Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.633016772568226
cohesive_energy=4.280573320677608
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: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 1.5846919506053516
Energy: 0.4179153791297454
Energy: 1.5846919506053516
Energy: 0.4179153791294348
Energy: 1.5846919506053516
Energy: 0.4179153791294348
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 0.016407731727709776
Energy: 1.5846919506047306
Energy: 1.5846919506053516
Energy: 0.4179153791294348
Energy: 1.5846919506050412
Energy: 0.4179153791291244
Energy: 1.5846919506053516
Energy: 0.4179153791294348
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 0.016407731727709776
Energy: 1.5846919506053516
Energy: 1.5846919506053516
Energy: 0.4179153791294348
Energy: 1.5846919506050412
Energy: 0.4179153791300559
Energy: 1.5846919506053516
Energy: 0.4179153791294348

minimum gb energy = 0.016407731727709776 eV
minimum distance =  2.53364583066134 Angstroms
sigma value = 1


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

Energy: 1.6980658022994073
Energy: 1.5402984130427066
Energy: 1.698065802300155
Energy: 1.5402984130434543
Energy: 1.6980658023009023
Energy: 1.5402984130427066
Energy: 1.8825448116325842
Energy: 1.4103790637794213
Energy: 1.8825448116258572
Energy: 1.4103790637794213
Energy: 1.8825448116310892
Energy: 1.4103790637794213
Energy: 1.6595263059894354
Energy: 1.6515242060117425
Energy: 1.65952630599093
Energy: 1.6515242060139845
Energy: 1.6595263059901826
Energy: 1.6515242060124902
Energy: 1.7902264476590577
Energy: 1.5142885744540464
Energy: 1.790226447659805
Energy: 1.5142885744540464
Energy: 1.7902264476590577
Energy: 1.5142885744540464
Energy: 1.5984320667521226
Energy: 1.7546885767326579
Energy: 1.5984320667521226
Energy: 1.7546885767326579
Energy: 1.5984320667506278
Energy: 1.7546885767356473
Energy: 1.7332263646173658
Energy: 1.4759278563238447
Energy: 1.7332263646151236
Energy: 1.4759278563238447
Energy: 1.7332263646166184
Energy: 1.4759278563238447
Energy: 1.500860668702256
Energy: 1.6764077577708314
Energy: 1.5008606687015087
Energy: 1.6764077577708314
Energy: 1.500860668702256
Energy: 1.6764077577738212
Energy: 1.5013375630068801
Energy: 1.7998749624971766
Energy: 1.5013375630053856
Energy: 1.7998749624986712
Energy: 1.501337563006133
Energy: 1.7998749624979238
Energy: 1.7154196823396317
Energy: 1.6765149936024089
Energy: 1.7154196823396317
Energy: 1.6765149936024089
Energy: 1.7154196823396317
Energy: 1.6765149936024089
Energy: 1.4069224779009364
Energy: 1.7995720277801979
Energy: 1.4069224778994414
Energy: 1.799572027780945
Energy: 1.4069224779001888
Energy: 1.7995720277801979
Energy: 1.6512330543539009
Energy: 1.472838316450794
Energy: 1.651233054352406
Energy: 1.472838316450794
Energy: 1.6512330543539009
Energy: 1.472838316450047
Energy: 1.3419126922760425
Energy: 1.7757462860944366
Energy: 1.3419126922745475
Energy: 1.7757462860981736
Energy: 1.3419126922760425
Energy: 1.775746286095184
Energy: 1.846949398007625
Energy: 1.3171547302424886
Energy: 1.846949398007625
Energy: 1.3171547302418094
Energy: 1.8469493980098672
Energy: 1.3171547302418094
Energy: 1.498091083830245
Energy: 1.7091032317251866
Energy: 1.4980910838294976
Energy: 1.7091032317259343
Energy: 1.4980910838294976
Energy: 1.7091032317259343
Energy: 1.8993470564556312
Energy: 1.4055476929807507
Energy: 1.8993470564601158
Energy: 1.4055476929807507
Energy: 1.8993470564556312
Energy: 1.4055476929807507
Energy: 1.8971191321252519
Energy: 1.6795537543878167
Energy: 1.8971191321259995
Energy: 1.6795537543870693
Energy: 1.8971191321252519
Energy: 1.6795537543878167
Energy: 1.660184141740065
Energy: 1.6211136775805184
Energy: 1.660184141740065
Energy: 1.621113677578276
Energy: 1.660184141742307
Energy: 1.6211136775827606
Energy: 1.6597407504366861
Energy: 1.5254778198227155
Energy: 1.6597407504389283
Energy: 1.5254778198227155
Energy: 1.6597407504381811
Energy: 1.5254778198227155
Energy: 1.465614484611804
Energy: 1.5149476006185492
Energy: 1.465614484611804
Energy: 1.5149476006185492
Energy: 1.4656144846125512
Energy: 1.5149476006178015
Energy: 1.6720245801960185
Energy: 1.4764755397772418
Energy: 1.6720245801945919
Energy: 1.4764755397772418
Energy: 1.6720245801938445
Energy: 1.4764755397802316
Energy: 1.4286098540090761
Energy: 1.8033346825295502
Energy: 1.4286098540098238
Energy: 1.8033346825317922
Energy: 1.4286098540105712
Energy: 1.8033346825355296
Energy: 1.681866286976595
Energy: 1.6733516720219412
Energy: 1.6818662869773426
Energy: 1.6733516720219412
Energy: 1.6818662869780898
Energy: 1.6733516720219412
Energy: 1.3219815053347912
Energy: 1.9239797854055933
Energy: 1.3219815053347912
Energy: 1.9239797854048457
Energy: 1.3219815053347912
Energy: 1.9239797854048457

minimum gb energy = 1.3171547302418094 eV
minimum distance =  2.33649058884808 Angstroms
sigma value = 33


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

Energy: 1.8956583262634386
Energy: 1.810394677670987
Energy: 1.7353637739816794
Energy: 1.810394677674813
Energy: 1.8956583262617386
Energy: 1.8103946776726874
Energy: 1.60876147082416
Energy: 1.5428541358239674
Energy: 1.6087614885485513
Energy: 1.5428541358214167
Energy: 1.6087614960199066
Energy: 1.5428541358243926
Energy: 1.4758832419342978
Energy: 1.3757097319630194
Energy: 1.4758832419355732
Energy: 1.3757097319719471
Energy: 1.4758832419338728
Energy: 1.3757097319830007
Energy: 1.3778524701222195
Energy: 1.8102598102533578
Energy: 1.3778524691877396
Energy: 1.8102598102533578
Energy: 1.3778524683476392
Energy: 1.8102598102529326
Energy: 1.6913419552162652
Energy: 1.4458106867759708
Energy: 1.6913419552162652
Energy: 1.4458106867678933
Energy: 1.6913419552120137
Energy: 1.4458106867564533
Energy: 1.493014269727192
Energy: 1.4757154637301564
Energy: 1.4930142697301292
Energy: 1.4757698800102677
Energy: 1.4930142697416078
Energy: 1.4757154637276055
Energy: 1.9489869454653381
Energy: 1.4501730513261
Energy: 1.9489869454636377
Energy: 1.7451876594070204
Energy: 1.948986945461087
Energy: 1.4501730364313907
Energy: 1.328152075589654
Energy: 1.5440250343385105
Energy: 1.32815207559178
Energy: 1.5440250333598553
Energy: 1.32815207559178
Energy: 1.5440250272984712
Energy: 1.4303172059651323
Energy: 1.4810021798056356
Energy: 1.4303172059625817
Energy: 1.4810021798035102
Energy: 1.4303172059663691
Energy: 1.4810021798035102
Energy: 1.4420896224618214
Energy: 1.5605732737899762
Energy: 1.4420886781752333
Energy: 1.560573267816092
Energy: 1.4420896224588455
Energy: 1.5605732614759367
Energy: 1.6811338204834712
Energy: 1.4463027412192728
Energy: 1.681133820486447
Energy: 1.4463027412167224
Energy: 1.6811338204817707
Energy: 1.4463027412171474
Energy: 1.4770901558860947
Energy: 1.587254877394992
Energy: 1.477089789662798
Energy: 1.5872548773966924
Energy: 1.4770901558890706
Energy: 1.5872548773941417
Energy: 1.4065630060900147
Energy: 1.4741735687575455
Energy: 1.4065629534509234
Energy: 1.4741735687545696
Energy: 1.4065629112744198
Energy: 1.4741735687575455
Energy: 1.739508347554374
Energy: 1.5490111798027966
Energy: 1.7395083475547992
Energy: 1.5490112100639193
Energy: 1.7395083475535238
Energy: 1.5490113403899026
Energy: 1.709393902771113
Energy: 1.541792311792827
Energy: 1.709393902766011
Energy: 1.541792311796653
Energy: 1.7093939027672864
Energy: 1.5417923117983539
Energy: 1.4760862252868028
Energy: 1.3789108625353974
Energy: 1.4760862252868028
Energy: 1.3789108625358226
Energy: 1.4760862252859526
Energy: 1.3789108625396487
Energy: 1.867793712646603
Energy: 1.425116489863095
Energy: 1.8677937126457524
Energy: 1.425116489861008
Energy: 1.8677937126427766
Energy: 1.425116489704598
Energy: 1.6907375767981176
Energy: 1.4757445797421993
Energy: 1.6907375767964559
Energy: 1.4758552943624133
Energy: 1.69073757679348
Energy: 1.4757445797413486
Energy: 1.5841028529328094
Energy: 1.5185287648424386
Energy: 1.584102852927708
Energy: 1.463933272847817
Energy: 1.5841028529264327
Energy: 1.518528764849666
Energy: 1.814492384969817
Energy: 1.7395469146611984
Energy: 1.81449238496344
Energy: 1.8194776831327548
Energy: 1.8144923849676915
Energy: 1.739546914663324
Energy: 1.329611109439926
Energy: 1.568665456496881
Energy: 1.3296111094403513
Energy: 1.5686654598509826
Energy: 1.3296111094416267
Energy: 1.5686654645359812
Energy: 1.3191122942612399
Energy: 1.4810942915951337
Energy: 1.3191122942574138
Energy: 1.4810942915938583
Energy: 1.3191122942633657
Energy: 1.4810942915925829
Energy: 1.4420251681011114
Energy: 1.5311877920084125
Energy: 1.4420272589036982
Energy: 1.5311877899121615
Energy: 1.442025168099836
Energy: 1.5311877824331537
Energy: 1.54690328506815
Energy: 1.691847226552601
Energy: 1.5469032850719762
Energy: 1.6918472265504756
Energy: 1.5469032850779278
Energy: 1.6918472265504756
Energy: 1.4760142657166344
Energy: 1.482412623915634
Energy: 1.4759143111402322
Energy: 1.4824126239147837
Energy: 1.4760142657204605
Energy: 1.4824126239169095
Energy: 1.5873936597854135
Energy: 1.5410189011298792
Energy: 1.3857833951044987
Energy: 1.541018890625281
Energy: 1.5873937119009347
Energy: 1.5410187648266496
Energy: 1.5716266892259247
Energy: 1.5951853799772786
Energy: 1.395778123617676
Energy: 1.5951853799772786
Energy: 1.571626684054343
Energy: 1.5951853799606988
Energy: 1.4757932326167706
Energy: 1.618327921300086
Energy: 1.4757932326197467
Energy: 1.618327921300086
Energy: 1.4757932326159204
Energy: 1.6183279213026371
Energy: 1.5463701463829296
Energy: 1.5425824658790643
Energy: 1.5463701881000969
Energy: 1.5425824658799145
Energy: 1.5463702075119548
Energy: 1.5425824658756633
Energy: 1.4421779663169314
Energy: 1.671142268172686
Energy: 1.4421779663135306
Energy: 1.6711422681786376
Energy: 1.4421779663143808
Energy: 1.6711422681739612
Energy: 1.690389954667344
Energy: 1.4812586590500993
Energy: 1.6903899546762717
Energy: 1.481235331139619
Energy: 1.6903899546788226
Energy: 1.4812586590539256
Energy: 1.473536984951237
Energy: 1.408688385338686
Energy: 1.4735369849520874
Energy: 1.655187177011507
Energy: 1.4735369849567639
Energy: 1.4086883830503913
Energy: 1.5480047669453132
Energy: 1.8194098173629476
Energy: 1.5480047659679337
Energy: 1.739486165021504
Energy: 1.5480047657431546
Energy: 1.8194098173616722
Energy: 1.5431348051132097
Energy: 1.70911137754739
Energy: 1.5431348051200116
Energy: 1.7091113775495157
Energy: 1.5431348051195866
Energy: 1.7091113775516413
Energy: 1.3778359388978907
Energy: 1.475830249661456
Energy: 1.377835938895765
Energy: 1.475830249661881
Energy: 1.3778359389029924
Energy: 1.475830249659755
Energy: 1.8053313963475186
Energy: 1.5142639968990805
Energy: 1.8053313963453927
Energy: 1.514263997444719
Energy: 1.8053313963487938
Energy: 1.5142639982176869
Energy: 1.476458671570667
Energy: 1.6905708604318959
Energy: 1.4764664821293991
Energy: 1.6905708604357224
Energy: 1.4764586715651402
Energy: 1.6905708604314709
Energy: 1.517394642634902
Energy: 1.492087481967835
Energy: 1.5173946426327762
Energy: 1.4920874819661345
Energy: 1.5173946426340519
Energy: 1.4920874819665597
Energy: 1.7394964711514895
Energy: 1.5381194751038254
Energy: 1.7394964711553158
Energy: 1.5381194740992759
Energy: 1.7394964711519147
Energy: 1.5381194690088555
Energy: 1.5138904623292644
Energy: 1.3286973263375008
Energy: 1.5138906875494147
Energy: 1.328697326334525
Energy: 1.5138907583501653
Energy: 1.3286973263358002
Energy: 1.4771254987085856
Energy: 1.428272285225776
Energy: 1.4771254987141123
Energy: 1.4282722852274767
Energy: 1.477125498710286
Energy: 1.4282722852249259

minimum gb energy = 1.3191122942574138 eV
minimum distance =  2.4116216218892 Angstroms
sigma value = 51


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

Energy: 1.6462832878519216
Energy: 1.6610510858112328
Energy: 1.6462832878509366
Energy: 1.6610510858112328
Energy: 1.6462832878519216
Energy: 1.6610510858112328
Energy: 1.7477173864668578
Energy: 1.5177666618528436
Energy: 1.7477173864668578
Energy: 1.5177666618528436
Energy: 1.7477173864648878
Energy: 1.5177666618528436
Energy: 1.5894641682884572
Energy: 1.6297959471092383
Energy: 1.5894641682884572
Energy: 1.6297959471072683
Energy: 1.5894641682884572
Energy: 1.6297959471072683
Energy: 1.6379900175648976
Energy: 1.3569377709240633
Energy: 1.6379900175668676
Energy: 1.3569377709240633
Energy: 1.6379900175668676
Energy: 1.3569377709240633
Energy: 1.6391722030688018
Energy: 1.6103901059951558
Energy: 1.6391722030688018
Energy: 1.6103901059951558
Energy: 1.6391722030697873
Energy: 1.6103901059941708
Energy: 1.6705561339869177
Energy: 1.6107239059184282
Energy: 1.6705561339869177
Energy: 1.6107239059174432
Energy: 1.6705561339869177
Energy: 1.6107239059184282
Energy: 1.611402343534946
Energy: 1.6106315033110452
Energy: 1.611402343532976
Energy: 1.6106315033110452
Energy: 1.611402343528051
Energy: 1.6106315033120304
Energy: 1.4985786561073748
Energy: 1.6111179555822348
Energy: 1.4985786561073748
Energy: 1.6111179555812498
Energy: 1.4985786561073748
Energy: 1.6111179555782946
Energy: 1.8596057927863492
Energy: 1.3565908220838951
Energy: 1.8596057927873342
Energy: 1.3565908220838951
Energy: 1.8596057927863492
Energy: 1.3565908220838951
Energy: 1.3903596251632533
Energy: 1.8493809415228524
Energy: 1.3903596251632533
Energy: 1.8493809415238376
Energy: 1.3903596251642385
Energy: 1.8493809415238376
Energy: 1.83509327266937
Energy: 1.3781934263576194
Energy: 1.83509327266937
Energy: 1.3781934263576194
Energy: 1.8350932726683853
Energy: 1.3781934263586044
Energy: 1.641931069248919
Energy: 1.6639460284198344
Energy: 1.641931069248919
Energy: 1.6639460284188494
Energy: 1.641931069248919
Energy: 1.6639460284188494
Energy: 1.7470776596862618
Energy: 1.4902315250304328
Energy: 1.7470776574138522
Energy: 1.4902315250304328
Energy: 1.7470776554309062
Energy: 1.4902315250304328
Energy: 1.5894191191540008
Energy: 1.5430149499631127
Energy: 1.5894191191540008
Energy: 1.5430149499631127
Energy: 1.5894191191540008
Energy: 1.5430149499631127
Energy: 1.6320358008212474
Energy: 1.6550168647328374
Energy: 1.6320358008212474
Energy: 1.6550168647318524
Energy: 1.6320358008212474
Energy: 1.6550168647318524
Energy: 1.6380488794168357
Energy: 1.6106249339532397
Energy: 1.6380488794148658
Energy: 1.6106249339522545
Energy: 1.6380488794119106
Energy: 1.6106249339532397
Energy: 1.6393493032148962
Energy: 1.7608508227024209
Energy: 1.6393493032139115
Energy: 1.7608508227024209
Energy: 1.6393493032148962
Energy: 1.7608508227043909
Energy: 1.6255145406392393
Energy: 1.6080947096814688
Energy: 1.6255145406402247
Energy: 1.6080947096814688
Energy: 1.6255145406402247
Energy: 1.6080947096814688

minimum gb energy = 1.3565908220838951 eV
minimum distance =  2.30716112312238 Angstroms
sigma value = 19


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

Energy: 1.2993368153431089
Energy: 1.3347328277738308
Energy: 1.2993368153425247
Energy: 1.3347328277738308
Energy: 1.2993368153425247
Energy: 1.3347328277738308
Energy: 1.4655383994157878
Energy: 1.642200908427125
Energy: 1.4655383994163722
Energy: 1.642200908427125
Energy: 1.4655383994157878
Energy: 1.642200908427125
Energy: 1.257096266896472
Energy: 1.6402612680818525
Energy: 1.2570962668953034
Energy: 1.640261268082437
Energy: 1.257096266896472
Energy: 1.6402612680812683
Energy: 1.3709033462788711
Energy: 1.2567435873126258
Energy: 1.3709033462794553
Energy: 1.2567435873126258
Energy: 1.3709033462794553
Energy: 1.2567435873120416
Energy: 1.2895737875262105
Energy: 1.296082439596506
Energy: 1.2895737875262105
Energy: 1.2960824395959483
Energy: 1.2895737875262105
Energy: 1.2960824395959483
Energy: 1.2894271731372242
Energy: 1.2958630586185746
Energy: 1.2894271731378082
Energy: 1.2958630586185746
Energy: 1.2894271731372242
Energy: 1.2958630586179904
Energy: 1.37089052764137
Energy: 1.2566821316936465
Energy: 1.3708905276419545
Energy: 1.256682131693062
Energy: 1.370890527640786
Energy: 1.2566821316936465
Energy: 1.2570945342012994
Energy: 1.6403478348501275
Energy: 1.2570945342007152
Energy: 1.6403478348501275
Energy: 1.2570945342012994
Energy: 1.6403478348483747
Energy: 1.4653709248368607
Energy: 1.642261002270278
Energy: 1.4653709248351077
Energy: 1.642261002270278
Energy: 1.4653709248351077
Energy: 1.642261002270278
Energy: 1.2993368153425247
Energy: 1.3347328277744155
Energy: 1.29933681534194
Energy: 1.3347328277744155
Energy: 1.29933681534194
Energy: 1.3347328277738308
Energy: 1.4655383994157878
Energy: 1.642200908427125
Energy: 1.4655383994157878
Energy: 1.6422009084265405
Energy: 1.4655383994163722
Energy: 1.6422009084265405
Energy: 1.2570962668958876
Energy: 1.6402612680812683
Energy: 1.2570962668958876
Energy: 1.6402612680818525
Energy: 1.257096266896472
Energy: 1.6402612680812683
Energy: 1.3709033462794553
Energy: 1.256743587310873
Energy: 1.3709033462788711
Energy: 1.256743587311457
Energy: 1.3709033462794553
Energy: 1.2567435873120416
Energy: 1.2895737875262105
Energy: 1.296082439596506
Energy: 1.2895737875262105
Energy: 1.296082439595364
Energy: 1.2895737875262105
Energy: 1.2960824395947796
Energy: 1.2894271731372242
Energy: 1.295863058619159
Energy: 1.2894271731372242
Energy: 1.2958630586162374
Energy: 1.2894271731372242
Energy: 1.295863058616822
Energy: 1.3708905276402015
Energy: 1.2566821316936465
Energy: 1.37089052764137
Energy: 1.2566821316942307
Energy: 1.370890527640786
Energy: 1.2566821316924779
Energy: 1.2570945342001307
Energy: 1.6403478348501275
Energy: 1.2570945342012994
Energy: 1.640347834849543
Energy: 1.2570945342007152
Energy: 1.640347834848959
Energy: 1.4653709248345237
Energy: 1.642261002270278
Energy: 1.465370924833939
Energy: 1.6422610022691095
Energy: 1.4653709248333548
Energy: 1.642261002270278
Energy: 1.2993368153425247
Energy: 1.3347328277738308
Energy: 1.299336815341356
Energy: 1.3347328277738308
Energy: 1.2993368153425247
Energy: 1.3347328277738308
Energy: 1.4655383994157878
Energy: 1.6422009084282934
Energy: 1.4655383994157878
Energy: 1.642200908427125
Energy: 1.4655383994157878
Energy: 1.6422009084282934
Energy: 1.257096266896472
Energy: 1.640261268082437
Energy: 1.257096266896472
Energy: 1.6402612680818525
Energy: 1.257096266896472
Energy: 1.6402612680818525
Energy: 1.3709033462794553
Energy: 1.256743587311457
Energy: 1.3709033462788711
Energy: 1.256743587311457
Energy: 1.3709033462794553
Energy: 1.256743587311457
Energy: 1.289573787525042
Energy: 1.296082439596506
Energy: 1.2895737875262105
Energy: 1.2960824395947796
Energy: 1.2895737875256261
Energy: 1.2960824395959483
Energy: 1.2894271731378082
Energy: 1.295863058616822
Energy: 1.2894271731383926
Energy: 1.2958630586162374
Energy: 1.2894271731378082
Energy: 1.2958630586156534
Energy: 1.37089052764137
Energy: 1.256682131693062
Energy: 1.370890527640786
Energy: 1.2566821316942307
Energy: 1.37089052764137
Energy: 1.2566821316936465
Energy: 1.2570945342001307
Energy: 1.640347834849543
Energy: 1.2570945342001307
Energy: 1.640347834849543
Energy: 1.2570945342007152
Energy: 1.6403478348483747
Energy: 1.465370924831602
Energy: 1.642261002270278
Energy: 1.465370924831602
Energy: 1.642261002270278
Energy: 1.4653709248321862
Energy: 1.642261002270278
Energy: 1.2993368153425247
Energy: 1.3347328277738308
Energy: 1.299336815341356
Energy: 1.3347328277738308
Energy: 1.29933681534194
Energy: 1.3347328277738308
Energy: 1.4655383994163722
Energy: 1.6422009084277092
Energy: 1.4655383994157878
Energy: 1.642200908427125
Energy: 1.4655383994157878
Energy: 1.642200908427125
Energy: 1.257096266896472
Energy: 1.6402612680818525
Energy: 1.257096266896472
Energy: 1.6402612680818525
Energy: 1.257096266896472
Energy: 1.6402612680818525

minimum gb energy = 1.2566821316924779 eV
minimum distance =  2.33249538611291 Angstroms
sigma value = 27


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

Energy: 1.295843756148204
Energy: 1.2618587639213859
Energy: 1.2958437561467728
Energy: 1.2618587639213859
Energy: 1.295843756148204
Energy: 1.2618587639213859
Energy: 1.5076369660754108
Energy: 1.3047046797160553
Energy: 1.5076369660754108
Energy: 1.3047046797160553
Energy: 1.5076369660754108
Energy: 1.3047046797160553
Energy: 1.2168224229159033
Energy: 1.4768134618124609
Energy: 1.2168224229159033
Energy: 1.4768134618110298
Energy: 1.2168224229159033
Energy: 1.4768134618124609
Energy: 1.5062274062487728
Energy: 1.2238227791601126
Energy: 1.5062274062473417
Energy: 1.2238227791601126
Energy: 1.5062274062487728
Energy: 1.2238227791601126
Energy: 1.5718160076089984
Energy: 1.2241860192985619
Energy: 1.5718160076075671
Energy: 1.2241860192985619
Energy: 1.5718160076075671
Energy: 1.2241860192985619
Energy: 1.562815520609287
Energy: 1.6312535520014473
Energy: 1.5628155206078558
Energy: 1.6312535520014473
Energy: 1.5628155206064245
Energy: 1.6312535520014473
Energy: 1.2169755596172689
Energy: 1.3078885129287101
Energy: 1.2169755596172689
Energy: 1.3078885129287101
Energy: 1.2169755596172689
Energy: 1.3078885129287101
Energy: 1.2895217764231746
Energy: 1.2627691177008693
Energy: 1.2895217764231746
Energy: 1.2627691177008693
Energy: 1.2895217764246059
Energy: 1.2627691177023006
Energy: 1.524219482711016
Energy: 1.3273475816745637
Energy: 1.5242194827095847
Energy: 1.3273475812339464
Energy: 1.5242194827095847
Energy: 1.3273475833297244
Energy: 1.4873397400252457
Energy: 1.544957649103107
Energy: 1.4873397400252457
Energy: 1.544957649103107
Energy: 1.4873397400252457
Energy: 1.5449576491016757
Energy: 1.2991312700033604
Energy: 1.2254398770567916
Energy: 1.2991312700033604
Energy: 1.2254398770567916
Energy: 1.2991312700033604
Energy: 1.2254398770567916
Energy: 1.6195103735722667
Energy: 1.4661642792128038
Energy: 1.6195103735708678
Energy: 1.4661642792128038
Energy: 1.6195103735708678
Energy: 1.4661642792099416

minimum gb energy = 1.2168224229159033 eV
minimum distance =  2.30222639933524 Angstroms
sigma value = 9


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

Energy: 1.3824908226839638
Energy: 1.2951829517490814
Energy: 1.3824908226823551
Energy: 1.295182951748679
Energy: 1.3824908226835615
Energy: 1.2951829517494833
Energy: 1.2690130712802492
Energy: 1.2314793886334912
Energy: 1.2690130712802492
Energy: 1.2314793886334912
Energy: 1.2690130712818577
Energy: 1.231479388633893
Energy: 1.1587011555077118
Energy: 1.326597759886553
Energy: 1.1587011555081137
Energy: 1.3265977598873573
Energy: 1.158701155508516
Energy: 1.3265977598889658
Energy: 1.1924043223989138
Energy: 1.140538988785039
Energy: 1.1924043223985117
Energy: 1.1405389887846369
Energy: 1.1924043223985117
Energy: 1.1405389887834305
Energy: 1.2628266349538673
Energy: 1.2386380349214483
Energy: 1.262826634952661
Energy: 1.238638034923459
Energy: 1.2628266349530632
Energy: 1.2386380349238608
Energy: 1.3250806860798958
Energy: 1.2907899032128132
Energy: 1.3250806860811022
Energy: 1.2907899032091938
Energy: 1.3250806860815043
Energy: 1.2907899032116068
Energy: 1.2435339543545563
Energy: 1.3215757388482905
Energy: 1.2435339543529478
Energy: 1.3215757388478884
Energy: 1.2435339543501327
Energy: 1.3215757388486928
Energy: 1.1164756371729665
Energy: 1.3238054678541187
Energy: 1.1164756371725646
Energy: 1.323805467854923
Energy: 1.1164756371725646
Energy: 1.323805467854521
Energy: 1.3042472666103186
Energy: 1.296948022298263
Energy: 1.3042472666095144
Energy: 1.296948022298263
Energy: 1.304247266613938
Energy: 1.296948022297861
Energy: 1.2542515727812587
Energy: 1.3854141415465346
Energy: 1.2542515727808565
Energy: 1.3854141415449261
Energy: 1.2542515727808565
Energy: 1.385414141541307
Energy: 1.195934686752793
Energy: 1.148719771241152
Energy: 1.195934686752793
Energy: 1.148719771241152
Energy: 1.1959346867539993
Energy: 1.148719771241152
Energy: 1.263833861641716
Energy: 1.3094031964069055
Energy: 1.263833861641314
Energy: 1.309403196402884
Energy: 1.263833861641314
Energy: 1.309403196404895
Energy: 1.2800452100538655
Energy: 1.2806045179422125
Energy: 1.2800452100578503
Energy: 1.2806045179410062
Energy: 1.28004521005467
Energy: 1.2806045179450276
Energy: 1.375730093317784
Energy: 1.4360056879836112
Energy: 1.3757300933185883
Energy: 1.4360056879824048
Energy: 1.3757300933193926
Energy: 1.4360056879820027
Energy: 1.1515697653686159
Energy: 1.2934230204728936
Energy: 1.1515697653702244
Energy: 1.2934230204732955
Energy: 1.151569765369822
Energy: 1.2934230204728936
Energy: 1.1751342824183413
Energy: 1.3014105246946037
Energy: 1.175134282389826
Energy: 1.3014105246917884
Energy: 1.1751342824163307
Energy: 1.3014105246942014
Energy: 1.5158171109537402
Energy: 1.1417225704571752
Energy: 1.515817110956153
Energy: 1.1417225704579794
Energy: 1.5158171109609784
Energy: 1.1417225704575773
Energy: 1.1730363922532872
Energy: 1.239125209903243
Energy: 1.173036392252885
Energy: 1.2391252099036452
Energy: 1.1730363922532872
Energy: 1.2391252099044494
Energy: 1.1107973203658255
Energy: 1.3926066312572196
Energy: 1.1107973203674342
Energy: 1.392606631252796
Energy: 1.1107973203662274
Energy: 1.3926066312576217
Energy: 1.3960693684526857
Energy: 1.1753268254337084
Energy: 1.396069368453088
Energy: 1.1753268254333065
Energy: 1.396069368453088
Energy: 1.1753268254329041
Energy: 1.1107387721552302
Energy: 1.5107819679554948
Energy: 1.1107387721548283
Energy: 1.5107819679571033
Energy: 1.1107387721556325
Energy: 1.5107819679538863
Energy: 1.1732667632291978
Energy: 1.2392350465096906
Energy: 1.1732667632291978
Energy: 1.239235046510093
Energy: 1.1732667632291978
Energy: 1.2392350465104949
Energy: 1.5157432267789375
Energy: 1.1414654508780315
Energy: 1.5157432267801438
Energy: 1.1414654508776294
Energy: 1.515743226779742
Energy: 1.1414654508780315
Energy: 1.1749368510005487
Energy: 1.3538856832531396
Energy: 1.1749368509989402
Energy: 1.3538856832551502
Energy: 1.1749368510021574
Energy: 1.3538856832491182
Energy: 1.1517616998408549
Energy: 1.2936117687093527
Energy: 1.1517616998424633
Energy: 1.2936117687093527
Energy: 1.1517616998404527
Energy: 1.293611768709755
Energy: 1.3756409067172033
Energy: 1.2928934646752914
Energy: 1.3756409067200186
Energy: 1.2928934646752914
Energy: 1.3756409067176056
Energy: 1.2928934646748893
Energy: 1.2798188524578475
Energy: 1.2806741136087434
Energy: 1.279818852455837
Energy: 1.2806741136059283
Energy: 1.2798188524598584
Energy: 1.2806741136055264
Energy: 1.2098360102296037
Energy: 1.2678705964593884
Energy: 1.209836010230006
Energy: 1.2678705964618011
Energy: 1.209836010230408
Energy: 1.2678705964597903
Energy: 1.1957348671239663
Energy: 1.1483745885737435
Energy: 1.1957348671219554
Energy: 1.1483745885741456
Energy: 1.1957348671219554
Energy: 1.1483745885741456
Energy: 1.2548455143048012
Energy: 1.2246595855499451
Energy: 1.2548455143064097
Energy: 1.2246595855535645
Energy: 1.2548455143039967
Energy: 1.2246595855503473
Energy: 1.3042657260202792
Energy: 1.2404866125855125
Energy: 1.3042657260234964
Energy: 1.2404866125851104
Energy: 1.3042657260214858
Energy: 1.2404866125855125
Energy: 1.1164564732991866
Energy: 1.324047006635703
Energy: 1.116456473300393
Energy: 1.3240470066361054
Energy: 1.116456473300393
Energy: 1.3240470066365073
Energy: 1.2433745532348168
Energy: 1.3219250283682311
Energy: 1.2433745532344147
Energy: 1.3219250283682311
Energy: 1.2433745532348168
Energy: 1.3219250283686332
Energy: 1.324970064087771
Energy: 1.2909009207000177
Energy: 1.3249700640853581
Energy: 1.2909009206980073
Energy: 1.3249700640873692
Energy: 1.2909009207000177
Energy: 1.2628078567115621
Energy: 1.2395523913300017
Energy: 1.2628078567115621
Energy: 1.2395523913304036
Energy: 1.2628078567111598
Energy: 1.239552391330806
Energy: 1.1924554845530915
Energy: 1.1404717299571172
Energy: 1.1924554845547
Energy: 1.1404717299575196
Energy: 1.1924554845534936
Energy: 1.1404717299586895
Energy: 1.1586721863069207
Energy: 1.3271855406787314
Energy: 1.1586721863061162
Energy: 1.3271855406783293
Energy: 1.1586721863069207
Energy: 1.3271855406775248
Energy: 1.2687633141023666
Energy: 1.2315765975040556
Energy: 1.2687633141027688
Energy: 1.2315765975032513
Energy: 1.2687633141023666
Energy: 1.2315765975040556
Energy: 1.3824908226859742
Energy: 1.295182951748679
Energy: 1.3824908226843657
Energy: 1.295182951748679
Energy: 1.3824908226859742
Energy: 1.2951829517482771
Energy: 1.2690130712774343
Energy: 1.2302791922142697
Energy: 1.2690130712774343
Energy: 1.2302791922138676
Energy: 1.2690130712762278
Energy: 1.2302791922142697
Energy: 1.1587011555093203
Energy: 1.326597759883336
Energy: 1.1587011555097224
Energy: 1.3265977598845422
Energy: 1.1587011555097224
Energy: 1.3265977598845422
Energy: 1.1924043223969032
Energy: 1.1405389887862454
Energy: 1.1924043223977074
Energy: 1.1405389887870496
Energy: 1.1924043223965008
Energy: 1.140538988787452
Energy: 1.2628266349514548
Energy: 1.2386380349238608
Energy: 1.2628266349518567
Energy: 1.2386380349210462
Energy: 1.262826634952259
Energy: 1.238638034918231

minimum gb energy = 1.1107387721548283 eV
minimum distance =  2.3861009498686 Angstroms
sigma value = 57


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

Energy: 1.1637481520676178
Energy: 1.0729323050571125
Energy: 0.6479696135185631
Energy: 1.0729323050598585
Energy: 1.1637481520694486
Energy: 1.0729323050580277
Energy: 1.211117428590052
Energy: 1.0592407682309104
Energy: 1.2111174285909672
Energy: 1.0644898022391858
Energy: 1.2111174285918826
Energy: 1.0592407682290796
Energy: 1.125605638580883
Energy: 1.0955746947680247
Energy: 1.1256056385817983
Energy: 1.0576817178563318
Energy: 1.125605638580883
Energy: 1.0955746947652785
Energy: 1.0744712513562997
Energy: 0.9071674465407926
Energy: 1.0744712513581305
Energy: 0.6475779176589544
Energy: 1.0744712513562997
Energy: 0.9071674465444542
Energy: 0.7869340738690668
Energy: 1.216012330192847
Energy: 0.786934073867236
Energy: 1.216012330191016
Energy: 0.786934073867236
Energy: 1.2160123301891852
Energy: 0.647685997554768
Energy: 1.1250331115412857
Energy: 0.6476859975575142
Energy: 1.1250331115422012
Energy: 0.6476859975565986
Energy: 1.1250331115422012
Energy: 0.6476664090002594
Energy: 0.7128929981387343
Energy: 0.6476664090011749
Energy: 0.7128929981387343
Energy: 0.6476664089993441
Energy: 0.7128929981405651
Energy: 1.2113711118101216
Energy: 0.7914624481295024
Energy: 1.2113711118082906
Energy: 0.7914624481313332
Energy: 1.2113711118110368
Energy: 0.7914624481295024
Energy: 1.0749515992354541
Energy: 0.6475438359270155
Energy: 1.0749515992354541
Energy: 0.907267013648913
Energy: 1.0749515992354541
Energy: 0.6475438359279307
Energy: 0.7100613490915676
Energy: 1.2238044534869523
Energy: 0.7100613490906522
Energy: 1.2238044534896986
Energy: 0.7100613490943138
Energy: 1.2238044534869523
Energy: 0.7865532674405356
Energy: 1.0611666556636719
Energy: 0.7865532674451127
Energy: 1.0611666556645873
Energy: 0.786553267446028
Energy: 1.0611666556673338
Energy: 1.1637481520676178
Energy: 1.072932305056197
Energy: 0.6479696135185631
Energy: 1.072932305060774
Energy: 1.1637481520676178
Energy: 1.0729323050598585
Energy: 1.211117428590052
Energy: 1.059240768229995
Energy: 1.211117428590052
Energy: 1.0644898022391858
Energy: 1.211117428590052
Energy: 1.0592407682290796
Energy: 1.1256056385790518
Energy: 1.0955746947680247
Energy: 1.1256056385817983
Energy: 1.057681717933184
Energy: 1.1256056385817983
Energy: 1.0955746947671094
Energy: 1.074471251359046
Energy: 0.9071674465417079
Energy: 1.0744712513599612
Energy: 0.6475779176589544
Energy: 1.0744712513581305
Energy: 0.9071674465444542
Energy: 0.7869340738690668
Energy: 1.216012330191016
Energy: 0.7869340738681514
Energy: 1.216012330191016
Energy: 0.7869340738681514
Energy: 1.2160123301873544
Energy: 0.6476859975520217
Energy: 1.1250331115422012
Energy: 0.647685997554768
Energy: 1.1250331115431162
Energy: 0.6476859975565986
Energy: 1.1250331115440317
Energy: 0.6476664089993441
Energy: 0.7128929981405651
Energy: 0.6476664090011749
Energy: 0.7128929981387343
Energy: 0.6476664090002594
Energy: 0.7128929981387343
Energy: 1.2113711118101216
Energy: 0.7914624481295024
Energy: 1.2113711118082906
Energy: 0.7914624481304178
Energy: 1.2113711118128676
Energy: 0.7914624481295024

minimum gb energy = 0.6475438359270155 eV
minimum distance =  2.44346227209858 Angstroms
sigma value = 11


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

Energy: 1.063897372724338
Energy: 1.2905259323822904
Energy: 1.0638973727270205
Energy: 1.290525932384973
Energy: 1.0638973727256793
Energy: 1.290525932382961
Energy: 1.2951510327202105
Energy: 1.2636940813533102
Energy: 1.2951510327228923
Energy: 1.2636940813539808
Energy: 1.2951510327208808
Energy: 1.2636940813526396
Energy: 1.2912413263496214
Energy: 1.4469544912660324
Energy: 1.2912413263496214
Energy: 1.446954491266703
Energy: 1.2912413263496214
Energy: 1.446954491266703
Energy: 1.5364687555664382
Energy: 1.0002739887714256
Energy: 1.5364687555637557
Energy: 1.0002739887714256
Energy: 1.5364687555657677
Energy: 1.0002739887700847
Energy: 1.2531286637972283
Energy: 0.9779776794083334
Energy: 1.2531286637985695
Energy: 0.9779776794076628
Energy: 1.25312866379924
Energy: 0.9779776794076628
Energy: 1.031879502748525
Energy: 1.1208074801484527
Energy: 1.0318795027478544
Energy: 1.1208074801491232
Energy: 1.0318795027478544
Energy: 1.1208074801477823
Energy: 0.9650782545686752
Energy: 1.1892814757663341
Energy: 0.9650782545693456
Energy: 1.1892814757663341
Energy: 0.9650782545700162
Energy: 1.189281475767005
Energy: 1.3821410370839688
Energy: 0.9326548399840403
Energy: 1.3821410370846392
Energy: 0.9326548399840403
Energy: 1.3821410370839688
Energy: 0.9326548399840403
Energy: 1.2610516923291002
Energy: 0.9367479099950787
Energy: 1.2610516923277593
Energy: 0.9367479099957492
Energy: 1.2610516923258086
Energy: 0.9367479099964198
Energy: 0.9479641527823109
Energy: 1.5233627109025645
Energy: 0.9479641527816404
Energy: 1.523362710903235
Energy: 0.9479641527816404
Energy: 1.5233627109025645
Energy: 1.2757479739195445
Energy: 1.3958777439727257
Energy: 1.275747973918874
Energy: 1.395877743972055
Energy: 1.2757479739182034
Energy: 1.3958777439733965
Energy: 1.2530195588836017
Energy: 0.9926058841938732
Energy: 1.2530195588836017
Energy: 0.9926058841932026
Energy: 1.2530195588836017
Energy: 0.9926058841932026
Energy: 1.1578086273365424
Energy: 1.0041093345721257
Energy: 1.1578086273264843
Energy: 1.0041093345727963
Energy: 1.157808627329837
Energy: 1.0041093345714553
Energy: 1.2934784871715364
Energy: 1.412319895567519
Energy: 1.2934784871715364
Energy: 1.412319895562825
Energy: 1.2934784871701954
Energy: 1.412319895565507
Energy: 1.3102257529376136
Energy: 1.2310775267380611
Energy: 1.3102257529396253
Energy: 1.2310775267360494
Energy: 1.3102257529389547
Energy: 1.2310775267380611
Energy: 1.0568329702505854
Energy: 1.2982919996036455
Energy: 1.0568329702532677
Energy: 1.298291999602975
Energy: 1.0568329702505854
Energy: 1.298291999602975
Energy: 1.1775198471770634
Energy: 1.244096360792562
Energy: 1.1775198471750519
Energy: 1.2440963607932327
Energy: 1.1775198471763928
Energy: 1.2440963607939033
Energy: 1.3615532656522185
Energy: 1.3992073951242214
Energy: 1.361553265617411
Energy: 1.399207395124892
Energy: 1.3615532656522185
Energy: 1.399207395123551
Energy: 1.196974881118489
Energy: 0.9969729526690451
Energy: 1.196974881118489
Energy: 0.9969729526697156
Energy: 1.1969748811178185
Energy: 0.9969729526690451
Energy: 1.252663610675921
Energy: 1.1201895840271388
Energy: 1.2526636106752504
Energy: 1.1201895840271388
Energy: 1.252663610675921
Energy: 1.1201895840257974
Energy: 0.9562068879569047
Energy: 1.3677643493511134
Energy: 0.9562068879555637
Energy: 1.367764349351784
Energy: 0.9562068879569047
Energy: 1.367764349351784
Energy: 1.00118880632813
Energy: 1.18488675249812
Energy: 1.0011888063288008
Energy: 1.18488675249812
Energy: 1.0011888063288008
Energy: 1.1848867524974493
Energy: 1.146199675474288
Energy: 1.1714160322723943
Energy: 1.1461996754836756
Energy: 1.171416032273065
Energy: 1.146199675487699
Energy: 1.171416032273065
Energy: 1.2616251553519227
Energy: 1.1120425027660108
Energy: 1.2616251553512523
Energy: 1.1120425027666812
Energy: 1.2616251553519227
Energy: 1.1120425027666812
Energy: 0.9565266373516422
Energy: 1.5527674695097522
Energy: 0.9565266373529834
Energy: 1.5527674695104225
Energy: 0.9565266373529834
Energy: 1.5527674695104225
Energy: 1.777931162541055
Energy: 1.3991875295513352
Energy: 1.7779311625403844
Energy: 1.3991875295506646
Energy: 1.777931162541055
Energy: 1.3991875295513352

minimum gb energy = 0.9326548399840403 eV
minimum distance =  2.34973222946673 Angstroms
sigma value = 41


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

Energy: 1.1849915370827382
Energy: 1.0933884912681786
Energy: 1.1849915370843236
Energy: 1.0933884912681786
Energy: 1.184991537081681
Energy: 1.0933884912681786
Energy: 1.1520019703275497
Energy: 1.4622014306202786
Energy: 1.1520019703270215
Energy: 1.46220143061975
Energy: 1.152001970326493
Energy: 1.46220143061975
Energy: 1.5457137941640877
Energy: 1.6017713199725736
Energy: 1.5457137941630306
Energy: 1.6017713199731023
Energy: 1.5457137941640877
Energy: 1.6017713199725736
Energy: 1.1283185430928153
Energy: 1.0870423893507377
Energy: 1.1283185430928153
Energy: 1.0870423893502092
Energy: 1.1283185430922869
Energy: 1.0870423893502092
Energy: 1.0484392042359465
Energy: 1.1454895870013886
Energy: 1.0484392042348896
Energy: 1.1454895870008601
Energy: 1.048439204235418
Energy: 1.1454895870008601
Energy: 1.1217902029937161
Energy: 1.3077211685755405
Energy: 1.1217902029921307
Energy: 1.307721168575012
Energy: 1.1217902029937161
Energy: 1.3077211685755405
Energy: 1.0457249305939373
Energy: 1.5142870089378766
Energy: 1.0457249305944656
Energy: 1.514287008937348
Energy: 1.0457249305928802
Energy: 1.514287008938405
Energy: 1.0616448974697834
Energy: 1.0869397748155398
Energy: 1.0616448974687263
Energy: 1.0869397748155398
Energy: 1.0616448974692552
Energy: 1.0869397748155398
Energy: 1.0559437113550965
Energy: 1.1255218088716976
Energy: 1.0559437113561536
Energy: 1.1255218088716976
Energy: 1.055943711355625
Energy: 1.1255218088716976
Energy: 1.1218408356824532
Energy: 1.3157329605687862
Energy: 1.1218408356819245
Energy: 1.315732960567729
Energy: 1.1218408356824532
Energy: 1.3157329605672006
Energy: 1.117404221930245
Energy: 1.3098205098415772
Energy: 1.117404221930245
Energy: 1.3098205098421056
Energy: 1.1174042219307734
Energy: 1.3098205098421056
Energy: 1.018227480369625
Energy: 1.4620002960560334
Energy: 1.0182274803701534
Energy: 1.462000296056562
Energy: 1.0182274803701534
Energy: 1.4620002960560334
Energy: 1.029820954451192
Energy: 1.0858374350650306
Energy: 1.029820954451192
Energy: 1.0858374350650306
Energy: 1.029820954451192
Energy: 1.0858374350650306
Energy: 0.9957874514350444
Energy: 1.1359823582928399
Energy: 0.9957874514334587
Energy: 1.1359823582944253
Energy: 0.9957874514339873
Energy: 1.1359823582949538
Energy: 1.1181946782806957
Energy: 1.0950046811741474
Energy: 1.1181946782796384
Energy: 1.095004681173619
Energy: 1.1181946782806957
Energy: 1.0950046811730905
Energy: 0.996439138826067
Energy: 1.5539898894107342
Energy: 0.996439138826067
Energy: 1.5539898894107342
Energy: 0.996439138826067
Energy: 1.5539898894107342
Energy: 1.02355357428011
Energy: 1.0856836990647665
Energy: 1.0235535742790531
Energy: 1.085683699065295
Energy: 1.0235535742806385
Energy: 1.0856836990658236
Energy: 1.4229344176336145
Energy: 1.2170275105082766
Energy: 1.422934417634143
Energy: 1.2170275105072197
Energy: 1.4229344176336145
Energy: 1.2170275105082766
Energy: 1.146994304487837
Energy: 1.4692518032361885
Energy: 1.1469943044873085
Energy: 1.4692518032367168
Energy: 1.1469943044873085
Energy: 1.4692518032361885
Energy: 1.1168186067901573
Energy: 1.494871803451605
Energy: 1.1168186067901573
Energy: 1.494871803451605
Energy: 1.1168186067917432
Energy: 1.4948718034510766
Energy: 1.041701618538299
Energy: 1.467107137612053
Energy: 1.0417016185372419
Energy: 1.4671071376125815
Energy: 1.0417016185372419
Energy: 1.4671071376125815
Energy: 1.2620935924590806
Energy: 1.5993070577754689
Energy: 1.262093592458552
Energy: 1.5993070577759974
Energy: 1.262093592458552
Energy: 1.5993070577759974
Energy: 1.291845590105568
Energy: 1.0622869295954294
Energy: 1.2918455901060966
Energy: 1.062286929594901
Energy: 1.2918455901060966
Energy: 1.062286929594901
Energy: 0.9962324130138235
Energy: 1.4672156722122722
Energy: 0.9962324130148804
Energy: 1.4672156722122722
Energy: 0.996232413015409
Energy: 1.4672156722122722
Energy: 1.0031811767144347
Energy: 1.6317045243287538
Energy: 1.0031811767128493
Energy: 1.6317045243266395
Energy: 1.0031811767144347
Energy: 1.6317045243276966
Energy: 1.0467067257931397
Energy: 1.1331216455528184
Energy: 1.0467067257931397
Energy: 1.1331216455533468
Energy: 1.0467067257926108
Energy: 1.13312164555229
Energy: 1.0337940905932026
Energy: 1.062443711146608
Energy: 1.0337940905926741
Energy: 1.062443711146608
Energy: 1.0337940905932026
Energy: 1.062443711146608
Energy: 1.0506861021565657
Energy: 1.46148864756904
Energy: 1.050686102157094
Energy: 1.46148864756904
Energy: 1.050686102157094
Energy: 1.46148864756904
Energy: 1.1476399204410732
Energy: 1.2369401359688212
Energy: 1.1476399204400165
Energy: 1.2369401359682928
Energy: 1.1476399204400165
Energy: 1.2369401359688212
Energy: 1.2070486072572815
Energy: 1.0726574068792023
Energy: 1.2070486072583384
Energy: 1.072657406877617
Energy: 1.207048607256753
Energy: 1.0726574068786738
Energy: 1.0206328119370536
Energy: 1.0552840380251154
Energy: 1.020632811936525
Energy: 1.0552840380251154
Energy: 1.020632811937582
Energy: 1.0552840380245867
Energy: 1.0866763853886228
Energy: 1.1087954436161347
Energy: 1.0866763853907366
Energy: 1.1087954436161347
Energy: 1.086676385389151
Energy: 1.1087954436166632
Energy: 0.9961829017485655
Energy: 1.0876584082597542
Energy: 0.996182901750151
Energy: 1.0876584082597542
Energy: 0.9961829017490941
Energy: 1.0876584082602827

minimum gb energy = 0.9957874514334587 eV
minimum distance =  2.38217220271433 Angstroms
sigma value = 33


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

Energy: 1.246677587828433
Energy: 1.1093960903792064
Energy: 1.2466775878265448
Energy: 1.1093960903792064
Energy: 1.246677587828433
Energy: 1.1093960903792064
Energy: 1.2211941300460425
Energy: 1.068061650420851
Energy: 1.2211941300449636
Energy: 1.0680616504186253
Energy: 1.2211941300449636
Energy: 1.0680616504197717
Energy: 1.555072669306624
Energy: 1.2538996591622726
Energy: 1.555072669305545
Energy: 1.2538996591633518
Energy: 1.555072669305545
Energy: 1.2538996591603846
Energy: 1.1214287941317154
Energy: 1.095371234647489
Energy: 1.1214287941291528
Energy: 1.0953712346470845
Energy: 1.12142879413212
Energy: 1.095371234647489
Energy: 1.154074177892998
Energy: 1.128571696674734
Energy: 1.1540741778937398
Energy: 1.1285716966891655
Energy: 1.1540741778926606
Energy: 1.1285716966817474
Energy: 1.1843480842995195
Energy: 1.112940107704231
Energy: 1.1843480842991823
Energy: 1.112940107704568
Energy: 1.1843480843002614
Energy: 1.112940107704231
Energy: 1.0968429345365276
Energy: 1.1999874735336158
Energy: 1.0968429345365276
Energy: 1.1999874735336158
Energy: 1.0968429345369322
Energy: 1.1999874735339529
Energy: 1.179113067707072
Energy: 1.191340911135604
Energy: 1.179113067707072
Energy: 1.1913409111351994
Energy: 1.179113067707072
Energy: 1.1913409111351994
Energy: 1.6405210051290517
Energy: 1.1535749857237962
Energy: 1.6405210051305352
Energy: 1.1535749857237962
Energy: 1.6405210051305352
Energy: 1.153574985724538
Energy: 1.2724327817017196
Energy: 1.088066361285675
Energy: 1.2724327817095424
Energy: 1.088066361286012
Energy: 1.272432781707317
Energy: 1.088066361285675
Energy: 1.1578917789138643
Energy: 1.1585534117872351
Energy: 1.1578917789131224
Energy: 1.1585534117876397
Energy: 1.157891778913527
Energy: 1.1585534117872351
Energy: 1.426900722599829
Energy: 1.0948549035645254
Energy: 1.4269007225983452
Energy: 1.09485490356493
Energy: 1.4269007225979404
Energy: 1.0948549035645254
Energy: 1.1704884343579551
Energy: 1.4457094818510337
Energy: 1.1704884343612596
Energy: 1.445709481850292
Energy: 1.1704884343605177
Energy: 1.4457094818514387
Energy: 1.185283590815074
Energy: 1.1750308847702662
Energy: 1.1852835908154788
Energy: 1.1750308847714126
Energy: 1.1852835908172996
Energy: 1.175030884771008
Energy: 1.1771450957287386
Energy: 1.0818663924805145
Energy: 1.1771450957284013
Energy: 1.081866392479773
Energy: 1.177145095727255
Energy: 1.081866392479773
Energy: 1.1195311060411213
Energy: 1.43873001903708
Energy: 1.1195311060418633
Energy: 1.43873001903708
Energy: 1.119531106042942
Energy: 1.4387300190363381
Energy: 1.0617200694765396
Energy: 1.089899908428137
Energy: 1.061720069473572
Energy: 1.0898999084273955
Energy: 1.061720069473572
Energy: 1.089899908428137
Energy: 1.0913883263437016
Energy: 1.0999624049444008
Energy: 1.0913883263433644
Energy: 1.0999624049458845
Energy: 1.0913883263437016
Energy: 1.0999624049455472
Energy: 1.2668317677058112
Energy: 1.1366724600726466
Energy: 1.2668317677043275
Energy: 1.1366724600723095
Energy: 1.2668317677062158
Energy: 1.136672460073793
Energy: 1.0748097285248321
Energy: 1.1720455914342303
Energy: 1.074809728488483
Energy: 1.1720455914345675
Energy: 1.0748097285226068
Energy: 1.1720455914342303
Energy: 1.1250697587316714
Energy: 1.2248935167575061
Energy: 1.125069758733155
Energy: 1.2248935167578434
Energy: 1.1250697587316714
Energy: 1.2248935167575061
Energy: 1.032875866107243
Energy: 1.2202443809866643
Energy: 1.032875866107243
Energy: 1.220244380988148
Energy: 1.0328758661094681
Energy: 1.2202443809884853
Energy: 1.1774952968050703
Energy: 1.3041231189321747
Energy: 1.1774952968047332
Energy: 1.304123118932512
Energy: 1.177495296805475
Energy: 1.304123118932512
Energy: 1.1008953111819137
Energy: 1.1201918475571215
Energy: 1.1008953111823183
Energy: 1.120191847554896
Energy: 1.1008953111823183
Energy: 1.1201918475623143
Energy: 1.0914430751320123
Energy: 1.0902200664069301
Energy: 1.091443075133496
Energy: 1.0902200664061883
Energy: 1.0914430751312705
Energy: 1.090220066407672
Energy: 1.1095593579261078
Energy: 1.180296549829125
Energy: 1.1095593579283334
Energy: 1.1802965498298665
Energy: 1.1095593579268497
Energy: 1.1802965498287876
Energy: 1.2174874674662617
Energy: 1.099056994530449
Energy: 1.217487467465857
Energy: 1.0990569945311908
Energy: 1.2174874674673404
Energy: 1.0990569945311908
Energy: 1.1793114847241049
Energy: 1.0999200233674726
Energy: 1.1793114847237678
Energy: 1.0999200233674726
Energy: 1.1793114847245094
Energy: 1.0999200233682145
Energy: 1.177197176236709
Energy: 1.6425770415234364
Energy: 1.1771971762374511
Energy: 1.642577041522695
Energy: 1.1771971762359674
Energy: 1.642577041522695
Energy: 1.0686784893062438
Energy: 1.268022802847646
Energy: 1.068678489305839
Energy: 1.2680228028472413
Energy: 1.068678489305839
Energy: 1.2680228028472413
Energy: 1.1197420322038185
Energy: 1.0904852491206778
Energy: 1.1197420322060443
Energy: 1.0904852491199362
Energy: 1.119742032205707
Energy: 1.0904852491206778
Energy: 1.1013554631906073
Energy: 1.0602289738688204
Energy: 1.10135546319027
Energy: 1.0602289738603232
Energy: 1.1013554631906073
Energy: 1.0602289738558723
Energy: 1.449461850065438
Energy: 1.1081852372820733
Energy: 1.449461850065775
Energy: 1.1081852372824106
Energy: 1.449461850065438
Energy: 1.1081852372828154
Energy: 1.1726516241656202
Energy: 1.1800178425648302
Energy: 1.172651624167441
Energy: 1.1800178425651673
Energy: 1.1726516241666993
Energy: 1.1800178425655723
Energy: 1.1726605671097634
Energy: 1.1802092759161849
Energy: 1.1726605671101682
Energy: 1.1802092759150382
Energy: 1.1726605671097634
Energy: 1.1802092759165221
Energy: 1.0752143561929286
Energy: 1.1258073742469656
Energy: 1.075214356188478
Energy: 1.1258073742466284
Energy: 1.0752143561899614
Energy: 1.125807374248112
Energy: 1.1011750688205584
Energy: 1.0609063873043747
Energy: 1.1011750688213
Energy: 1.0609063873136138
Energy: 1.1011750688213
Energy: 1.0609063872995865
Energy: 1.1200125256793654
Energy: 1.0901344711849204
Energy: 1.1200125256793654
Energy: 1.0901344711853254
Energy: 1.1200125256805118
Energy: 1.0901344711849204
Energy: 1.0686211248753292
Energy: 1.2681852277289396
Energy: 1.0686211248745872
Energy: 1.268185227730086
Energy: 1.0686211248731037
Energy: 1.268185227731165
Energy: 1.176901165991862
Energy: 1.6426063119408367
Energy: 1.1769011659914577
Energy: 1.6426063119400947
Energy: 1.1769011659914577
Energy: 1.6426063119396905
Energy: 1.1791952498695488
Energy: 1.0999141339196035
Energy: 1.1791952498688072
Energy: 1.0999141339206824
Energy: 1.1791952498684701
Energy: 1.0999141339196035
Energy: 1.21723791293861
Energy: 1.0992415962573117
Energy: 1.2172379129404305
Energy: 1.0992415962569069
Energy: 1.217237912937868
Energy: 1.0992415962573117
Energy: 1.1098149681247722
Energy: 1.1799756779845743
Energy: 1.1098149681236258
Energy: 1.1799756779823487
Energy: 1.1098149681247722
Energy: 1.1799756779834951
Energy: 1.0911478436297748
Energy: 1.090426514510648
Energy: 1.0911478436238402
Energy: 1.0904265145099061
Energy: 1.0911478436312585
Energy: 1.0904265145091643
Energy: 1.1008903762060933
Energy: 1.12012665201446
Energy: 1.100890376206835
Energy: 1.1201266520185735
Energy: 1.1008903762075768
Energy: 1.1201266520166853
Energy: 1.1774386017920015
Energy: 1.3042622573110085
Energy: 1.1774386017920015
Energy: 1.3042622573110085
Energy: 1.1774386017927434
Energy: 1.3042622573106712
Energy: 1.0330832170716227
Energy: 1.2210560054081758
Energy: 1.0330832170731061
Energy: 1.2210560054078383
Energy: 1.0330832170723645
Energy: 1.2210560054089175

minimum gb energy = 1.032875866107243 eV
minimum distance =  2.38275399781325 Angstroms
sigma value = 67


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

Energy: 1.2940246624390135
Energy: 1.1699112912125562
Energy: 1.2940246624390135
Energy: 1.1699112912125562
Energy: 1.2940246624390135
Energy: 1.1699112912125562
Energy: 1.255982737926831
Energy: 1.0701028441291132
Energy: 1.255982737926831
Energy: 1.0701028441291132
Energy: 1.255982737924352
Energy: 1.0701028441291132
Energy: 1.1363388899218672
Energy: 1.351316557155452
Energy: 1.1363388872730211
Energy: 1.3513165571579309
Energy: 1.136338883226736
Energy: 1.351316557155452
Energy: 1.2559212817633847
Energy: 1.0704606077135188
Energy: 1.2559212817633847
Energy: 1.0704606077135188
Energy: 1.2559212817609058
Energy: 1.0704606077159977
Energy: 1.2940246624390135
Energy: 1.1699112912150351
Energy: 1.2940246624390135
Energy: 1.1699112912150351
Energy: 1.2940246624390135
Energy: 1.1699112912150351
Energy: 1.255982737926831
Energy: 1.0701028441291132
Energy: 1.255982737926831
Energy: 1.0701028441291132
Energy: 1.255982737924352
Energy: 1.0701028441291132
Energy: 1.0706512205048322
Energy: 1.351316557155452
Energy: 1.0706512205023533
Energy: 1.351316557155452
Energy: 1.0706512205122691
Energy: 1.351316557155452

minimum gb energy = 1.0701028441291132 eV
minimum distance =  2.40072046036856 Angstroms
sigma value = 3


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

Energy: 1.4526275100067625
Energy: 1.372962154766547
Energy: 1.4526275100033892
Energy: 1.3729621547699202
Energy: 1.4526275100067625
Energy: 1.372962154766547
Energy: 1.3074602518527352
Energy: 1.2326529342048627
Energy: 1.3074602518561085
Energy: 1.2326529342048627
Energy: 1.3074602518527352
Energy: 1.2326529342048627
Energy: 1.2956666941364618
Energy: 1.5030722188703418
Energy: 1.2956666941398354
Energy: 1.5030722188703418
Energy: 1.2956666941398354
Energy: 1.5030722188703418
Energy: 1.5223371922622388
Energy: 1.2087784497301959
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Energy: 1.3060959710640097
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Energy: 1.3206993390297534
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Energy: 1.3120987441261889
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Energy: 1.2508232457674906
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Energy: 1.2517536037843624
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Energy: 1.3521087923066049
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Energy: 1.2358457034362478
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Energy: 1.3206444901995038
Energy: 1.3521395660482562
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Energy: 1.3217680726633225
Energy: 1.22848014909082
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Energy: 1.2284801490874464
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Energy: 1.2323534311469964
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Energy: 1.5282250367968857
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Energy: 1.3536244543404776
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Energy: 1.3536244542966849
Energy: 1.28400412024223
Energy: 1.2258176094706283
Energy: 1.3887954490719898
Energy: 1.2258176094740016
Energy: 1.3887954490753633
Energy: 1.2258176094740016
Energy: 1.3887954490719898
Energy: 1.2388663222914686
Energy: 1.2980392661697207
Energy: 1.2388933202934216
Energy: 1.2980392661730942
Energy: 1.2391670514478004
Energy: 1.2980392661697207
Energy: 1.267896495561324
Energy: 1.547870368737951
Energy: 1.267896495561324
Energy: 1.5478703686536777
Energy: 1.267896495561324
Energy: 1.5478703682760417
Energy: 1.4891197342345175
Energy: 1.2024665989439536
Energy: 1.4891197342345175
Energy: 1.2024665989439536
Energy: 1.489119734237891
Energy: 1.2024665989439536
Energy: 1.304223669147662
Energy: 1.5460187341398357
Energy: 1.304223669147662
Energy: 1.5460187341398357
Energy: 1.304223669144289
Energy: 1.5460187341398357
Energy: 1.4634557188876929
Energy: 1.2330065663552445
Energy: 1.463453416797461
Energy: 1.233006566358618
Energy: 1.4634527355229625
Energy: 1.233006566358618
Energy: 1.3529374476208638
Energy: 1.2717913148191746
Energy: 1.3529374476208638
Energy: 1.2717913148158013
Energy: 1.3529374476208638
Energy: 1.2717913148191746
Energy: 1.3890903289149346
Energy: 1.2443555689689745
Energy: 1.3890903289115613
Energy: 1.2443555689689745
Energy: 1.3890903289149346
Energy: 1.2443555689689745
Energy: 1.3584228017818862
Energy: 1.304234991203137
Energy: 1.3584228017886328
Energy: 1.304234991203137
Energy: 1.358422801791945
Energy: 1.304234991203137
Energy: 1.4753100605441336
Energy: 1.3054249783731158
Energy: 1.4753100605475067
Energy: 1.3054249783731158
Energy: 1.4753100605441336
Energy: 1.3054249783697425
Energy: 1.2676500426908832
Energy: 1.403735603030286
Energy: 1.2676500426908832
Energy: 1.403735613132492
Energy: 1.2676500426908832
Energy: 1.4037355836587948
Energy: 1.32174837642509
Energy: 1.324038121816114
Energy: 1.32174837642509
Energy: 1.324038121816114
Energy: 1.32174837642509
Energy: 1.324038121816114
Energy: 1.3251228173969662
Energy: 1.30430867094563
Energy: 1.3251228168978881
Energy: 1.30430867094563
Energy: 1.3251228100563417
Energy: 1.30430867094563

minimum gb energy = 1.2024665989439536 eV
minimum distance =  2.36665951303001 Angstroms
sigma value = 81


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

Energy: 1.3426615246849984
Energy: 1.3111307235822312
Energy: 1.3426615246882396
Energy: 1.3111307235822312
Energy: 1.3426615246868505
Energy: 1.3111307235822312
Energy: 1.4208030494234418
Energy: 1.406445740705949
Energy: 1.4208030494239048
Energy: 1.406445740705949
Energy: 1.420803049422516
Energy: 1.406445740705949
Energy: 1.499926005046512
Energy: 1.4310761475405553
Energy: 1.4999260050446601
Energy: 1.4310761475192573
Energy: 1.4999260050474381
Energy: 1.4310761475377773
Energy: 1.4171191905280798
Energy: 1.4411841473406015
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Energy: 1.4411841473401383
Energy: 1.417119190527154
Energy: 1.4411841473419902
Energy: 1.4604761382020282
Energy: 1.4333123054569263
Energy: 1.4604761382011024
Energy: 1.4333123054592414
Energy: 1.4604761382015652
Energy: 1.4333123054583152
Energy: 1.206225813446345
Energy: 1.203081687173916
Energy: 1.2062258134472712
Energy: 1.2030816871743792
Energy: 1.206225813445882
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Energy: 1.170314028202252
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Energy: 1.2071582638908023
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Energy: 1.4472292875957224
Energy: 1.4407851744574824
Energy: 1.4472292875961854
Energy: 1.4407851744579454
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Energy: 1.4418948762649073
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Energy: 1.4418948762602775
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Energy: 1.430196787712799
Energy: 1.2028667528367
Energy: 1.4301967877137252
Energy: 1.202866752837163
Energy: 1.4301967877146509
Energy: 1.2028667528376262
Energy: 1.3124408201549174
Energy: 1.43067002010726
Energy: 1.3124408201563065
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Energy: 1.3124408201502875
Energy: 1.4306700201077232
Energy: 1.3117720870114946
Energy: 1.2034259100502769
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Energy: 1.3117720870105682
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Energy: 1.1342129413775113
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Energy: 1.4226823893700482
Energy: 1.1342129413779742
Energy: 1.4226823893695852
Energy: 1.4333187007965396
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Energy: 1.4333187007983914
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Energy: 1.500314068943087
Energy: 1.4410422257655036
Energy: 1.607642876828667
Energy: 1.4410422257641566
Energy: 1.6076428789894168
Energy: 1.4410422257632307
Energy: 1.6076428727783556
Energy: 1.4408001564411481
Energy: 1.4550005744783434
Energy: 1.440800156439759
Energy: 1.4550005744778802
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Energy: 1.4550005744764916
Energy: 1.2027489565744585
Energy: 1.173633992038255
Energy: 1.2027489565735325
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Energy: 1.2027489565739957
Energy: 1.173633992038255
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Energy: 1.173430832967348
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Energy: 1.2027885834836607
Energy: 1.17343083296457
Energy: 1.4407782525213493
Energy: 1.4550600843941637
Energy: 1.440778252520886
Energy: 1.4550600843941637
Energy: 1.4407782525218125
Energy: 1.4550600843941637
Energy: 1.441094365976305
Energy: 1.607584002008714
Energy: 1.44109436597399
Energy: 1.6075839949035273
Energy: 1.44109436597399
Energy: 1.6075839790766329
Energy: 1.4329497364149015
Energy: 1.5007962553521668
Energy: 1.4329497364130495
Energy: 1.5007962553567966
Energy: 1.4329497364125863
Energy: 1.5007962553549448
Energy: 1.1342560058696385
Energy: 1.4178652135260112
Energy: 1.1342560058687123
Energy: 1.4178652135255483
Energy: 1.1342560058677866
Energy: 1.4178652135264744
Energy: 1.3118622392760109
Energy: 1.2035156685107349
Energy: 1.311862239276937
Energy: 1.2035156685107349
Energy: 1.3118622392773998
Energy: 1.2035156685111978
Energy: 1.3122364616462245
Energy: 1.4299561959475922
Energy: 1.3122364616439095
Energy: 1.4299561959471292
Energy: 1.312236461631872
Energy: 1.4299561959471292
Energy: 1.429721502975289
Energy: 1.2029916218382044
Energy: 1.429721502976215
Energy: 1.2029916218377414
Energy: 1.429721502976215
Energy: 1.2029916218377414
Energy: 1.44196893132658
Energy: 1.4082738999280557
Energy: 1.441968931327506
Energy: 1.4082738999285187
Energy: 1.441968931329821
Energy: 1.4082738999280557
Energy: 1.3646019014451354
Energy: 1.447482199438227
Energy: 1.3646019014451354
Energy: 1.447482199438227
Energy: 1.3646019014455983
Energy: 1.4474821994391531
Energy: 1.2033217344331204
Energy: 1.2072938525378882
Energy: 1.2033217344321945
Energy: 1.2072938525378882
Energy: 1.2033217344326574
Energy: 1.2072938525383512
Energy: 1.2114871031069976
Energy: 1.1693430908264466
Energy: 1.2114871031065346
Energy: 1.1693430908264466
Energy: 1.2114871031065346
Energy: 1.1693430908264466
Energy: 1.3533192338114186
Energy: 1.651445007500582
Energy: 1.3533192338146598
Energy: 1.651445007501508
Energy: 1.3533192338114186
Energy: 1.651445007501045
Energy: 1.2342435611920133
Energy: 1.441252319303933
Energy: 1.234177678781702
Energy: 1.4412523193081002
Energy: 1.2422133242754847
Energy: 1.4412523193081002
Energy: 1.3123776546524444
Energy: 1.4317453601325805
Energy: 1.3123776515031607
Energy: 1.4317453601335064
Energy: 1.312377657102439
Energy: 1.4317453601339696
Energy: 1.1704770965895457
Energy: 1.2030180261552734
Energy: 1.1704770965895457
Energy: 1.2030180261548102
Energy: 1.1704770965890827
Energy: 1.2030180261557364

minimum gb energy = 1.1342129413775113 eV
minimum distance =  2.42128288407631 Angstroms
sigma value = 43


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

Energy: 1.5864269621896974
Energy: 1.4225927152061304
Energy: 1.5864269621902665
Energy: 1.4225927152061304
Energy: 1.5864269621908351
Energy: 1.4225927152061304
Energy: 1.3971825013581232
Energy: 1.232633236627962
Energy: 1.3971825013569856
Energy: 1.2326332366273935
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Energy: 1.2326332366273935
Energy: 1.1762502851491772
Energy: 1.5810833575958558
Energy: 1.1762502851531582
Energy: 1.5810833575958558
Energy: 1.1762502851537269
Energy: 1.5810833575958558
Energy: 1.2649209459789448
Energy: 1.294485822949548
Energy: 1.2649209459795137
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Energy: 1.2944858229467044
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Energy: 1.3488910197944168
Energy: 1.4205577917414236
Energy: 1.3488910142349646
Energy: 1.4205577917419923
Energy: 1.3488909507320104
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Energy: 1.3324682238072834
Energy: 1.3879826253673588
Energy: 1.3324682238067147
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Energy: 1.3474188218532759
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Energy: 1.2987614164784156
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Energy: 1.2987614164778467
Energy: 1.3820719294235333
Energy: 1.298761416479553
Energy: 1.3820719294258081
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Energy: 1.5627114419866321
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Energy: 1.2423576324872072
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Energy: 1.5229004834961446
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Energy: 1.2996613860806085
Energy: 1.3345550439742393
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Energy: 1.3345550439742393
Energy: 1.482117984135964
Energy: 1.3332286502357726
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Energy: 1.4946376057792716
Energy: 1.189146885597441
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Energy: 1.189146885597441
Energy: 1.494637605778703
Energy: 1.3562743446526613
Energy: 1.3501084676451867
Energy: 1.3562743446520928
Energy: 1.3501084676275568
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Energy: 1.3501084672591912
Energy: 1.3368390507228876
Energy: 1.4496295953920522
Energy: 1.336839050723456
Energy: 1.4496295953948957
Energy: 1.336839050723456
Energy: 1.4496295953926208
Energy: 1.4131709001017685
Energy: 1.2338982505479323
Energy: 1.4131615888156355
Energy: 1.2338982505485012
Energy: 1.4131471771775912
Energy: 1.2338982505479323
Energy: 1.5073788518119364
Energy: 1.3169255728862863
Energy: 1.5073788518119364
Energy: 1.3169255728857177
Energy: 1.5073788518113675
Energy: 1.3169255728862863
Energy: 1.4386592364309758
Energy: 1.3738899208541706
Energy: 1.4386592364304072
Energy: 1.373889920853602
Energy: 1.4386592364315445
Energy: 1.3738899208541706
Energy: 1.2621250021400123
Energy: 1.2338866850991779
Energy: 1.260576361572529
Energy: 1.2338866850997467
Energy: 1.2604403252337806
Energy: 1.2338866850997467
Energy: 1.336528918707596
Energy: 1.2825717768683769
Energy: 1.336528918707027
Energy: 1.282571776871789
Energy: 1.3365289187058897
Energy: 1.2825717768712201
Energy: 1.5097511134028712
Energy: 1.2798450347243577
Energy: 1.50975111340344
Energy: 1.2798450347272012
Energy: 1.50975111340344
Energy: 1.2798450347272012
Energy: 1.1889030889605847
Energy: 1.4047308358656794
Energy: 1.1889030889617223
Energy: 1.4047308358656794
Energy: 1.1889030889611534
Energy: 1.4047308358656794
Energy: 1.4783219092013558
Energy: 1.3329056294282755
Energy: 1.4783219092007873
Energy: 1.3329056294282755
Energy: 1.4783219091985123
Energy: 1.3329056294282755
Energy: 1.306472351277475
Energy: 1.400537697524714
Energy: 1.3064723512757688
Energy: 1.400537697524145
Energy: 1.3064723512780436
Energy: 1.400537697524145
Energy: 1.4859887804231522
Energy: 1.3448053940927949
Energy: 1.4859887804237206
Energy: 1.344805394092226
Energy: 1.4859887804242895
Energy: 1.3448053940933633
Energy: 1.240128601274873
Energy: 1.2330588700569065
Energy: 1.2401279928347104
Energy: 1.2330588700574754
Energy: 1.2401282290658933
Energy: 1.2330588700569065
Energy: 1.4568781989655573
Energy: 1.199452102581265
Energy: 1.4568781989672637
Energy: 1.199452102581265
Energy: 1.4568781989610078
Energy: 1.1994521025806966
Energy: 1.3063732658035174
Energy: 1.3822641726099096
Energy: 1.3063732658035174
Energy: 1.3822641726099096
Energy: 1.3063732658035174
Energy: 1.382264172607066
Energy: 1.3652459444220293
Energy: 1.3944728069186163
Energy: 1.3652459444214604
Energy: 1.3944728069186163
Energy: 1.3652459444220293
Energy: 1.3944728069186163
Energy: 1.2588069508202857
Energy: 1.3337361580876257
Energy: 1.2594761851383918
Energy: 1.3337361580876257
Energy: 1.2615556628110123
Energy: 1.3337361580881941

minimum gb energy = 1.1762502851491772 eV
minimum distance =  2.37313310077278 Angstroms
sigma value = 57


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

Energy: 1.4754183857501484
Energy: 1.2706299448477016
Energy: 1.4754183857501484
Energy: 1.2706299448477016
Energy: 1.475418385751621
Energy: 1.2706299448477016
Energy: 1.3991064554815333
Energy: 1.2016265002774353
Energy: 1.3991064554815333
Energy: 1.2016265002766988
Energy: 1.3991064554822696
Energy: 1.2016265002759625
Energy: 1.414505709754422
Energy: 1.561110801549428
Energy: 1.4145057097573674
Energy: 1.561110801549428
Energy: 1.4145057097536855
Energy: 1.561110801549428
Energy: 1.3917389566275828
Energy: 1.4098568779117269
Energy: 1.3917389566275828
Energy: 1.4098568779095177
Energy: 1.3917389566275828
Energy: 1.4098568778999454
Energy: 1.5122823362406406
Energy: 1.4127178967378975
Energy: 1.512282336239904
Energy: 1.4127178967342156
Energy: 1.5122823362413769
Energy: 1.4127178967386336
Energy: 1.319100385185879
Energy: 1.2847969906536503
Energy: 1.3191003851844063
Energy: 1.2847969906529138
Energy: 1.3191003851888243
Energy: 1.2847969906529138
Energy: 1.3535889963887964
Energy: 1.520832122045549
Energy: 1.353588996390269
Energy: 1.520832122045549
Energy: 1.353588996389533
Energy: 1.520832122045549
Energy: 1.3545079313494581
Energy: 1.3046239836454816
Energy: 1.3545079313487218
Energy: 1.304623983644745
Energy: 1.3545079313494581
Energy: 1.3046239836454816
Energy: 1.4609131061112812
Energy: 1.2005690579795478
Energy: 1.4609131061134901
Energy: 1.2005690579795478
Energy: 1.4609131061120175
Energy: 1.2005690579788113
Energy: 1.112064171519989
Energy: 1.407579902537097
Energy: 1.1120641715192525
Energy: 1.4075799025363607
Energy: 1.1120641715207253
Energy: 1.4075799025363607
Energy: 1.3535310700494136
Energy: 1.4093087932127295
Energy: 1.3535310700494136
Energy: 1.4093087932068389
Energy: 1.35353107005015
Energy: 1.4093087932097843
Energy: 1.4588222706944844
Energy: 1.5062666242139686
Energy: 1.4588222706952207
Energy: 1.506266368079044
Energy: 1.4588222706930118
Energy: 1.5062659146190096
Energy: 1.300683476463059
Energy: 1.2003980345782235
Energy: 1.3004243114997862
Energy: 1.2003980345782235
Energy: 1.300383375051772
Energy: 1.200398034577487
Energy: 1.556547477800212
Energy: 1.2570215948992896
Energy: 1.556547477800212
Energy: 1.2570215948992896
Energy: 1.5565474777994759
Energy: 1.2570215949000259
Energy: 1.25506264922753
Energy: 1.2066727300940183
Energy: 1.2550626492304755
Energy: 1.206672730093282
Energy: 1.2550626492297392
Energy: 1.2066727300940183
Energy: 1.4887757433455446
Energy: 1.3165408204132556
Energy: 1.488775743346281
Energy: 1.3165408204154643
Energy: 1.4887757433455446
Energy: 1.3165408204132556
Energy: 1.115729197872957
Energy: 1.3981329547454044
Energy: 1.115729197872957
Energy: 1.3981329547454044
Energy: 1.1157291978744297
Energy: 1.3981329547454044
Energy: 1.3112867289075636
Energy: 1.4258928403183708
Energy: 1.3112867289193118
Energy: 1.4258928403191073
Energy: 1.3112867289163663
Energy: 1.4258928403183708
Energy: 1.1152463101326306
Energy: 1.398162922706511
Energy: 1.115246310133367
Energy: 1.398162922706511
Energy: 1.1152463101326306
Energy: 1.398162922706511
Energy: 1.4886635598588467
Energy: 1.3170331608083452
Energy: 1.4886635598588467
Energy: 1.317033160807609
Energy: 1.4886635598581102
Energy: 1.317033160807609
Energy: 1.253494468672444
Energy: 1.2068780821675642
Energy: 1.2534944686746532
Energy: 1.2068780821675642
Energy: 1.2534944686702354
Energy: 1.2068780821675642
Energy: 1.5564677326247995
Energy: 1.2249419486624629
Energy: 1.5564677326240632
Energy: 1.224941948664672
Energy: 1.5564677326240632
Energy: 1.2249419486631992
Energy: 1.3003840691011892
Energy: 1.2001838229779351
Energy: 1.3003788921570247
Energy: 1.2001838229779351
Energy: 1.3003722845328534
Energy: 1.2001838229779351
Energy: 1.4586145810010145
Energy: 1.5061623518605105
Energy: 1.4586145809965965
Energy: 1.5061623403181745
Energy: 1.4586145810054327
Energy: 1.5061623177487138

minimum gb energy = 1.1120641715192525 eV
minimum distance =  2.32372782664509 Angstroms
sigma value = 17


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

Energy: 1.4218245120028983
Energy: 1.261624510435169
Energy: 1.4218245120049808
Energy: 1.2616245104362105
Energy: 1.4218245120049808
Energy: 1.261624510435169
Energy: 1.2093360883309365
Energy: 1.2099847722402564
Energy: 1.2093360883298951
Energy: 1.209984772239215
Energy: 1.2093360883309365
Energy: 1.2099847722402564
Energy: 1.2626335484012796
Energy: 1.4100389572330265
Energy: 1.2626335483981554
Energy: 1.4100389572330265
Energy: 1.2626335483981554
Energy: 1.410038957231985
Energy: 1.143881881577684
Energy: 1.4284697650979232
Energy: 1.1438818815787253
Energy: 1.428469765096882
Energy: 1.1438818815787253
Energy: 1.428469765096882
Energy: 1.3863655562885435
Energy: 1.361676388879246
Energy: 1.3863655562885435
Energy: 1.361676388879246
Energy: 1.3863655562905788
Energy: 1.3616763888802874
Energy: 1.3026472604299535
Energy: 1.3581034798049894
Energy: 1.3026472604299535
Energy: 1.3581034798049894
Energy: 1.302647260430995
Energy: 1.3581034798049894
Energy: 1.2831731537338658
Energy: 1.192601831419211
Energy: 1.2831731537328244
Energy: 1.192601831419211
Energy: 1.2831731537338658
Energy: 1.1926018314202524
Energy: 1.143903926070464
Energy: 1.2806244989404272
Energy: 1.1439039260694226
Energy: 1.280624498639617
Energy: 1.143903926070464
Energy: 1.2806244989310551
Energy: 1.3723581156738864
Energy: 1.2103627735816747
Energy: 1.3723581156738864
Energy: 1.2103627735806335
Energy: 1.3723581156749276
Energy: 1.2103627735816747
Energy: 1.3004850228798144
Energy: 1.210607992658208
Energy: 1.3004850228798144
Energy: 1.210607992658208
Energy: 1.3004850228798144
Energy: 1.210607992658208
Energy: 1.2608309166971572
Energy: 1.2374149869105135
Energy: 1.2608309166981986
Energy: 1.2374149869167141
Energy: 1.2608309166971572
Energy: 1.2374149869146316
Energy: 1.2111783713820883
Energy: 1.2110722093788295
Energy: 1.2111783714976314
Energy: 1.2110722093788295
Energy: 1.2111783715444453
Energy: 1.2110722093788295
Energy: 1.1431887733807455
Energy: 1.3570256271688985
Energy: 1.1431887733807455
Energy: 1.3570256271688985
Energy: 1.1431887733807455
Energy: 1.3570256271688985
Energy: 1.2801069863909484
Energy: 1.3780725396004148
Energy: 1.2801069863899073
Energy: 1.3780725396004148
Energy: 1.2801069863909484
Energy: 1.3780725395993734
Energy: 1.3027133732444929
Energy: 1.294260477518705
Energy: 1.3027133732444929
Energy: 1.294260477518705
Energy: 1.3027133732444929
Energy: 1.2942604775207878
Energy: 1.3022731857910967
Energy: 1.3537200338153348
Energy: 1.3022731857910967
Energy: 1.3537200338153348
Energy: 1.3022731857921381
Energy: 1.3537200338153348
Energy: 1.2780568760609505
Energy: 1.2942152584138786
Energy: 1.2780568760609505
Energy: 1.2942152584107545
Energy: 1.2780568760599094
Energy: 1.2942152584138786

minimum gb energy = 1.1431887733807455 eV
minimum distance =  2.33392627737431 Angstroms
sigma value = 17


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

Energy: 1.2352654084815917
Energy: 1.1113364889332193
Energy: 1.235265408478813
Energy: 1.1113364889336212
Energy: 1.235265408479983
Energy: 1.1113364889336212
Energy: 1.1202261542256637
Energy: 1.074183502688882
Energy: 1.120226154228881
Energy: 1.0741835026880777
Energy: 1.1202261542268703
Energy: 1.0741835026876756
Energy: 1.2031778577327048
Energy: 1.2020876514758254
Energy: 1.2031778577290855
Energy: 1.2020876514758254
Energy: 1.2031778577298895
Energy: 1.2020876514766297
Energy: 1.0491287727853955
Energy: 1.1907151794658415
Energy: 1.0491287727857976
Energy: 1.1907151794654396
Energy: 1.0491287727849934
Energy: 1.1907151794650372
Energy: 1.1139644029569584
Energy: 1.073991984140367
Energy: 1.1139644029593714
Energy: 1.073991984139965
Energy: 1.1139644029609799
Energy: 1.0739919841395626
Energy: 1.2065765959287191
Energy: 1.1257632334498517
Energy: 1.2065765959271106
Energy: 1.1257632334494498
Energy: 1.2065765959291213
Energy: 1.1257632334494498
Energy: 1.1255527908736294
Energy: 1.1385543490718266
Energy: 1.1255527908724228
Energy: 1.1385543490722287
Energy: 1.1255527908744336
Energy: 1.1385543490722287
Energy: 1.2390276472144377
Energy: 1.2584020184529008
Energy: 1.2390276472164483
Energy: 1.2584020184560814
Energy: 1.2390276472160462
Energy: 1.2584020184545093
Energy: 1.1722934627564474
Energy: 1.1839002631289117
Energy: 1.172293462755241
Energy: 1.1839002631289117
Energy: 1.1722934627560453
Energy: 1.1839002631293138
Energy: 1.1224547035256636
Energy: 1.0259717915578976
Energy: 1.1224547035252617
Energy: 1.025971791558702
Energy: 1.1224547035252617
Energy: 1.025971791558702
Energy: 1.0478823979913532
Energy: 1.355848159437444
Energy: 1.047882397990549
Energy: 1.355848159437042
Energy: 1.0478823979913532
Energy: 1.3558481594378462
Energy: 1.2578185937170099
Energy: 1.1072835358852575
Energy: 1.2578185937170099
Energy: 1.1072835358856596
Energy: 1.2578185937170099
Energy: 1.1072835358848552
Energy: 1.263287862401593
Energy: 1.1055112038869832
Energy: 1.2632878624027994
Energy: 1.105511203886179
Energy: 1.263287862401593
Energy: 1.105511203886179
Energy: 1.1334962379425333
Energy: 1.2230007188311176
Energy: 1.1334962379405227
Energy: 1.2230007188315197
Energy: 1.1334962379421312
Energy: 1.2230007188311176
Energy: 1.156899963188615
Energy: 1.1068174032675735
Energy: 1.1568999631921977
Energy: 1.106817403266367
Energy: 1.1568999631917956
Energy: 1.1068174032671712
Energy: 1.0483494210938826
Energy: 1.2008178373940166
Energy: 1.0483494210954911
Energy: 1.2008178373948206
Energy: 1.0483494210938826
Energy: 1.2008178373936143
Energy: 1.151314853690822
Energy: 1.1897877373481727
Energy: 1.1513148536916262
Energy: 1.1897877373485746
Energy: 1.151314853690822
Energy: 1.1897877373477703
Energy: 1.215701640431032
Energy: 1.1726522777656525
Energy: 1.215701640431032
Energy: 1.1726522777712824
Energy: 1.2157016404306298
Energy: 1.1726522777692716
Energy: 1.1669132864903664
Energy: 1.1669444007570395
Energy: 1.1669132864907683
Energy: 1.1669444007626695
Energy: 1.1669132864907683
Energy: 1.1669444007614629
Energy: 1.1492897421207733
Energy: 1.032547916285241
Energy: 1.1492897421203712
Energy: 1.032547916284839
Energy: 1.149289742119969
Energy: 1.032547916285241
Energy: 1.166750436777802
Energy: 1.167458124799177
Energy: 1.1667504367782042
Energy: 1.1674581248031985
Energy: 1.1667504367765957
Energy: 1.1674581247987752
Energy: 1.215707702378759
Energy: 1.1722574787229456
Energy: 1.2157077023799656
Energy: 1.1722574787189242
Energy: 1.2157077023807699
Energy: 1.172257478729782
Energy: 1.1513452578928849
Energy: 1.1899323622217506
Energy: 1.1513452578928849
Energy: 1.1899323622217506
Energy: 1.1513452578936891
Energy: 1.1899323622225548
Energy: 1.0485541728080425
Energy: 1.2489267107359425
Energy: 1.0485541728080425
Energy: 1.248926710737149
Energy: 1.0485541728076406
Energy: 1.2489267107359425
Energy: 1.1571186431050604
Energy: 1.107072555826645
Energy: 1.1571186431078755
Energy: 1.10707255582946
Energy: 1.1571186431042562
Energy: 1.107072555826645
Energy: 1.1335579091861083
Energy: 1.2233174214494862
Energy: 1.1335579091861083
Energy: 1.2233174214494862
Energy: 1.1335579091865102
Energy: 1.223317421449084
Energy: 1.2631641707227297
Energy: 1.105612880324644
Energy: 1.263164170723534
Energy: 1.105612880324644
Energy: 1.2631641707227297
Energy: 1.105612880324644
Energy: 1.2578242297789575
Energy: 1.1068470732912166
Energy: 1.2578242297785556
Energy: 1.1068470732916185
Energy: 1.2578242297793598
Energy: 1.1068470732908142
Energy: 1.0478635997758403
Energy: 1.22030128167935
Energy: 1.0478635997762424
Energy: 1.220301281682165
Energy: 1.0478635997766446
Energy: 1.2203012816713072
Energy: 1.1224544877927791
Energy: 1.026005500199905
Energy: 1.1224544877919749
Energy: 1.0260055002003072
Energy: 1.1224544877927791
Energy: 1.026005500199905
Energy: 1.1724405391994124
Energy: 1.1840375439556963
Energy: 1.1724405391990103
Energy: 1.1840375439552941
Energy: 1.172440539198206
Energy: 1.1840375439560984
Energy: 1.2388547601036328
Energy: 1.2572783371120104
Energy: 1.2388547601024262
Energy: 1.257278337110804
Energy: 1.2388547601040347
Energy: 1.2572783371144234
Energy: 1.1254650138718874
Energy: 1.1387526062791584
Energy: 1.1254650138726916
Energy: 1.1387526062783542
Energy: 1.1254650138722895
Energy: 1.1387526062783542
Energy: 1.206747561117364
Energy: 1.0896030649621191
Energy: 1.2067475611169616
Energy: 1.089603064961717
Energy: 1.2067475611169616
Energy: 1.0896030649613149
Energy: 1.1139262422593736
Energy: 1.073850213566507
Energy: 1.1139262422561564
Energy: 1.0738502135653005
Energy: 1.1139262422505265
Energy: 1.0738502135673114
Energy: 1.0487145934696134
Energy: 1.2127968494398687
Energy: 1.0487145934708195
Energy: 1.2127968494398687
Energy: 1.0487145934700153
Energy: 1.2127968494402708
Energy: 1.2034442625481527
Energy: 1.2016331941327083
Energy: 1.2034442625469464
Energy: 1.2016331941327083
Energy: 1.2034442625473485
Energy: 1.2016331941323064
Energy: 1.1205035600223718
Energy: 1.0744716736992677
Energy: 1.1205035600235782
Energy: 1.0744716736984634
Energy: 1.1205035600223718
Energy: 1.0744716736996698
Energy: 1.2352654084780088
Energy: 1.1113364889368385
Energy: 1.2352654084772046
Energy: 1.1113364889372404
Energy: 1.235265408478411
Energy: 1.1113364889368385
Energy: 1.120226154230087
Energy: 1.0871501722087982
Energy: 1.1202261542276744
Energy: 1.0871501722087982
Energy: 1.120226154226468
Energy: 1.087150172207994
Energy: 1.2031778577314982
Energy: 1.2020876514734125
Energy: 1.2031778577302918
Energy: 1.202087651472206
Energy: 1.2031778577323025
Energy: 1.2020876514734125
Energy: 1.0491287727805698
Energy: 1.1907151794674136
Energy: 1.0491287727793637
Energy: 1.1907151794674136
Energy: 1.0491287727833847
Energy: 1.1907151794690223
Energy: 1.1139644029485138
Energy: 1.0739919841423777
Energy: 1.1139644029409097
Energy: 1.073991984143584
Energy: 1.113964402952133
Energy: 1.0739919841427796

minimum gb energy = 1.0259717915578976 eV
minimum distance =  2.37035095622849 Angstroms
sigma value = 57


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

Energy: 1.1181384756001205
Energy: 1.0141517104160662
Energy: 1.11813847560143
Energy: 1.0141517104167208
Energy: 1.1181384756007753
Energy: 1.0141517104167208
Energy: 1.1259520762040223
Energy: 1.103805907795486
Energy: 1.1259520762033677
Energy: 1.1038059077961409
Energy: 1.1259520762040223
Energy: 1.1038059077967957
Energy: 1.143733423416614
Energy: 1.0999258904464235
Energy: 1.1437334234172687
Energy: 1.0999258904464235
Energy: 1.143733423416614
Energy: 1.0999258904477331
Energy: 0.9670137262542154
Energy: 1.1142958246559413
Energy: 0.9670137262529059
Energy: 1.1142958246559413
Energy: 0.9670137262529059
Energy: 1.1142958246559413
Energy: 1.1303588327971856
Energy: 1.0727058230876254
Energy: 1.1303588327952212
Energy: 1.0727058230876254
Energy: 1.130358832795876
Energy: 1.0727058230876254
Energy: 1.110103851580733
Energy: 0.9984265933129445
Energy: 1.1101038515826975
Energy: 0.9984265933122897
Energy: 1.110103851580733
Energy: 0.9984265933129445
Energy: 0.9503847644008664
Energy: 1.077923897524618
Energy: 0.9503847644008664
Energy: 1.0779238975252727
Energy: 0.9503847644002117
Energy: 1.0779238975239631
Energy: 1.2528652922191446
Energy: 1.2533428997255107
Energy: 1.2528652922191446
Energy: 1.2533428997255107
Energy: 1.2528652922197994
Energy: 1.2533428997255107
Energy: 1.0179565913009478
Energy: 1.0009105138127374
Energy: 1.0179565912989834
Energy: 1.000910513813392
Energy: 1.0179565912996382
Energy: 1.0009105138127374
Energy: 1.01894711550095
Energy: 1.0364771173725245
Energy: 1.0189471155029142
Energy: 1.0364771173718699
Energy: 1.0189471155002952
Energy: 1.0364771173725245
Energy: 0.9509451839865036
Energy: 1.2702045598334122
Energy: 0.9509451839865036
Energy: 1.270204559834067
Energy: 0.9509451839858488
Energy: 1.2702045598334122
Energy: 1.062731465675773
Energy: 0.9570684769546092
Energy: 1.0627314656770825
Energy: 0.9570684769539545
Energy: 1.0627314656770825
Energy: 0.9570684769539545
Energy: 1.016693521846855
Energy: 1.0778566727538905
Energy: 1.016693521846855
Energy: 1.0778566727479975
Energy: 1.016693521846855
Energy: 1.0778566727473429
Energy: 0.9660526415247522
Energy: 1.1701016441277823
Energy: 0.9660526415227879
Energy: 1.1701016441264727
Energy: 0.9660526415254069
Energy: 1.1701016441264727
Energy: 1.1314541191861052
Energy: 1.01636997565676
Energy: 1.1314541191854506
Energy: 1.01636997565676
Energy: 1.1314541191854506
Energy: 1.0163699756574147
Energy: 1.1297748995456336
Energy: 1.1220481002088714
Energy: 1.129774899544324
Energy: 1.1220481002082165
Energy: 1.1297748995456336
Energy: 1.1220481002082165
Energy: 1.0473420010124312
Energy: 1.1393134148009398
Energy: 1.0473420010117764
Energy: 1.139313414800285
Energy: 1.0473420010117764
Energy: 1.1393134148009398
Energy: 1.0855272849330995
Energy: 1.0171831759631718
Energy: 1.0855272849317898
Energy: 1.017183175962517
Energy: 1.085527284933754
Energy: 1.0171831759638266
Energy: 1.1022792478094292
Energy: 1.1876716246934966
Energy: 1.1022792478087744
Energy: 1.1876716246928418
Energy: 1.1022792478094292
Energy: 1.1876716246934966
Energy: 1.1036485543512025
Energy: 1.1046618818103895
Energy: 1.1036485543505474
Energy: 1.1046618818110443
Energy: 1.1036485543505474
Energy: 1.1046618818103895
Energy: 1.0900246250371695
Energy: 1.2631466142584407
Energy: 1.0900246250594317
Energy: 1.2631466142597503
Energy: 1.0900246250280023
Energy: 1.2631466142590952
Energy: 1.0937336145593164
Energy: 1.1950015436419055
Energy: 1.0937336145586618
Energy: 1.1950015436419055
Energy: 1.0937336145599714
Energy: 1.19500154364256
Energy: 1.046447810584107
Energy: 1.063236095965919
Energy: 1.0464478105847617
Energy: 1.063236095965919
Energy: 1.046447810583452
Energy: 1.063236095965919
Energy: 1.0474902070614223
Energy: 1.1952744535872462
Energy: 1.0474902070614223
Energy: 1.195274453587901
Energy: 1.0474902070607675
Energy: 1.1952744535898654
Energy: 1.0490782207130018
Energy: 1.2758595657975929
Energy: 1.0490782207169305
Energy: 1.2758595657982477
Energy: 1.0490782207169305
Energy: 1.275859565798843
Energy: 1.0150793828977926
Energy: 1.0620774084716336
Energy: 1.0150793828991023
Energy: 1.0620774084716336
Energy: 1.0150793828977926
Energy: 1.0620774084716336
Energy: 0.964340660508541
Energy: 1.1873671645633996
Energy: 0.9643406605078864
Energy: 1.1873671645633996
Energy: 0.964340660508541
Energy: 1.1873671645640544

minimum gb energy = 0.9503847644002117 eV
minimum distance =  2.34324628728742 Angstroms
sigma value = 43


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

Energy: 1.2112215790878356
Energy: 0.9045887820988804
Energy: 1.2112215790868814
Energy: 0.9045887820984033
Energy: 1.2112215790878356
Energy: 0.9045887820988804
Energy: 0.9778626807819799
Energy: 1.010948798040819
Energy: 0.9778626807819799
Energy: 1.0109487980403418
Energy: 0.9778626807824571
Energy: 1.0109487980403418
Energy: 0.9695192440143168
Energy: 1.0105762860906553
Energy: 0.9695192440147938
Energy: 1.0105762860911325
Energy: 0.9695192440147938
Energy: 1.0105762860906553
Energy: 0.8890561925723187
Energy: 0.9457656623325353
Energy: 0.8890561925737499
Energy: 0.9457656623325353
Energy: 0.8890561925708874
Energy: 0.9457656623325353
Energy: 0.974935397802049
Energy: 0.8749658932203963
Energy: 0.9749353978039572
Energy: 0.8749658932242129
Energy: 0.9749353978006179
Energy: 0.8749658932156258
Energy: 0.929941002774437
Energy: 0.8913652419464778
Energy: 0.9299410027734828
Energy: 0.8913652419455238
Energy: 0.929941002774437
Energy: 0.8913652419464778
Energy: 1.0699097823016204
Energy: 0.9247375447370727
Energy: 1.0699097823006665
Energy: 0.9247375447361186
Energy: 1.0699097823001893
Energy: 0.9247375447380268
Energy: 0.9793764490233254
Energy: 1.034010313893145
Energy: 0.9793764490223712
Energy: 1.0340103138926677
Energy: 0.9793764490238025
Energy: 1.034010313893145
Energy: 0.8881325708544043
Energy: 0.8781718512427179
Energy: 0.8881325708544043
Energy: 0.878171851243195
Energy: 0.8881325708553585
Energy: 0.8781718512427179
Energy: 0.9902765878433442
Energy: 0.8814090636915608
Energy: 0.99027658784239
Energy: 0.8814090636906067
Energy: 0.99027658784239
Energy: 0.8814090636915608
Energy: 1.0708270972363267
Energy: 1.0596937606756096
Energy: 1.070827097236804
Energy: 1.0596937606751324
Energy: 1.0708270972358496
Energy: 1.0596937606751324
Energy: 0.8472575546687597
Energy: 0.9653790764697938
Energy: 0.8472575546697139
Energy: 0.9653790764693168
Energy: 0.8472575546697139
Energy: 0.9653790764693168
Energy: 0.9892806083165638
Energy: 0.8374031894936141
Energy: 0.9892806083170409
Energy: 0.8374031894936141
Energy: 0.9892806083165638
Energy: 0.8374031894940912
Energy: 1.0609287524835431
Energy: 1.0641937353265631
Energy: 1.0609287524835431
Energy: 1.0641937353265631
Energy: 1.0609287524840203
Energy: 1.0641937353265631
Energy: 0.8736159741190711
Energy: 0.9658028223778906
Energy: 0.873615974118594
Energy: 0.9658028223778906
Energy: 0.8736159741195482
Energy: 0.9658028223774136
Energy: 1.0159296391036488
Energy: 0.9279413646270476
Energy: 1.0159296391031718
Energy: 0.9279413646265705
Energy: 1.015929639104126
Energy: 0.9279413646270476
Energy: 0.9878324969714583
Energy: 1.0627711776274449
Energy: 0.9878324969695498
Energy: 1.0627711776274449
Energy: 0.9878324969709811
Energy: 1.0627711776269677
Energy: 0.9009859609820072
Energy: 0.8396316083103564
Energy: 0.9009859609805759
Energy: 0.839631608307494
Energy: 0.9009859609815302
Energy: 0.8396316083060628
Energy: 0.9544878346565941
Energy: 0.9667777294295938
Energy: 0.9544878346565941
Energy: 0.9667777294295938
Energy: 0.9544878346561171
Energy: 0.9667777294295938
Energy: 1.1154683115166704
Energy: 0.9593796325138869
Energy: 1.115468311515239
Energy: 0.9593796325138869
Energy: 1.1154683115157162
Energy: 0.95937963251341
Energy: 0.9668102846156454
Energy: 0.8952420193937487
Energy: 0.9668102846132601
Energy: 0.8952420193932716
Energy: 0.9668102846137372
Energy: 0.8952420193932716
Energy: 1.0228979806366447
Energy: 0.9740422386407063
Energy: 1.0228979806361678
Energy: 0.9740422386407063
Energy: 1.0228979806366447
Energy: 0.9740422386407063
Energy: 0.9299693854531689
Energy: 0.9693210719778562
Energy: 0.9299693854526918
Energy: 0.9693210719778562
Energy: 0.9299693854522147
Energy: 0.9693210719773792
Energy: 1.025883697188805
Energy: 0.8963344445114748
Energy: 1.025883697188805
Energy: 0.896334444512906
Energy: 1.025883697188805
Energy: 0.8963344445114748
Energy: 0.9547439883752564
Energy: 0.9542230917597885
Energy: 0.9547439883766875
Energy: 0.9542230917597885
Energy: 0.9547439883747793
Energy: 0.9542230917593114
Energy: 0.9475023206478895
Energy: 0.9401395293733015
Energy: 0.9475023206474124
Energy: 0.9401395293728244
Energy: 0.9475023206474124
Energy: 0.9401395293733015
Energy: 0.8999489071688449
Energy: 1.099894855843175
Energy: 0.8999489071683678
Energy: 1.099894855843175
Energy: 0.899948907169322
Energy: 1.099894855842698
Energy: 0.9085885736882479
Energy: 0.9450820479370552
Energy: 0.9085885736887249
Energy: 0.9450820479351469
Energy: 0.9085885736877708
Energy: 0.9450820479375324
Energy: 0.8668986238513713
Energy: 0.8906596783564755
Energy: 0.8668986238499401
Energy: 0.8906596783564755
Energy: 0.8668986238513713
Energy: 0.8906596783569523
Energy: 0.8732905179802536
Energy: 0.8022925808938162
Energy: 0.8732905179802536
Energy: 0.8022925808914309
Energy: 0.8732905179802536
Energy: 0.8022925808914309
Energy: 0.9228368093339242
Energy: 0.9433018881518476
Energy: 0.9228368093339242
Energy: 0.9433018881518476
Energy: 0.9228368093339242
Energy: 0.9433018881523246
Energy: 0.8676423565888159
Energy: 0.8591512367685432
Energy: 0.8676423565869076
Energy: 0.8591512367685432
Energy: 0.8676423565869076
Energy: 0.8591512367685432
Energy: 0.842840755238068
Energy: 0.9540210147803464
Energy: 0.842840755238068
Energy: 0.9540210147798692
Energy: 0.842840755238068
Energy: 0.9540210147803464
Energy: 1.0673202756121722
Energy: 1.0542067369613781
Energy: 1.067320275612649
Energy: 1.0542067369618549
Energy: 1.067320275611218
Energy: 1.0542067369613781
Energy: 0.903258777941967
Energy: 0.8332698401725985
Energy: 0.9032587779414899
Energy: 0.8332698401735527
Energy: 0.9032587779414899
Energy: 0.8332698401730756
Energy: 0.7764564021827529
Energy: 0.95217641817952
Energy: 0.7764564021837069
Energy: 0.95217641817952
Energy: 0.7764564021832299
Energy: 0.95217641817952

minimum gb energy = 0.7764564021827529 eV
minimum distance =  2.32765736945634 Angstroms
sigma value = 81


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

Energy: 0.03585684295078038
Energy: 0.08745132517726144
Energy: 0.03585684295078038
Energy: 0.08745132517726144
Energy: 0.03585684295078038
Energy: 0.0874513251790143
Energy: 0.8232955234908912
Energy: 0.08744788110867312
Energy: 0.823295523492644
Energy: 0.08744788089315027
Energy: 0.823295523492644
Energy: 0.0874478810788744
Energy: 0.8233174794260303
Energy: 0.08937401493799522
Energy: 0.8233174794242774
Energy: 0.08937401493624238
Energy: 0.8233174794242774
Energy: 0.08937401482059304
Energy: 0.03585684295078038
Energy: 0.08745132517726144
Energy: 0.03585684295078038
Energy: 0.0874513251790143
Energy: 0.03585684295078038
Energy: 0.08745132517726144
Energy: 0.823295523492644
Energy: 0.08744789504300245
Energy: 0.823295523492644
Energy: 0.08744789488882991
Energy: 0.823295523492644
Energy: 0.08744789519546196
Energy: 0.8233174794242774
Energy: 0.08937399371492998
Energy: 0.8233174794242774
Energy: 0.08937399341009064
Energy: 0.8233174794242774
Energy: 0.08937399353972304
Energy: 0.03585684295078038
Energy: 0.0874513251790143
Energy: 0.03585684295078038
Energy: 0.0874513251790143
Energy: 0.03585684295078038
Energy: 0.0874513251790143
Energy: 0.823295523492644
Energy: 0.0874479058831646
Energy: 0.8232955234908912
Energy: 0.08744790584639424
Energy: 0.823295523492644
Energy: 0.08744790567995164
Energy: 0.8233174794242774
Energy: 0.08937397356067484
Energy: 0.8233174794242774
Energy: 0.08937397304031262
Energy: 0.8233174794242774
Energy: 0.08937397307883584
Energy: 0.03585684295078038
Energy: 0.08745132517726144
Energy: 0.03585684295078038
Energy: 0.0874513251790143
Energy: 0.03585684295078038
Energy: 0.08745132517726144

minimum gb energy = 0.03585684295078038 eV
minimum distance =  2.53030978077449 Angstroms
sigma value = 3


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

Energy: 0.9145607004054281
Energy: 0.8154814267269096
Energy: 0.9145607004054281
Energy: 0.8154814267258604
Energy: 0.9145607004049036
Energy: 0.8154814267258604
Energy: 0.7794640084536815
Energy: 0.7762530353585144
Energy: 0.7794640084526323
Energy: 0.7762530353585144
Energy: 0.7794640084531569
Energy: 0.7762530353585144
Energy: 0.8051836993864568
Energy: 0.7770841895346567
Energy: 0.8051836993848832
Energy: 0.7770841895351813
Energy: 0.8051836993859323
Energy: 0.7770841895346567
Energy: 0.7647176808044973
Energy: 0.8294818431090134
Energy: 0.7647176808050219
Energy: 0.8294818431084889
Energy: 0.7647176808050219
Energy: 0.8294818431079642
Energy: 0.7200699658467633
Energy: 0.7811494436768135
Energy: 0.7200699658467633
Energy: 0.781149443677338
Energy: 0.7200699658467633
Energy: 0.7811494436768135
Energy: 0.804401587107493
Energy: 0.7783373326812656
Energy: 0.8044015871090668
Energy: 0.7783373326817902
Energy: 0.8044015871080176
Energy: 0.7783373326817902
Energy: 0.7653642536123981
Energy: 0.8782777018486968
Energy: 0.7653642536123981
Energy: 0.8782777018502703
Energy: 0.7653642536134473
Energy: 0.8782777018497459
Energy: 0.7748715067751571
Energy: 0.7856770261953195
Energy: 0.7748715067751571
Energy: 0.7856770261958441
Energy: 0.7748715067762063
Energy: 0.7856770261953195
Energy: 0.8123243330588237
Energy: 0.7734055913484813
Energy: 0.8123243330577744
Energy: 0.7734055913484813
Energy: 0.812324333059348
Energy: 0.7734055913490059
Energy: 0.7648531032149599
Energy: 0.7637297896955907
Energy: 0.7648531032154843
Energy: 0.7637297896961154
Energy: 0.7648531032144352
Energy: 0.7637297896961154
Energy: 0.8188736876005915
Energy: 0.7657007862853009
Energy: 0.8188736876005915
Energy: 0.7657007862863501
Energy: 0.8188736876005915
Energy: 0.7657007862858256
Energy: 0.8277270423979775
Energy: 0.8308909106113267
Energy: 0.827727042398502
Energy: 0.8308909106108019
Energy: 0.827727042398502
Energy: 0.8308909106108019
Energy: 0.7856981086302921
Energy: 0.7258095628848618
Energy: 0.7856981086302921
Energy: 0.7258095628848618
Energy: 0.7856981086302921
Energy: 0.7258095628848618
Energy: 0.8449312260637868
Energy: 0.8025748727558125
Energy: 0.8449312260632623
Energy: 0.8025748727552879
Energy: 0.844931226062213
Energy: 0.8025748727552879
Energy: 0.772262160142465
Energy: 0.8122786974454737
Energy: 0.7722621601419405
Energy: 0.8122786974454737
Energy: 0.7722621601419405
Energy: 0.8122786974454737
Energy: 0.772233067729321
Energy: 0.7192788341808222
Energy: 0.7722330677314192
Energy: 0.7192788341813469
Energy: 0.7722330677303701
Energy: 0.7192788341808222
Energy: 0.7949745358553019
Energy: 0.8452405161728922
Energy: 0.7949745358553019
Energy: 0.8452405161728922
Energy: 0.7949745358553019
Energy: 0.8452405161734168
Energy: 0.7726223531051577
Energy: 0.788380767297178
Energy: 0.7726223531051577
Energy: 0.7883807672966535
Energy: 0.7726223531051577
Energy: 0.788380767297178
Energy: 0.7738298133526106
Energy: 0.7633820606197055
Energy: 0.7738298133526106
Energy: 0.7633820606197055
Energy: 0.7738298133526106
Energy: 0.7633820606197055
Energy: 0.7773863622532771
Energy: 0.8940643768292431
Energy: 0.7773863622522279
Energy: 0.8940643768292431
Energy: 0.7773863622532771
Energy: 0.8940643768297675
Energy: 0.8433526221805822
Energy: 0.8020961050289683
Energy: 0.8433526221795331
Energy: 0.8020961050289683
Energy: 0.8433526221790086
Energy: 0.8020961050284438
Energy: 0.7536586664224635
Energy: 0.7736669851111823
Energy: 0.7536586664203654
Energy: 0.7736669851111823
Energy: 0.7536586664235126
Energy: 0.7736669851106577
Energy: 0.8161206117371338
Energy: 0.7689235964011654
Energy: 0.81612061173556
Energy: 0.7689235964011654
Energy: 0.8161206117408055
Energy: 0.7689235964006408
Energy: 0.8143854734672162
Energy: 0.7804459177058303
Energy: 0.814385473465118
Energy: 0.7804459177063546
Energy: 0.8143854734666914
Energy: 0.7804459177058303
Energy: 0.7872836735420858
Energy: 0.8001173145926993
Energy: 0.7872836735415614
Energy: 0.8001173145926993
Energy: 0.7872836735415614
Energy: 0.8001173145926993
Energy: 0.8111169746343632
Energy: 0.766874389701642
Energy: 0.8111169746343632
Energy: 0.766874389701642
Energy: 0.8111169746364137
Energy: 0.766874389701642
Energy: 0.9130643693351272
Energy: 0.7724822811169072
Energy: 0.9130643693361765
Energy: 0.7724822811169072
Energy: 0.9130643693351272
Energy: 0.7724822811169072
Energy: 0.7649190099605448
Energy: 0.8135440721064914
Energy: 0.7649190099605448
Energy: 0.8135440721059668
Energy: 0.7649190099600204
Energy: 0.8135440721059668
Energy: 0.7870207366646602
Energy: 0.7875333349807103
Energy: 0.7870207366651847
Energy: 0.7875333349812349
Energy: 0.7870207366641354
Energy: 0.7875333349807103
Energy: 0.9193871619047144
Energy: 0.8258411788408238
Energy: 0.9193871619036653
Energy: 0.8258411788402993
Energy: 0.9193871619041898
Energy: 0.8258411788402993
Energy: 0.8221043488535648
Energy: 0.8105835280899475
Energy: 0.8221043488525157
Energy: 0.8105835280899475
Energy: 0.8221043488540893
Energy: 0.8105835280899475
Energy: 0.758488804193607
Energy: 0.7776345874426694
Energy: 0.758488804193607
Energy: 0.7776345874426694
Energy: 0.758488804193607
Energy: 0.7776345874426694
Energy: 0.7881264009712983
Energy: 0.8076892833199821
Energy: 0.7881264009707738
Energy: 0.8076892833194576
Energy: 0.7881264009718228
Energy: 0.8076892833199821

minimum gb energy = 0.7192788341808222 eV
minimum distance =  2.40055444912752 Angstroms
sigma value = 67


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

Energy: 1.0622303432531148
Energy: 1.0425570306420424
Energy: 1.06223034325162
Energy: 1.0425570306405474
Energy: 1.0622303432538622
Energy: 1.0425570306412948
Energy: 0.9896478512960919
Energy: 1.0006877275760884
Energy: 0.9896478512953445
Energy: 1.000687727575341
Energy: 0.9896478512968392
Energy: 1.0006877275760884
Energy: 1.0318383191520388
Energy: 0.9992743614308668
Energy: 1.0318383191520388
Energy: 0.9992743614308668
Energy: 1.0318383191512914
Energy: 0.9992743614308668
Energy: 1.0121514213475216
Energy: 1.0413700858364352
Energy: 1.0121514213475216
Energy: 1.0413700858364352
Energy: 1.0121514213475216
Energy: 1.0413700858349404
Energy: 0.9581135860429434
Energy: 0.9784310267345345
Energy: 0.9581135860444382
Energy: 0.9784310267345345
Energy: 0.9581135860444382
Energy: 0.9784310267345345
Energy: 1.026550404006109
Energy: 0.9805284888376223
Energy: 1.0265504040068565
Energy: 0.9805284888376223
Energy: 1.026550404009099
Energy: 0.9805284888383696
Energy: 0.9715172397541553
Energy: 1.004401009768207
Energy: 0.9715172397563975
Energy: 1.004401009768207
Energy: 0.97151723975565
Energy: 1.004401009768207
Energy: 1.0252198178987733
Energy: 0.9827063732652273
Energy: 1.0252198178995207
Energy: 0.9827063732667223
Energy: 1.0252198178972782
Energy: 0.9827063732659748
Energy: 1.049137830681625
Energy: 1.0679854733046723
Energy: 1.0491378306831198
Energy: 1.067985473303925
Energy: 1.0491378306831198
Energy: 1.0679854733046723
Energy: 0.9688985901761282
Energy: 0.9505127191923295
Energy: 0.9688985901761282
Energy: 0.9505127191923295
Energy: 0.9688985901768755
Energy: 0.9505127191923295
Energy: 1.021521986330943
Energy: 0.9837008100261789
Energy: 1.021521986330943
Energy: 0.9837008100261789
Energy: 1.0215219863301954
Energy: 0.9837008100261789
Energy: 0.9675327557034683
Energy: 1.0216013876496566
Energy: 0.9675327557027208
Energy: 1.0216013876496566
Energy: 0.9675327557034683
Energy: 1.0216013876496566
Energy: 0.9664458830420358
Energy: 0.9709940588105269
Energy: 0.9664458830435305
Energy: 0.9709940588105269
Energy: 0.9664458830427832
Energy: 0.9709940588105269
Energy: 1.0088297028780473
Energy: 0.9881318020331176
Energy: 1.0088297028772997
Energy: 0.9881318020331176
Energy: 1.0088297028787947
Energy: 0.9881318020346126
Energy: 0.9995951097413242
Energy: 0.9863235884419137
Energy: 0.9995951097420717
Energy: 0.9863235884419137
Energy: 0.9995951097413242
Energy: 0.9863235884419137
Energy: 1.0176427505095447
Energy: 1.001457914387554
Energy: 1.0176427505095447
Energy: 1.0014579143883013
Energy: 1.0176427505102918
Energy: 1.0014579143868065
Energy: 1.0591767352054033
Energy: 0.9976239475254635
Energy: 1.0591767352054033
Energy: 0.9976239475254635
Energy: 1.059176735204656
Energy: 0.9976239475254635
Energy: 1.0141909145614305
Energy: 0.9646351135242609
Energy: 1.0141909145614305
Energy: 0.9646351135242609
Energy: 1.0141909145614305
Energy: 0.9646351135242609
Energy: 0.9725205393349786
Energy: 1.03757790229471
Energy: 0.972520539334231
Energy: 1.03757790229471
Energy: 0.972520539334231
Energy: 1.03757790229471
Energy: 0.9539861133115992
Energy: 1.0016063187537385
Energy: 0.9539861133123468
Energy: 1.0016063187544861
Energy: 0.9539861133130941
Energy: 1.0016063187544861
Energy: 1.0587618406178083
Energy: 0.9689650783671958
Energy: 1.0587618406163133
Energy: 0.9689650783664485
Energy: 1.058761840617061
Energy: 0.9689650783664485
Energy: 1.014167190810761
Energy: 1.0686031657485642
Energy: 1.0141671908115084
Energy: 1.0686031657485642
Energy: 1.0141671908115084
Energy: 1.0686031657485642
Energy: 0.9754379933829735
Energy: 0.9992191216905717
Energy: 0.9754379933844685
Energy: 0.9992191216905717
Energy: 0.9754379933822263
Energy: 0.9992191216905717

minimum gb energy = 0.9505127191923295 eV
minimum distance =  2.40004559097469 Angstroms
sigma value = 33


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

Energy: 1.1916027169950414
Energy: 1.1705967877774324
Energy: 1.1916027169955157
Energy: 1.1705967877798031
Energy: 1.1916027169955157
Energy: 1.170596787779329
Energy: 1.1342751567637221
Energy: 1.1099925530251495
Energy: 1.134275156766093
Energy: 1.1099925530251495
Energy: 1.1342751567641962
Energy: 1.1099925530251495
Energy: 1.1797570990035542
Energy: 1.1056693831818964
Energy: 1.1797570990049766
Energy: 1.1056693831818964
Energy: 1.1797570990040283
Energy: 1.1056693831823707
Energy: 1.1455515003908072
Energy: 1.2055550312642889
Energy: 1.1455515003898589
Energy: 1.2055550312642889
Energy: 1.1455515003912813
Energy: 1.2055550312642889
Energy: 1.1293638652502154
Energy: 1.098368148666326
Energy: 1.129363865248793
Energy: 1.0983681486667998
Energy: 1.1293638652497413
Energy: 1.0983681486667998
Energy: 1.2358452456676898
Energy: 1.1175479458265787
Energy: 1.2358452456667417
Energy: 1.1175479458265787
Energy: 1.2358452456676898
Energy: 1.1175479458265787
Energy: 1.1321107408059299
Energy: 1.1492374727479655
Energy: 1.1321107408073523
Energy: 1.1492374727484396
Energy: 1.1321107408068782
Energy: 1.1492374727479655
Energy: 1.185457987414023
Energy: 1.1303242712176969
Energy: 1.185457987414497
Energy: 1.1303242712176969
Energy: 1.1854579874135487
Energy: 1.130324271218171
Energy: 1.093583062564279
Energy: 1.1863162972236025
Energy: 1.0935830625638048
Energy: 1.1863162972231283
Energy: 1.093583062564279
Energy: 1.1863162972236025
Energy: 1.1703642607102478
Energy: 1.143388774716862
Energy: 1.170364260710722
Energy: 1.143388774716388
Energy: 1.1703642607111964
Energy: 1.143388774716862
Energy: 1.1710092342869332
Energy: 1.0982053158685616
Energy: 1.171009234286459
Energy: 1.0982053158685616
Energy: 1.1710092342869332
Energy: 1.0982053158680876
Energy: 1.1346063846555086
Energy: 1.140648943461911
Energy: 1.1346063846531378
Energy: 1.1406489434609626
Energy: 1.1346063846550345
Energy: 1.1406489434614369
Energy: 1.1736596962896193
Energy: 1.1262535762305352
Energy: 1.1736596962886712
Energy: 1.1262535762300612
Energy: 1.1736596962900934
Energy: 1.1262535762305352
Energy: 1.1240068610645826
Energy: 1.0981892804353182
Energy: 1.1240068610669531
Energy: 1.0981892804357922
Energy: 1.124006861065531
Energy: 1.0981892804362663
Energy: 1.1571913143627939
Energy: 1.1442910504685626
Energy: 1.1571913143623198
Energy: 1.1442910504685626
Energy: 1.1571913143627939
Energy: 1.144291050469037
Energy: 1.1452928315390232
Energy: 1.1700161965201747
Energy: 1.145292831538075
Energy: 1.1700161965192266
Energy: 1.1452928315390232
Energy: 1.1700161965211233
Energy: 1.1183469968046003
Energy: 1.1064478242942202
Energy: 1.1183469968031778
Energy: 1.1064478242942202
Energy: 1.1183469968031778
Energy: 1.1064478242946945
Energy: 1.2013595460075646
Energy: 1.2093318493737022
Energy: 1.2013595460075646
Energy: 1.2093318493741765
Energy: 1.2013595460051936
Energy: 1.2093318493737022
Energy: 1.1148079398262
Energy: 1.2033204219195048
Energy: 1.1148079398257258
Energy: 1.2033204219209273
Energy: 1.1148079398257258
Energy: 1.2033204219199791
Energy: 1.1792840397495923
Energy: 1.1034210450706237
Energy: 1.1792840397481699
Energy: 1.103421045071098
Energy: 1.179284039749118
Energy: 1.103421045071098
Energy: 1.1318897468934181
Energy: 1.1754379872928695
Energy: 1.1318897468948408
Energy: 1.1754379872933438
Energy: 1.1318897468938924
Energy: 1.1754379872928695
Energy: 1.1549725040962602
Energy: 1.1183548425023186
Energy: 1.154972504095312
Energy: 1.1183548425018444
Energy: 1.1549725040962602
Energy: 1.1183548425023186
Energy: 1.203552852216394
Energy: 1.0982187257919913
Energy: 1.203552852214023
Energy: 1.0982187257929394
Energy: 1.2035528522154457
Energy: 1.0982187257896205
Energy: 1.1700150382227081
Energy: 1.2108299444566188
Energy: 1.1700150382231822
Energy: 1.154155786766036
Energy: 1.1700150382231822
Energy: 1.154155786766036
Energy: 1.1306479285734998
Energy: 1.126774131799094
Energy: 1.1306479285725515
Energy: 1.126774131799094
Energy: 1.130647928573974
Energy: 1.126774131799094
Energy: 1.204140007817923
Energy: 1.1329733933565125
Energy: 1.2041400078198192
Energy: 1.1329733933565125
Energy: 1.2041400078202935
Energy: 1.1329733933569868
Energy: 1.1318323386718756
Energy: 1.1161614328373508
Energy: 1.1318323386714013
Energy: 1.116161432837825
Energy: 1.131832338670453
Energy: 1.1161614328373508
Energy: 1.135257742988611
Energy: 1.2272181802735251
Energy: 1.135257742989085
Energy: 1.2272181802739992
Energy: 1.135257742988137
Energy: 1.2272181802739992
Energy: 1.1743591830082296
Energy: 1.0981989962652192
Energy: 1.1743591830068074
Energy: 1.0981989962647452
Energy: 1.1743591830077555
Energy: 1.0981989962647452
Energy: 1.14123369221685
Energy: 1.1442454304394754
Energy: 1.1412336922163757
Energy: 1.1442454304394754
Energy: 1.141233692217324
Energy: 1.1442454304404237
Energy: 1.2353016107337988
Energy: 1.2106612095573708
Energy: 1.2353016107342727
Energy: 1.2106612095568965
Energy: 1.2353016107342727
Energy: 1.2106612095573708
Energy: 1.1323302905974615
Energy: 1.1040897292427514
Energy: 1.1323302905984096
Energy: 1.1040897292436997
Energy: 1.1323302905974615
Energy: 1.1040897292427514
Energy: 1.1435810228190386
Energy: 1.1691767408586733
Energy: 1.1435810228180903
Energy: 1.169176740858199
Energy: 1.1435810228190386
Energy: 1.1691767408586733
Energy: 1.1595367358146293
Energy: 1.1082680273527514
Energy: 1.1595367358141553
Energy: 1.1082680273522774
Energy: 1.1595367358151036
Energy: 1.1082680273527514
Energy: 1.129073636806079
Energy: 1.1067012620337708
Energy: 1.129073636803708
Energy: 1.1067012620337708
Energy: 1.129073636805605
Energy: 1.1067012620337708
Energy: 1.1841971227115082
Energy: 1.1193582769507162
Energy: 1.1841971227096117
Energy: 1.1193582769516646
Energy: 1.184197122713405
Energy: 1.1193582769511903
Energy: 1.133804451825111
Energy: 1.154563501488553
Energy: 1.1338044518217918
Energy: 1.154563501488553
Energy: 1.1338044518232142
Energy: 1.154563501488553

minimum gb energy = 1.0935830625638048 eV
minimum distance =  2.37178311276003 Angstroms
sigma value = 41


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

Energy: 1.378310279889931
Energy: 1.4616771406389306
Energy: 1.378310279889931
Energy: 1.4616771406376363
Energy: 1.378310279889931
Energy: 1.4616771406363416
Energy: 1.3757578446568564
Energy: 1.3323186452402973
Energy: 1.3757578446568564
Energy: 1.3323186452402973
Energy: 1.3757578446568564
Energy: 1.3323186452402973
Energy: 1.5081641555769283
Energy: 1.327524783744807
Energy: 1.5081641555782228
Energy: 1.327524783744807
Energy: 1.5081641555769283
Energy: 1.327524783744807
Energy: 1.360763183492129
Energy: 1.4280906994129854
Energy: 1.360763183492129
Energy: 1.4280906994116909
Energy: 1.3607631834908345
Energy: 1.4280906994116909
Energy: 1.4344616163056356
Energy: 1.3474272147728683
Energy: 1.434461616304341
Energy: 1.3474272147728683
Energy: 1.4344616163056356
Energy: 1.3474272147728683
Energy: 1.4997813360064896
Energy: 1.461057932548624
Energy: 1.4997813360077843
Energy: 1.4610579325499184
Energy: 1.4997813360064896
Energy: 1.4610579325499184
Energy: 1.3725702299563143
Energy: 1.3381157098071863
Energy: 1.3725702299550195
Energy: 1.3381157098071863
Energy: 1.3725702299563143
Energy: 1.3381157098071863
Energy: 1.4069964469931802
Energy: 1.3326730586699833
Energy: 1.406996446990591
Energy: 1.332673058671278
Energy: 1.4069964469918856
Energy: 1.332673058671278
Energy: 1.372991166198671
Energy: 1.3762369090307585
Energy: 1.372991166198671
Energy: 1.3762369090307585
Energy: 1.372991166198671
Energy: 1.3762369090307585
Energy: 1.3627741641929558
Energy: 1.376641360571652
Energy: 1.3627741641929558
Energy: 1.3766413605703576
Energy: 1.3627741641929558
Energy: 1.3766413605703576
Energy: 1.3719665335785103
Energy: 1.3276968521394656
Energy: 1.3719665335772158
Energy: 1.3276968521394656
Energy: 1.3719665335785103
Energy: 1.3276968521394656
Energy: 1.4102310678635133
Energy: 1.3316867871076097
Energy: 1.4102310678635133
Energy: 1.3316867871076097
Energy: 1.4102310678635133
Energy: 1.3316867871076097
Energy: 1.3749707775554068
Energy: 1.430732088324278
Energy: 1.3749707775554068
Energy: 1.4307320883255723
Energy: 1.3749707775554068
Energy: 1.4307320883255723
Energy: 1.465471723597846
Energy: 1.3326919618876567
Energy: 1.4654717235991406
Energy: 1.3326919618876567
Energy: 1.4654717235991406
Energy: 1.3326919618876567

minimum gb energy = 1.327524783744807 eV
minimum distance =  2.36295733044848 Angstroms
sigma value = 11


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

Energy: 1.6067154863620934
Energy: 1.5800073411084359
Energy: 1.6067154863609563
Energy: 1.5800073411084359
Energy: 1.606715486361525
Energy: 1.5800073411084359
Energy: 1.5781742440931064
Energy: 1.4989970186181378
Energy: 1.578174244093675
Energy: 1.4989970186181378
Energy: 1.578174244093675
Energy: 1.4989970186181378
Energy: 1.6225379964327493
Energy: 1.5337055353808269
Energy: 1.6225379964327493
Energy: 1.5337055353808269
Energy: 1.6225379964321807
Energy: 1.5337055353808269
Energy: 1.600520108525657
Energy: 1.5748603249406863
Energy: 1.6005201085262255
Energy: 1.5748603249406863
Energy: 1.6005201085267944
Energy: 1.5748603249406863
Energy: 1.6688094724661686
Energy: 1.5535028147199998
Energy: 1.6688094724667377
Energy: 1.5535028147194312
Energy: 1.6688094724661686
Energy: 1.5535028147194312
Energy: 1.5751343496357986
Energy: 1.6138838814715553
Energy: 1.5751343496363672
Energy: 1.6138838814715553
Energy: 1.5751343496357986
Energy: 1.6138838814709868
Energy: 1.573675162386371
Energy: 1.6387041776829026
Energy: 1.5736751623858023
Energy: 1.6387041776829026
Energy: 1.573675162386371
Energy: 1.6387041776829026
Energy: 1.5812213523667449
Energy: 1.5336172785867452
Energy: 1.5812213523656076
Energy: 1.5336172785867452
Energy: 1.5812213523656076
Energy: 1.5336172785867452
Energy: 1.6302469442167429
Energy: 1.527046209799992
Energy: 1.6302469442173115
Energy: 1.527046209799992
Energy: 1.6302469442173115
Energy: 1.527046209799992
Energy: 1.5357277545876884
Energy: 1.6636966345492326
Energy: 1.5357277545882573
Energy: 1.6636966345486637
Energy: 1.5357277545876884
Energy: 1.6636966345486637
Energy: 1.5824238843235825
Energy: 1.537053410204095
Energy: 1.5824238843235825
Energy: 1.537053410203526
Energy: 1.5824238843235825
Energy: 1.537053410204095
Energy: 1.6119031563701558
Energy: 1.5879753896395852
Energy: 1.6119031563695871
Energy: 1.5879753896390163
Energy: 1.6119031563701558
Energy: 1.5879753896390163
Energy: 1.6046620051701928
Energy: 1.624827950130263
Energy: 1.6046620051707619
Energy: 1.624827950130263
Energy: 1.6046620051701928
Energy: 1.6248279501308314
Energy: 1.661801546290371
Energy: 1.5596565666166062
Energy: 1.66180154629094
Energy: 1.5596565666166062
Energy: 1.661801546290371
Energy: 1.5596565666166062
Energy: 1.6303140579446023
Energy: 1.5832195967258185
Energy: 1.6303140579446023
Energy: 1.5832195967258185
Energy: 1.6303140579446023
Energy: 1.5832195967258185
Energy: 1.5645155968297473
Energy: 1.602417396320014
Energy: 1.5645155968297473
Energy: 1.602417396320014
Energy: 1.5645155968297473
Energy: 1.602417396320014
Energy: 1.541440046046862
Energy: 1.5274291065451606
Energy: 1.5414400460479993
Energy: 1.5274291065457295
Energy: 1.541440046046862
Energy: 1.5274291065457295
Energy: 1.5677967579428724
Energy: 1.5672227950488355
Energy: 1.5677967579428724
Energy: 1.5672227950488355
Energy: 1.5677967579428724
Energy: 1.5672227950488355
Energy: 1.5548454380420593
Energy: 1.5841822319400054
Energy: 1.5548454380431969
Energy: 1.5841822319400054
Energy: 1.5548454380426278
Energy: 1.5841822319400054
Energy: 1.6794657632351275
Energy: 1.5460400728467356
Energy: 1.6794657632345589
Energy: 1.5460400728467356
Energy: 1.6794657632351275
Energy: 1.5460400728473043
Energy: 1.5724154351620843
Energy: 1.6284146543856475
Energy: 1.5724154351615158
Energy: 1.6284146543856475
Energy: 1.5724154351615158
Energy: 1.6284146543856475
Energy: 1.6015985024167814
Energy: 1.616064731469057
Energy: 1.6015985024179187
Energy: 1.616064731469057
Energy: 1.6015985024173505
Energy: 1.616064731469057
Energy: 1.6168100753029848
Energy: 1.53371785287501
Energy: 1.616810075301847
Energy: 1.53371785287501
Energy: 1.6168100753024162
Energy: 1.5337178528744415
Energy: 1.6322021356364325
Energy: 1.5194686571531648
Energy: 1.6322021356347265
Energy: 1.5194686571531648
Energy: 1.6322021356358638
Energy: 1.5194686571531648
Energy: 1.5630462345393816
Energy: 1.6151169375116927
Energy: 1.5630462345388128
Energy: 1.6151169375116927
Energy: 1.5630462345393816
Energy: 1.615116937511124
Energy: 1.6088902113826116
Energy: 1.545538807827443
Energy: 1.6088902113831804
Energy: 1.545538807827443
Energy: 1.6088902113826116
Energy: 1.5455388078268744
Energy: 1.5123825674985178
Energy: 1.647201997679614
Energy: 1.5123825674990867
Energy: 1.647201997679614
Energy: 1.5123825674985178
Energy: 1.647201997679614
Energy: 1.542294288073278
Energy: 1.5867025721874188
Energy: 1.542294288073278
Energy: 1.5867025721879875
Energy: 1.542294288073278
Energy: 1.5867025721879875
Energy: 1.588207188932641
Energy: 1.5557694238352808
Energy: 1.5882071889320728
Energy: 1.5557694238358495
Energy: 1.588207188932641
Energy: 1.5557694238352808
Energy: 1.590517965491657
Energy: 1.5717506159629417
Energy: 1.5905179654910884
Energy: 1.5717506159623726
Energy: 1.590517965491657
Energy: 1.5717506159623726
Energy: 1.5550526068162007
Energy: 1.643094487890064
Energy: 1.5550526068167694
Energy: 1.6430944878894953
Energy: 1.5550526068167694
Energy: 1.6430944878894953

minimum gb energy = 1.4989970186181378 eV
minimum distance =  2.32476611276122 Angstroms
sigma value = 57


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

Energy: 1.6771749795886104
Energy: 1.74048217323669
Energy: 1.6771749795875985
Energy: 1.74048217323669
Energy: 1.6771749795875985
Energy: 1.7404821732356779
Energy: 1.5600500576827507
Energy: 1.6590316085756136
Energy: 1.5600500576807266
Energy: 1.6590316085756136
Energy: 1.5600500576817389
Energy: 1.6590316085756136
Energy: 1.6856040312249754
Energy: 1.6045012291597576
Energy: 1.6856040312249754
Energy: 1.6045012291597576
Energy: 1.6856040312239635
Energy: 1.6045012291597576
Energy: 1.5411732497747237
Energy: 1.759150345701914
Energy: 1.5411732497747237
Energy: 1.759150345701914
Energy: 1.5411732497747237
Energy: 1.7591503457009021
Energy: 1.6853971879367826
Energy: 1.6048372227713308
Energy: 1.6853971879337462
Energy: 1.6048372227713308
Energy: 1.6853971879388063
Energy: 1.6048372227713308
Energy: 1.5599323059487615
Energy: 1.7382860629820314
Energy: 1.5599323059477495
Energy: 1.7382860629820314
Energy: 1.5599323059497736
Energy: 1.7382860629820314
Energy: 1.6771749795886104
Energy: 1.7404821732356779
Energy: 1.6771749795886104
Energy: 1.7404821732356779
Energy: 1.6771749795886104
Energy: 1.7404821732356779
Energy: 1.5600500576787024
Energy: 1.6590316085756136
Energy: 1.5600500576797143
Energy: 1.6590316085746017
Energy: 1.5600500576787024
Energy: 1.6590316085735894
Energy: 1.6856040312259877
Energy: 1.6045012291587455
Energy: 1.6856040312259877
Energy: 1.6045012291587455
Energy: 1.6856040312280116
Energy: 1.6045012291587455
Energy: 1.5411732497757356
Energy: 1.7468135458541874
Energy: 1.5411732497757356
Energy: 1.7468135458531753
Energy: 1.5411732497747237
Energy: 1.7468135458531753
Energy: 1.6853971879388063
Energy: 1.6048372227682945
Energy: 1.6853971879367826
Energy: 1.6048372227682945
Energy: 1.6853971879367826
Energy: 1.6048372227682945
Energy: 1.5599323059497736
Energy: 1.680648038626784
Energy: 1.5599323059487615
Energy: 1.680648038626784
Energy: 1.5599323059497736
Energy: 1.680648038626784
Energy: 1.6771749795875985
Energy: 1.74048217323669
Energy: 1.6771749795875985
Energy: 1.74048217323669
Energy: 1.6771749795875985
Energy: 1.74048217323669
Energy: 1.5600500576817389
Energy: 1.6590316085756136
Energy: 1.5600500576807266
Energy: 1.6590316085766255
Energy: 1.5600500576797143
Energy: 1.6590316085776373
Energy: 1.6856040312259877
Energy: 1.6045012291597576
Energy: 1.6856040312239635
Energy: 1.6045012291597576
Energy: 1.6856040312249754
Energy: 1.6045012291597576
Energy: 1.5411732497747237
Energy: 1.6926483962293224
Energy: 1.5411732497747237
Energy: 1.6926483962303343
Energy: 1.5411732497747237
Energy: 1.6926483962293224
Energy: 1.6853971879367826
Energy: 1.6048372227713308
Energy: 1.6853971879398184
Energy: 1.6048372227713308
Energy: 1.6853971879377945
Energy: 1.6048372227713308

minimum gb energy = 1.5411732497747237 eV
minimum distance =  2.35607829635652 Angstroms
sigma value = 9


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

Energy: 1.8418210959963668
Energy: 1.806232721282065
Energy: 1.8418210959971928
Energy: 1.8062327212812386
Energy: 1.8418210959971928
Energy: 1.8062327212812386
Energy: 1.7216664192706328
Energy: 1.7210988035230235
Energy: 1.7216664192706328
Energy: 1.7210988035230235
Energy: 1.7216664192706328
Energy: 1.7210988035230235
Energy: 1.7268315431072045
Energy: 1.6957308282369528
Energy: 1.7268315431063783
Energy: 1.6957308282377794
Energy: 1.7268315431063783
Energy: 1.6957308282377794
Energy: 1.6397303593196437
Energy: 1.812762629902279
Energy: 1.6397303593196437
Energy: 1.812762629902279
Energy: 1.6397303593204697
Energy: 1.812762629902279
Energy: 1.725490933388112
Energy: 1.7176381653863364
Energy: 1.7254909333872857
Energy: 1.7176381653863364
Energy: 1.725490933388112
Energy: 1.7176381653863364
Energy: 1.7501694354657515
Energy: 1.7037357670327764
Energy: 1.7501694354657515
Energy: 1.7037357670327764
Energy: 1.7501694354665778
Energy: 1.7037357670327764
Energy: 1.7148500598318202
Energy: 1.807362012080706
Energy: 1.7148500598326464
Energy: 1.807362012080706
Energy: 1.7148500598318202
Energy: 1.807362012080706
Energy: 1.6860137788494922
Energy: 1.7818547892342924
Energy: 1.6860137788494922
Energy: 1.7818547892367715
Energy: 1.6860137788486658
Energy: 1.7818547892342924
Energy: 1.8261748092049792
Energy: 1.711244925292353
Energy: 1.8261748092041532
Energy: 1.711244925292353
Energy: 1.8261748092041532
Energy: 1.7112449252915265
Energy: 1.6834691887648574
Energy: 1.738472237480873
Energy: 1.6834691887648574
Energy: 1.738472237480873
Energy: 1.6834691887656839
Energy: 1.738472237480047
Energy: 1.7161283461105723
Energy: 1.729902242384198
Energy: 1.7161283461097463
Energy: 1.7299022423850243
Energy: 1.7161283461097463
Energy: 1.7299022423850243
Energy: 1.7735398451259616
Energy: 1.705763622537194
Energy: 1.7735398451251352
Energy: 1.7057636225363677
Energy: 1.7735398451251352
Energy: 1.705763622537194
Energy: 1.6321928741478378
Energy: 1.7620983629669456
Energy: 1.6321928741470118
Energy: 1.7620983629669456
Energy: 1.6321928741470118
Energy: 1.7620983629669456
Energy: 1.7071797222268754
Energy: 1.7219037845990186
Energy: 1.7071797222260492
Energy: 1.7219037845990186
Energy: 1.7071797222260492
Energy: 1.7219037845990186
Energy: 1.7484959109739888
Energy: 1.7016154045499834
Energy: 1.7484959109739888
Energy: 1.7016154045499834
Energy: 1.7484959109732001
Energy: 1.7016154045499834
Energy: 1.731272878664813
Energy: 1.817843186901469
Energy: 1.7312728786656395
Energy: 1.817843186901469
Energy: 1.7312728786656395
Energy: 1.817843186901469
Energy: 1.7309329575706505
Energy: 1.795593037377264
Energy: 1.730932957571477
Energy: 1.795593037376438
Energy: 1.730932957571477
Energy: 1.795593037376438
Energy: 1.8959555605595435
Energy: 1.6588146119559284
Energy: 1.895955560558717
Energy: 1.6588146119567548
Energy: 1.8959555605595435
Energy: 1.6588146119559284
Energy: 1.7214363008532205
Energy: 1.7503406509117483
Energy: 1.7214363008523943
Energy: 1.7503406509109218
Energy: 1.7214363008523943
Energy: 1.7503406509117483
Energy: 1.727988914062826
Energy: 1.7404115527981112
Energy: 1.727988914062826
Energy: 1.7404115527981112
Energy: 1.727988914062826
Energy: 1.7404115527981112
Energy: 1.7924253081933426
Energy: 1.714779781046889
Energy: 1.7924253081933426
Energy: 1.7147797810477152
Energy: 1.792425308192516
Energy: 1.714779781046889

minimum gb energy = 1.6321928741470118 eV
minimum distance =  2.32950055224527 Angstroms
sigma value = 27


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

Energy: 1.8131280361150452
Energy: 1.985344180057547
Energy: 1.7698343250891568
Energy: 1.985344180057547
Energy: 1.813128036114349
Energy: 1.985344180057547
Energy: 1.810729135136034
Energy: 1.685543266041547
Energy: 1.8107291351346408
Energy: 1.6855432660422436
Energy: 1.8107291351353374
Energy: 1.6855432660408503
Energy: 1.718677236581652
Energy: 1.6838462309822517
Energy: 1.718677236581652
Energy: 1.6838462309829485
Energy: 1.718677236581652
Energy: 1.6838462309843416
Energy: 1.7141567992897162
Energy: 1.8044354496096142
Energy: 1.7141567992883233
Energy: 1.8044354496096142
Energy: 1.7141567992911093
Energy: 1.8044354496110073
Energy: 1.7290543753496588
Energy: 1.753034929376424
Energy: 1.7290543753475696
Energy: 1.753034929376424
Energy: 1.7290543753496588
Energy: 1.7530349293729417
Energy: 1.7197430378251655
Energy: 1.7635519808363116
Energy: 1.7197430378286482
Energy: 1.7635519808363116
Energy: 1.7197430378251655
Energy: 1.763551980835615
Energy: 1.6521539311234923
Energy: 1.8346699814423912
Energy: 1.6521539311241888
Energy: 1.8346699814423912
Energy: 1.6521539311234923
Energy: 1.8346699814430878
Energy: 1.7955560247261997
Energy: 1.7177339552397852
Energy: 1.795556024727561
Energy: 1.7177339552397852
Energy: 1.7955560247261997
Energy: 1.7177339552411783
Energy: 1.8231713663388103
Energy: 1.6565662040672688
Energy: 1.8231192845650102
Energy: 1.6565662040721445
Energy: 1.8231713663388103
Energy: 1.656566204070055
Energy: 1.7786959060684193
Energy: 1.6890203589961974
Energy: 1.77912323816999
Energy: 1.6890203589961974
Energy: 1.7786959060684193
Energy: 1.6890203589927146
Energy: 1.8357568725758873
Energy: 1.7158864242959273
Energy: 1.8362983381903146
Energy: 1.7158864242952307
Energy: 1.8357568725758873
Energy: 1.7158864242959273
Energy: 1.7755530215275217
Energy: 1.6359259587470727
Energy: 1.7755530215296116
Energy: 1.6359259587470727
Energy: 1.775553021528915
Energy: 1.6359259587449833
Energy: 1.722535063408035
Energy: 1.7777472870789979
Energy: 1.7225350634129106
Energy: 1.7777472870783013
Energy: 1.722535063408035
Energy: 1.7777472870776048
Energy: 1.6568167581108484
Energy: 1.721844707428499
Energy: 1.656816758108759
Energy: 1.721844707428499
Energy: 1.6568167581108484
Energy: 1.7218447074291958
Energy: 1.7687287778761198
Energy: 1.8015252366146002
Energy: 1.7687601365809502
Energy: 1.8015252366146002
Energy: 1.7687287778761198
Energy: 1.8015252366118144
Energy: 1.7066977951946702
Energy: 1.7438936413008652
Energy: 1.7066977951946702
Energy: 1.7438936413008652
Energy: 1.706697795193974
Energy: 1.7438936412973827
Energy: 1.7382318189475296
Energy: 1.7185015417422036
Energy: 1.7382318189482264
Energy: 1.7185015417422036
Energy: 1.7382318189468335
Energy: 1.7185015417449898
Energy: 1.8095637434445047
Energy: 1.6817201162958964
Energy: 1.8095637434472907
Energy: 1.6817201162958964
Energy: 1.8095637434445047
Energy: 1.6817201162965927
Energy: 1.7281877485962032
Energy: 1.6359685695349724
Energy: 1.6795728609081635
Energy: 1.6359685695349724
Energy: 1.7281877485968997
Energy: 1.635968569535669
Energy: 1.8131280361171347
Energy: 1.9853441800582434
Energy: 1.7698343250884603
Energy: 1.9853441800582434
Energy: 1.8131280361171347
Energy: 1.9853441800554572
Energy: 1.8107291351346408
Energy: 1.685543266041547
Energy: 1.810729135133248
Energy: 1.685543266041547
Energy: 1.8107291351353374
Energy: 1.6855432660429401
Energy: 1.7186772365837415
Energy: 1.6838462309829485
Energy: 1.7186772365823484
Energy: 1.6838462309829485
Energy: 1.718677236584438
Energy: 1.6838462309822517
Energy: 1.7141567992945916
Energy: 1.8044354496089177
Energy: 1.7141567992911093
Energy: 1.8044354496089177
Energy: 1.714156799293199
Energy: 1.8044354496110073
Energy: 1.7290543753496588
Energy: 1.753034929376424
Energy: 1.7290543753475696
Energy: 1.7530349293757275
Energy: 1.7290543753503553
Energy: 1.7530349293743344
Energy: 1.7197430378258618
Energy: 1.763551980835615
Energy: 1.719743037831434
Energy: 1.7635519808370081
Energy: 1.7197430378265584
Energy: 1.7635519808370081

minimum gb energy = 1.6359259587449833 eV
minimum distance =  2.30318063922711 Angstroms
sigma value = 19


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

Energy: 1.7236100718118197
Energy: 1.7155352927508107
Energy: 1.7236100718118197
Energy: 1.715535292751412
Energy: 1.7236100718112188
Energy: 1.715535292751412
Energy: 1.687719520604505
Energy: 1.6263691482365377
Energy: 1.6877195206057078
Energy: 1.6263691482365377
Energy: 1.6877195206051065
Energy: 1.6263691482365377
Energy: 1.6856340594829224
Energy: 1.6345878751200227
Energy: 1.6856340594823211
Energy: 1.6345878751194212
Energy: 1.6856340594823211
Energy: 1.6345878751194212
Energy: 1.61593910325337
Energy: 1.636083489572946
Energy: 1.6159391032527688
Energy: 1.636083489572946
Energy: 1.6159391032527688
Energy: 1.636083489572946
Energy: 1.6218110319705072
Energy: 1.6742617444686638
Energy: 1.621811031969906
Energy: 1.6742617444686638
Energy: 1.6218110319711088
Energy: 1.6742617444686638
Energy: 1.6447648060610234
Energy: 1.6779002579292641
Energy: 1.6447648060616242
Energy: 1.6779002579304663
Energy: 1.6447648060616242
Energy: 1.6779002579304663
Energy: 1.5983121722849614
Energy: 1.6799150953337125
Energy: 1.5983121722861635
Energy: 1.6799150953331115
Energy: 1.5983121722849614
Energy: 1.6799150953331115
Energy: 1.6293689337297859
Energy: 1.6808698455757864
Energy: 1.6293689337297859
Energy: 1.6808698455757864
Energy: 1.6293689337291846
Energy: 1.6808698455751852
Energy: 1.724886728057142
Energy: 1.6240664983166528
Energy: 1.7248867280559397
Energy: 1.6240664983166528
Energy: 1.7248867280565405
Energy: 1.6240664983166528
Energy: 1.6462949216204519
Energy: 1.654514080717916
Energy: 1.646294921619851
Energy: 1.654514080717916
Energy: 1.6462949216204519
Energy: 1.6545140807173147
Energy: 1.6453085645778447
Energy: 1.7484970435809117
Energy: 1.6453085645754402
Energy: 1.7484970435809117
Energy: 1.6453085645754402
Energy: 1.7484970435809117
Energy: 1.6809539955880701
Energy: 1.6221088659093377
Energy: 1.6809539955886716
Energy: 1.6221088659087368
Energy: 1.6809539955880701
Energy: 1.6221088658985159
Energy: 1.6325962034493584
Energy: 1.6473317542143642
Energy: 1.6325962034493584
Energy: 1.647331754213763
Energy: 1.6325962034493584
Energy: 1.647331754213763
Energy: 1.6594556179083118
Energy: 1.641839776322466
Energy: 1.6594556179083118
Energy: 1.641839776323067
Energy: 1.6594556179083118
Energy: 1.641839776323067
Energy: 1.688711607533691
Energy: 1.6092752541939552
Energy: 1.688711607533691
Energy: 1.6092752541945563
Energy: 1.6887116075330897
Energy: 1.6092752541939552
Energy: 1.6668418062553936
Energy: 1.6221982341624774
Energy: 1.6668418062553936
Energy: 1.6221982341618761
Energy: 1.666841806254792
Energy: 1.6221982341618761
Energy: 1.6236506568743532
Energy: 1.6590584105901378
Energy: 1.623650656873752
Energy: 1.6590584105901378
Energy: 1.623650656873752
Energy: 1.6590584105901378
Energy: 1.6618044956149076
Energy: 1.63793040504212
Energy: 1.6618044956149076
Energy: 1.63793040504212
Energy: 1.6618044956143065
Energy: 1.63793040504212
Energy: 1.6548917872200004
Energy: 1.6768069380403368
Energy: 1.6548917872200004
Energy: 1.6768069380403368
Energy: 1.6548917872200004
Energy: 1.6768069380403368
Energy: 1.6186425008315715
Energy: 1.664277376745343
Energy: 1.6186425008321728
Energy: 1.6642773767471466
Energy: 1.6186425008315715
Energy: 1.6642773767459438
Energy: 1.5967047053209975
Energy: 1.6671514480651477
Energy: 1.5967047053203967
Energy: 1.6671514480651477
Energy: 1.5967047053203967
Energy: 1.6671514480645466
Energy: 1.7475764523539545
Energy: 1.6306310584178956
Energy: 1.7475764523539545
Energy: 1.6306310584178956
Energy: 1.7475764523539545
Energy: 1.6306310584178956
Energy: 1.673633815524311
Energy: 1.6411209189176414
Energy: 1.67363381552371
Energy: 1.6411209189176414
Energy: 1.673633815524311
Energy: 1.6411209189182425
Energy: 1.6910129211097045
Energy: 1.7054467730755412
Energy: 1.6910129211097045
Energy: 1.7054467730749403
Energy: 1.6910129211097045
Energy: 1.7054467730755412
Energy: 1.6666413660285566
Energy: 1.6209176573991353
Energy: 1.6666413660285566
Energy: 1.6209176573991353
Energy: 1.6666413660285566
Energy: 1.6209176573991353
Energy: 1.624576413440815
Energy: 1.6337823598934542
Energy: 1.624576413441416
Energy: 1.6337823598934542
Energy: 1.624576413441416
Energy: 1.6337823598934542
Energy: 1.6309346539389298
Energy: 1.6510979769809846
Energy: 1.6309346539389298
Energy: 1.6510979769821872
Energy: 1.6309346539389298
Energy: 1.6510979769797822
Energy: 1.6689417035973106
Energy: 1.6494939932486643
Energy: 1.6689417035967093
Energy: 1.6494939932486643
Energy: 1.6689417035979122
Energy: 1.6494939932486643
Energy: 1.6932875257599478
Energy: 1.655897468371498
Energy: 1.6932875257593463
Energy: 1.655897468371498
Energy: 1.6932875257599478
Energy: 1.655897468371498

minimum gb energy = 1.5967047053203967 eV
minimum distance =  2.31242642553653 Angstroms
sigma value = 101


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

Energy: 1.630127145813456
Energy: 1.6101961248954426
Energy: 1.630127145813456
Energy: 1.6101961248954426
Energy: 1.630127145813456
Energy: 1.6101961248954426
Energy: 1.6024202315596459
Energy: 1.5835468265040253
Energy: 1.6024202315559464
Energy: 1.5835468265040253
Energy: 1.6024202315591172
Energy: 1.583546826504554
Energy: 1.5789634503789194
Energy: 1.5570687254813984
Energy: 1.5789634503815622
Energy: 1.5570687254819269
Energy: 1.5789634503857903
Energy: 1.5570687254813984
Energy: 1.5291332239059248
Energy: 1.6268874439466572
Energy: 1.5291332239059248
Energy: 1.6268874439466572
Energy: 1.5291332239059248
Energy: 1.626887443947186
Energy: 1.5528554428784342
Energy: 1.5882008474496692
Energy: 1.5528554428784342
Energy: 1.5882008474496692
Energy: 1.5528554428784342
Energy: 1.5882008474501976
Energy: 1.563967020467086
Energy: 1.5527609031062066
Energy: 1.5639670204692
Energy: 1.552760903106735
Energy: 1.5639670204676146
Energy: 1.5527609031056782
Energy: 1.5579849347601034
Energy: 1.629039438499634
Energy: 1.557984934760632
Energy: 1.629039438499634
Energy: 1.557984934759575
Energy: 1.629039438499634
Energy: 1.5457968708928402
Energy: 1.6679830053479476
Energy: 1.5457968708938974
Energy: 1.667983005347419
Energy: 1.5457968708938974
Energy: 1.6679830053479476
Energy: 1.610335008044576
Energy: 1.5488095527439443
Energy: 1.6103350080451047
Energy: 1.5488095527439443
Energy: 1.6103350080451047
Energy: 1.5488095527439443
Energy: 1.5668835895356514
Energy: 1.5734162196785213
Energy: 1.5668835895372366
Energy: 1.5734162196779924
Energy: 1.5668835895372366
Energy: 1.5734162196779924
Energy: 1.5229253913434897
Energy: 1.7798572853763948
Energy: 1.5229253913456038
Energy: 1.779857285377452
Energy: 1.5229253913445466
Energy: 1.7798572853779806
Energy: 1.6156986334974968
Energy: 1.5923906230889706
Energy: 1.615698633496968
Energy: 1.5923906230889706
Energy: 1.615698633496968
Energy: 1.5923906230889706
Energy: 1.5709858486867807
Energy: 1.5628446455006553
Energy: 1.570985848688366
Energy: 1.5628446454995986
Energy: 1.5709858486862518
Energy: 1.5628446455006553
Energy: 1.6231479474758181
Energy: 1.6457157305640222
Energy: 1.6231479474758181
Energy: 1.6457157305645507
Energy: 1.6231479474768753
Energy: 1.6457157305640222
Energy: 1.591113516062576
Energy: 1.573002535762215
Energy: 1.5911135160620478
Energy: 1.573002535762215
Energy: 1.5911135160631047
Energy: 1.573002535762215
Energy: 1.5818210390976988
Energy: 1.5594688694965282
Energy: 1.5818210390987562
Energy: 1.559468869497057
Energy: 1.5818210390987562
Energy: 1.5594688694965282
Energy: 1.531114987579588
Energy: 1.5857626389102712
Energy: 1.5311149875801162
Energy: 1.5857626389102712
Energy: 1.5311149875790593
Energy: 1.5857626389102712
Energy: 1.536387337552187
Energy: 1.600357136909607
Energy: 1.5363873375516586
Energy: 1.600357136909607
Energy: 1.536387337552187
Energy: 1.600357136909607
Energy: 1.5648290541395686
Energy: 1.5489979210044904
Energy: 1.56482905413904
Energy: 1.5489979210044904
Energy: 1.5648290541395686
Energy: 1.5489979210044904
Energy: 1.5550452892392095
Energy: 1.590334429900074
Energy: 1.555045289238681
Energy: 1.590334429901131
Energy: 1.5550452892392095
Energy: 1.5903344299006028
Energy: 1.5315156843523017
Energy: 1.741848695424062
Energy: 1.5315156843533586
Energy: 1.7418486954235337
Energy: 1.5315156843528301
Energy: 1.7418486954235337
Energy: 1.6445209707294997
Energy: 1.5467063296819328
Energy: 1.6445209707300281
Energy: 1.5467063296824615
Energy: 1.6445209707294997
Energy: 1.5467063296824615
Energy: 1.6374011965116728
Energy: 1.557086490662177
Energy: 1.6374011965090307
Energy: 1.557086490662177
Energy: 1.6374011965100876
Energy: 1.5570864906627055
Energy: 1.5291189613675062
Energy: 1.6159527065070174
Energy: 1.5291189613685634
Energy: 1.6159527065038466
Energy: 1.5291189613680347
Energy: 1.615952706514945
Energy: 1.6025016078270822
Energy: 1.5733835011697932
Energy: 1.6025016078270822
Energy: 1.5733835011697932
Energy: 1.6025016078266017
Energy: 1.573383501169265
Energy: 1.5715408140876341
Energy: 1.5585781787182587
Energy: 1.5715408140876341
Energy: 1.5585781787182587
Energy: 1.5715408140876341
Energy: 1.5585781787182587
Energy: 1.6216320144572833
Energy: 1.6489537175693634
Energy: 1.6216320144572833
Energy: 1.6489537175693634
Energy: 1.6216320144567549
Energy: 1.6489537175693634
Energy: 1.6072022831899633
Energy: 1.5782268163120983
Energy: 1.6072022831910202
Energy: 1.5782268163142121
Energy: 1.6072022831899633
Energy: 1.5782268163115698
Energy: 1.6197055022665587
Energy: 1.5503546112310314
Energy: 1.6197055022660305
Energy: 1.5503546112310314
Energy: 1.6197055022655016
Energy: 1.5503546112315598
Energy: 1.537022999047155
Energy: 1.581587100017956
Energy: 1.537022999046098
Energy: 1.5815871000168988
Energy: 1.537022999047155
Energy: 1.5815871000168988
Energy: 1.5307628186376476
Energy: 1.5818670195144071
Energy: 1.530762818639762
Energy: 1.5818670195149354
Energy: 1.5307628186387048
Energy: 1.5818670195149354
Energy: 1.6418437883439616
Energy: 1.5466355663176405
Energy: 1.641843788345019
Energy: 1.5466355663186975
Energy: 1.6418437883471328
Energy: 1.546635566319226
Energy: 1.6380897209519536
Energy: 1.5602390534691726
Energy: 1.6380897209519536
Energy: 1.5602390534691726
Energy: 1.6380897209508962
Energy: 1.5602390534691726

minimum gb energy = 1.5229253913434897 eV
minimum distance =  2.3279916771436 Angstroms
sigma value = 33


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

Energy: 0.018556656598748274
Energy: 1.0201216386719925
Energy: 0.018556656598748274
Energy: 1.0201216386711143
Energy: 0.018556656598309153
Energy: 1.0201216386706753
Energy: 0.020820173054394108
Energy: 0.40769279825329097
Energy: 0.020820173054394108
Energy: 0.40769279825373006
Energy: 0.02082017305483323
Energy: 0.40769279825373006
Energy: 1.345454082650629
Energy: 0.40741407877421915
Energy: 1.345454082650629
Energy: 0.4074140887683203
Energy: 1.3454540826518975
Energy: 0.4074140908227723
Energy: 0.02082017305483323
Energy: 0.4076927982554378
Energy: 0.02082017305483323
Energy: 0.4076927982554378
Energy: 0.02082017305483323
Energy: 0.4076927982554378

minimum gb energy = 0.018556656598309153 eV
minimum distance =  2.55918958867089 Angstroms
sigma value = 1