987728773415808
Energy: 1.2343398393204095
Energy: 1.3987728773398695
Energy: 1.2344070637416455
Energy: 1.5291602085021896
Energy: 1.2067179304812223
Energy: 1.529160208503045
Energy: 1.234407063739934
Energy: 1.529160208503045
Energy: 1.3229844676000218
Energy: 1.408990718555609
Energy: 1.310952630839488
Energy: 1.408990718555609
Energy: 1.3229844676000218
Energy: 1.408990718555609
Energy: 1.2061755323571255
Energy: 1.3763208311108766
Energy: 1.2065657322954304
Energy: 1.3763208311125879
Energy: 1.2061755323579815
Energy: 1.376320831111732
Energy: 1.2514400770866925
Energy: 1.3458385697905906
Energy: 1.2190911208517714
Energy: 1.3458385697905906
Energy: 1.2514400770858367
Energy: 1.345838569791446
Energy: 1.2326276517403967
Energy: 1.3012521544169444
Energy: 1.2059299806725006
Energy: 1.3012521544169444
Energy: 1.2326276517403967
Energy: 1.3012521544178
Energy: 1.206705140293155
Energy: 1.3212259595143971
Energy: 1.2181504712883866
Energy: 1.3212259595118305
Energy: 1.2067051402940105
Energy: 1.3212259595118305

minimum gb energy = 1.2059299806725006 eV
minimum distance =  2.22509567591494 Angstroms
sigma value = 33


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

Energy: 0.014457189997228998
Energy: 0.015109301636644014
Energy: 1.3542526258256242
Energy: 0.015109301637315416
Energy: 0.014457189996557596
Energy: 0.015109301635933114
Energy: 0.014605422223166752
Energy: 0.6565046462545021
Energy: 0.014605422223166752
Energy: 0.6565046462545021
Energy: 0.014605422223166752
Energy: 0.656504646248262
Energy: 1.3542526258263354
Energy: 0.015109301635933114
Energy: 0.014457189997228998
Energy: 0.015109301636644014
Energy: 1.3542526258270462
Energy: 0.015109301636644014
Energy: 0.01460542222387765
Energy: 0.656504646248262
Energy: 0.014605422223166752
Energy: 0.6565046462545021
Energy: 0.014605422223166752
Energy: 0.6565046462572667

minimum gb energy = 0.014457189996557596 eV
minimum distance =  2.4118258578211 Angstroms
sigma value = 1