Model name: model_name=Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Ni__SM_078420412697_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5213917642831802
cohesive_energy=4.4503499778548585
mass=58.6934
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: 0.018143781431579853
Energy: 0.9013645869657707
Energy: 0.018143781431579853
Energy: 0.9013645869654402
Energy: 0.018143781431249346
Energy: 0.9013645869654402
Energy: 0.9013645869654402
Energy: 1.2364401947926695
Energy: 0.9013645869657707
Energy: 1.236440194790393
Energy: 0.9013645869654402
Energy: 1.2364401947923391
Energy: 0.018143781431579853
Energy: 0.9013645869654402
Energy: 0.018143781431579853
Energy: 0.9013645869654402
Energy: 0.018143781431579853
Energy: 0.9013645869654402
Energy: 0.9013645869654402
Energy: 1.2364401947926695
Energy: 0.9013645869657707
Energy: 1.2364401947907233
Energy: 0.9013645869654402
Energy: 1.2364401947900991
Energy: 0.018143781431249346
Energy: 0.9013645869654402
Energy: 0.018143781431579853
Energy: 0.9013645869654402
Energy: 0.018143781431249346
Energy: 0.9013645869654402
Energy: 0.9013645869654402
Energy: 1.2364401947913846
Energy: 0.9013645869654402
Energy: 1.236440194791715
Energy: 0.9013645869657707
Energy: 1.2364401947907233

minimum gb energy = 0.018143781431249346 eV
minimum distance =  2.34454068905111 Angstroms
sigma value = 1


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

Energy: 1.4153119318171872
Energy: 1.504716118964727
Energy: 1.4153119318163914
Energy: 1.504716118964727
Energy: 1.4153119318171872
Energy: 1.504716118964727
Energy: 1.5150645380556644
Energy: 1.3029122806966371
Energy: 1.51506453805646
Energy: 1.3029122806966371
Energy: 1.5150645380556644
Energy: 1.3029122806974325
Energy: 1.406376443062262
Energy: 1.4102981010811109
Energy: 1.4063764430614665
Energy: 1.4102981010811109
Energy: 1.406376443062262
Energy: 1.4102981010819065
Energy: 1.5597594078321726
Energy: 1.3337789064239303
Energy: 1.5597594078321726
Energy: 1.3337789064239303
Energy: 1.5597594078321726
Energy: 1.3337789064239303
Energy: 1.4019231489875936
Energy: 1.4664399167806563
Energy: 1.401923148988389
Energy: 1.4664399167806563
Energy: 1.401923148988389
Energy: 1.4664399167806563
Energy: 1.4186494572601984
Energy: 1.300537964030856
Energy: 1.4186494572594028
Energy: 1.300537964030856
Energy: 1.4186494572601984
Energy: 1.300537964030856
Energy: 1.3977035781106162
Energy: 1.4683861702326
Energy: 1.3977035781098208
Energy: 1.4683861702318044
Energy: 1.3977035781114118
Energy: 1.4683861702326
Energy: 1.3725792159563592
Energy: 1.5510979874437731
Energy: 1.3725792159563592
Energy: 1.5510979874437731
Energy: 1.3725792159563592
Energy: 1.551097987444569
Energy: 1.461767049050283
Energy: 1.3855294638925957
Energy: 1.461767049050283
Energy: 1.3855294638925957
Energy: 1.461767049050283
Energy: 1.3855294638925957
Energy: 1.2583747418517448
Energy: 1.5289770095510262
Energy: 1.2583747418517448
Energy: 1.5289770095502306
Energy: 1.258374741850949
Energy: 1.5289770095502306
Energy: 1.5923986532293775
Energy: 1.2989527702887804
Energy: 1.5923986532293775
Energy: 1.2989527702887804
Energy: 1.5923986532285819
Energy: 1.2989527702887804
Energy: 1.2504912608949743
Energy: 1.6677979770445084
Energy: 1.2504912608957701
Energy: 1.667797977045304
Energy: 1.2504912608957701
Energy: 1.667797977043713
Energy: 1.5055897868769146
Energy: 1.260726547846368
Energy: 1.5055897868769146
Energy: 1.260726547846368
Energy: 1.5055897868769146
Energy: 1.2607265478455727
Energy: 1.3230875892536245
Energy: 1.4110462854868064
Energy: 1.3230875892536245
Energy: 1.4110462854860109
Energy: 1.3230875892536245
Energy: 1.4110462854860109
Energy: 1.5807553455396466
Energy: 1.2735036769821393
Energy: 1.5807553455404422
Energy: 1.2735036769829347
Energy: 1.5807553455396466
Energy: 1.2735036769821393
Energy: 1.5592358602496827
Energy: 1.4379369880899309
Energy: 1.5592358602488872
Energy: 1.4379369880899309
Energy: 1.5592358602488872
Energy: 1.4379369880907262
Energy: 1.4471596688865778
Energy: 1.3783769976192153
Energy: 1.4471596688873731
Energy: 1.3783769976200109
Energy: 1.4471596688865778
Energy: 1.3783769976200109
Energy: 1.4458456460507028
Energy: 1.3665692463584218
Energy: 1.4458456460507028
Energy: 1.3665692463568309
Energy: 1.4458456460507028
Energy: 1.3665692463576264
Energy: 1.3069456744127914
Energy: 1.4061170091219144
Energy: 1.334016152822898
Energy: 1.40611700912271
Energy: 1.334016152822898
Energy: 1.406117009121119
Energy: 1.4351447564427708
Energy: 1.2998837406140236
Energy: 1.4351447564419753
Energy: 1.2998837406140236
Energy: 1.4351447564427708
Energy: 1.299883740613228
Energy: 1.30032103055624
Energy: 1.699219991928209
Energy: 1.30032103055624
Energy: 1.699219991928209
Energy: 1.30032103055624
Energy: 1.699219991928209
Energy: 1.468642882406567
Energy: 1.386575845291772
Energy: 1.4686428824057713
Energy: 1.386575845291772
Energy: 1.4686428824057713
Energy: 1.386575845291772
Energy: 1.3076102939507332
Energy: 1.5110061400622996
Energy: 1.3076102939499377
Energy: 1.5110061400622996
Energy: 1.3076102939507332
Energy: 1.5110061400622996

minimum gb energy = 1.2504912608949743 eV
minimum distance =  2.25741768628229 Angstroms
sigma value = 33


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

Energy: 1.412471926676495
Energy: 1.4706204141308588
Energy: 1.3730043190134704
Energy: 1.4706204141308588
Energy: 1.4124719266760422
Energy: 1.4706204141308588
Energy: 1.5336934501592188
Energy: 1.3361468016854572
Energy: 1.5336934501592188
Energy: 1.3361468016850044
Energy: 1.5336934501587662
Energy: 1.336146801684552
Energy: 1.2667298164819905
Energy: 1.3342962857113485
Energy: 1.2667298164819905
Energy: 1.3342962857118013
Energy: 1.2667298164819905
Energy: 1.3342962857122538
Energy: 1.4570195935348411
Energy: 1.47051680699951
Energy: 1.4570195935352934
Energy: 1.4705168069990573
Energy: 1.4570195935352934
Energy: 1.4705168069990573
Energy: 1.3793848936436928
Energy: 1.4160271538725557
Energy: 1.3793848936441453
Energy: 1.4160271538730083
Energy: 1.3793848936436928
Energy: 1.4160271538730083
Energy: 1.3640164426775958
Energy: 1.2745989525126025
Energy: 1.364016442677143
Energy: 1.274598952513055
Energy: 1.3640164426775958
Energy: 1.2745989525126025
Energy: 1.464519939794585
Energy: 1.4447334984509457
Energy: 1.4645199397936797
Energy: 1.4447334984513982
Energy: 1.4645199397936797
Energy: 1.4447334984513982
Energy: 1.226984820076885
Energy: 1.4782825752642506
Energy: 1.2269848200773377
Energy: 1.4782825752642506
Energy: 1.226984820076885
Energy: 1.478282575263798
Energy: 1.390547991638954
Energy: 1.268198303561119
Energy: 1.390547991638954
Energy: 1.268198303561119
Energy: 1.390547991638954
Energy: 1.2681983035615714
Energy: 1.2506759063690391
Energy: 1.494045609572481
Energy: 1.250674539236548
Energy: 1.494045609572481
Energy: 1.2506759063694917
Energy: 1.494045609572481
Energy: 1.5245525724927722
Energy: 1.3056139339114154
Energy: 1.5245525724927722
Energy: 1.3056139339114154
Energy: 1.5245525724927722
Energy: 1.3056139339114154
Energy: 1.2668823841900094
Energy: 1.4427421282381778
Energy: 1.2668828753178674
Energy: 1.4427421282381778
Energy: 1.266882384189557
Energy: 1.4427421282386304
Energy: 1.4401826098733304
Energy: 1.266866721896217
Energy: 1.4401826098737829
Energy: 1.266866721897122
Energy: 1.4401826098742354
Energy: 1.266866721897122
Energy: 1.3730039175391198
Energy: 1.471328973901208
Energy: 1.3730039175395723
Energy: 1.471328973901208
Energy: 1.3730039175391198
Energy: 1.471328973901208
Energy: 1.4211853119692237
Energy: 1.3365455854206056
Energy: 1.4211853119692237
Energy: 1.3365455854210582
Energy: 1.4211853119696762
Energy: 1.3365455854210582
Energy: 1.2697397067559155
Energy: 1.3348530432320231
Energy: 1.2697397067554632
Energy: 1.3348530432320231
Energy: 1.2697397067563683
Energy: 1.3348530432320231
Energy: 1.445967126073748
Energy: 1.3986216286911677
Energy: 1.445967126073748
Energy: 1.398621628690715
Energy: 1.445967126073748
Energy: 1.398621628690715
Energy: 1.3760585902979463
Energy: 1.2658459897394982
Energy: 1.3760585902983988
Energy: 1.265845989739046
Energy: 1.3760585902979463
Energy: 1.2658459897394982
Energy: 1.3720724903501909
Energy: 1.3396820819887512
Energy: 1.3720724903497383
Energy: 1.339682081989204
Energy: 1.3720724903501909
Energy: 1.339682081989204
Energy: 1.4721791989215356
Energy: 1.3778263584798267
Energy: 1.472179198921083
Energy: 1.3778263584798267
Energy: 1.4721791989219881
Energy: 1.3778263584802795
Energy: 1.2305364583869642
Energy: 1.4759789757246666
Energy: 1.2305364583869642
Energy: 1.4759789757255715
Energy: 1.2305364583874168
Energy: 1.4759789757251192
Energy: 1.3363846940175403
Energy: 1.268732142330359
Energy: 1.3363846940166353
Energy: 1.2687321423308116
Energy: 1.3363846940166353
Energy: 1.2687321423308116
Energy: 1.2861969170642908
Energy: 1.4932088412596916
Energy: 1.2862051597643647
Energy: 1.4932088412601443
Energy: 1.2861969170642908
Energy: 1.4932088412596916
Energy: 1.4965785730162842
Energy: 1.3761183739748335
Energy: 1.4965785730189989
Energy: 1.376118373975286
Energy: 1.4965785730158314
Energy: 1.3761183739748335
Energy: 1.26699813600175
Energy: 1.3714001774154816
Energy: 1.2667796425961493
Energy: 1.3714001773942548
Energy: 1.26699813600175
Energy: 1.3714001773413107
Energy: 1.4764725313385219
Energy: 1.458899982045254
Energy: 1.4400133480035875
Energy: 1.458899982045254
Energy: 1.4764725313385219
Energy: 1.4588999820438964
Energy: 1.4763201516821125
Energy: 1.434619136419898
Energy: 1.440127244762756
Energy: 1.4346191364194454
Energy: 1.4763201516821125
Energy: 1.434619136419898
Energy: 1.266964040519751
Energy: 1.324783089162213
Energy: 1.2669640405192986
Energy: 1.324783089162213
Energy: 1.2669640405192986
Energy: 1.3247830891626655
Energy: 1.492328751897605
Energy: 1.3351221440903471
Energy: 1.4923287518971524
Energy: 1.3351221440898946
Energy: 1.4923287518971524
Energy: 1.3351221440898946
Energy: 1.305509399087791
Energy: 1.524978855658573
Energy: 1.305509399087791
Energy: 1.5249788556581203
Energy: 1.3055093990882436
Energy: 1.5249788556581203
Energy: 1.4005118350147676
Energy: 1.2683748580901884
Energy: 1.400511835014315
Energy: 1.2683748580901884
Energy: 1.4005118350147676
Energy: 1.2683748580906407
Energy: 1.267005362867802
Energy: 1.440605237859109
Energy: 1.267005362867802
Energy: 1.4406052378586565
Energy: 1.2670053628673494
Energy: 1.440605237859109
Energy: 1.472650098967213
Energy: 1.377683506429354
Energy: 1.472650098967213
Energy: 1.377683506429354
Energy: 1.4726500989676656
Energy: 1.377683506429354
Energy: 1.3369704298412508
Energy: 1.4209099246970243
Energy: 1.3369704298412508
Energy: 1.4209099246970243
Energy: 1.3369704298417031
Energy: 1.4209099246970243
Energy: 1.3351313073300402
Energy: 1.2666155971718422
Energy: 1.3351313073304927
Energy: 1.2666155971718422
Energy: 1.3351313073304927
Energy: 1.2666155971713897
Energy: 1.3977185554289964
Energy: 1.445834458274554
Energy: 1.397718555428544
Energy: 1.445834458274554
Energy: 1.397718555428544
Energy: 1.4458344582750062
Energy: 1.277832746040996
Energy: 1.3763797600587897
Energy: 1.2778261682883831
Energy: 1.3763797600592422
Energy: 1.2778327460405434
Energy: 1.3763797600587897
Energy: 1.340929804524393
Energy: 1.3617535890360213
Energy: 1.3409298045248454
Energy: 1.361753589036474
Energy: 1.340929804524393
Energy: 1.361753589036474
Energy: 1.3731687644746198
Energy: 1.4748952281961227
Energy: 1.3731687644750723
Energy: 1.4748952281961227
Energy: 1.3731687644746198
Energy: 1.4748952281947652
Energy: 1.4776614366614236
Energy: 1.2273173921812215
Energy: 1.4776614366618763
Energy: 1.2273173921812215
Energy: 1.4776614366618763
Energy: 1.2273173921803162
Energy: 1.266842854394106
Energy: 1.3922699424392952
Energy: 1.266842854394106
Energy: 1.3922699424388427
Energy: 1.266842854394106
Energy: 1.3922699424388427

minimum gb energy = 1.226984820076885 eV
minimum distance =  2.31677250041691 Angstroms
sigma value = 51


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

Energy: 1.4175597005305116
Energy: 1.430817605402682
Energy: 1.4175597005305116
Energy: 1.430817605402682
Energy: 1.4175597005315603
Energy: 1.430817605402682
Energy: 1.4784231921850717
Energy: 1.3704982578626228
Energy: 1.478423192184023
Energy: 1.3704982578626228
Energy: 1.4784231921850717
Energy: 1.3704982578626228
Energy: 1.3584318536389282
Energy: 1.4028389858839045
Energy: 1.3584318536389282
Energy: 1.4028389858839045
Energy: 1.3584318536389282
Energy: 1.4028389858839045
Energy: 1.3937409157413723
Energy: 1.342742002607383
Energy: 1.393740915740324
Energy: 1.342742002607383
Energy: 1.3937409157413723
Energy: 1.342742002607383
Energy: 1.4656235765411199
Energy: 1.418171356373191
Energy: 1.4656235765411199
Energy: 1.418171356373191
Energy: 1.4656235765411199
Energy: 1.418171356373191
Energy: 1.530402577545465
Energy: 1.4197404120215282
Energy: 1.530402577545465
Energy: 1.4197404120215282
Energy: 1.530402577545465
Energy: 1.4197404120215282
Energy: 1.3838012573454765
Energy: 1.3645929176694631
Energy: 1.3838012573454765
Energy: 1.3645929176694631
Energy: 1.3838012573454765
Energy: 1.3645929176694631
Energy: 1.3225290666466099
Energy: 1.4184665723772607
Energy: 1.3225290666466099
Energy: 1.4184665723783094
Energy: 1.3225290666466099
Energy: 1.4184665723772607
Energy: 1.6025262561422402
Energy: 1.3413020249709136
Energy: 1.6025262561422402
Energy: 1.341302024969865
Energy: 1.6025262561411917
Energy: 1.341302024969865
Energy: 1.341377886078021
Energy: 1.6136635978656606
Energy: 1.3413778860769725
Energy: 1.6136635978656606
Energy: 1.341377886078021
Energy: 1.6136635978656606
Energy: 1.5826082559380603
Energy: 1.2584927024606227
Energy: 1.5826082559370118
Energy: 1.2584927024595745
Energy: 1.5826082559380603
Energy: 1.2584927024595745
Energy: 1.4171671652689704
Energy: 1.4319198395219128
Energy: 1.4171671652700186
Energy: 1.4319198395219128
Energy: 1.4171671652700186
Energy: 1.4319198395219128
Energy: 1.478017081142753
Energy: 1.4092386454339054
Energy: 1.478017081142753
Energy: 1.4092386454339054
Energy: 1.4780170811417044
Energy: 1.4092386454339054
Energy: 1.4015438548184618
Energy: 1.3414080438108122
Energy: 1.4015438548184618
Energy: 1.3414080438108122
Energy: 1.4015438548174137
Energy: 1.3414080438108122
Energy: 1.3755474877341143
Energy: 1.3986503812317463
Energy: 1.3755474877341143
Energy: 1.3986503812317463
Energy: 1.3755474877341143
Energy: 1.3986503812317463
Energy: 1.463199761452136
Energy: 1.4213178187171869
Energy: 1.463199761452136
Energy: 1.4213178187171869
Energy: 1.463199761452136
Energy: 1.4213178187171869
Energy: 1.4650642952226882
Energy: 1.5076295001975377
Energy: 1.4650642952226882
Energy: 1.5076295001985864
Energy: 1.4650642952226882
Energy: 1.5076295001975377
Energy: 1.3924050305865097
Energy: 1.3675075268587709
Energy: 1.3924050305865097
Energy: 1.3675075268598196
Energy: 1.3924050305865097
Energy: 1.3675075268587709

minimum gb energy = 1.2584927024595745 eV
minimum distance =  2.24221699867189 Angstroms
sigma value = 19


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

Energy: 1.2395102787164813
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2913670133574782
Energy: 1.385870283479481
Energy: 1.2913670133568562
Energy: 1.3858702834801029
Energy: 1.2913670133574782
Energy: 1.3858702834801029
Energy: 1.179150929565169
Energy: 1.4634279825751306
Energy: 1.1791509295664129
Energy: 1.4634279825751306
Energy: 1.1791509295657907
Energy: 1.4634279825751306
Energy: 1.2753152591907317
Energy: 1.179204186235825
Energy: 1.2753152591907317
Energy: 1.1792041862364468
Energy: 1.2753152591907317
Energy: 1.1792041862364468
Energy: 1.2051783243230418
Energy: 1.2577838617351251
Energy: 1.2051783243230418
Energy: 1.2577838617351251
Energy: 1.205178324323664
Energy: 1.257783861734503
Energy: 1.205116811296094
Energy: 1.257953487963272
Energy: 1.205116811296716
Energy: 1.257953487963272
Energy: 1.205116811296094
Energy: 1.257953487963272
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.179310569787457
Energy: 1.463539633860602
Energy: 1.179310569787457
Energy: 1.4635396338599804
Energy: 1.179310569787457
Energy: 1.463539633860602
Energy: 1.2914369445511813
Energy: 1.3859797069863664
Energy: 1.2914369445518035
Energy: 1.3859797069857447
Energy: 1.2914369445524254
Energy: 1.3859797069857447
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2913670133581
Energy: 1.3858702834801029
Energy: 1.2913670133574782
Energy: 1.385870283480725
Energy: 1.2913670133574782
Energy: 1.3858702834801029
Energy: 1.179150929565169
Energy: 1.4634279825751306
Energy: 1.1791509295657907
Energy: 1.4634279825757526
Energy: 1.179150929564547
Energy: 1.4634279825757526
Energy: 1.2753152591907317
Energy: 1.1792041862364468
Energy: 1.2753152591907317
Energy: 1.1792041862364468
Energy: 1.2753152591901098
Energy: 1.1792041862364468
Energy: 1.205178324323664
Energy: 1.257783861734503
Energy: 1.2051783243230418
Energy: 1.2577838617351251
Energy: 1.205178324323664
Energy: 1.2577838617351251
Energy: 1.205116811297338
Energy: 1.257953487963272
Energy: 1.205116811296094
Energy: 1.257953487963272
Energy: 1.205116811296716
Energy: 1.257953487963272
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.2753291737911232
Energy: 1.1791693879065046
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.179310569788079
Energy: 1.463539633860602
Energy: 1.179310569787457
Energy: 1.463539633860602
Energy: 1.179310569787457
Energy: 1.463539633860602
Energy: 1.2914369445511813
Energy: 1.3859797069857447
Energy: 1.2914369445511813
Energy: 1.3859797069857447
Energy: 1.2914369445518035
Energy: 1.3859797069857447
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2395102787164813
Energy: 1.23290184952368
Energy: 1.2913670133568562
Energy: 1.3858702834801029
Energy: 1.2913670133568562
Energy: 1.385870283480725
Energy: 1.2913670133574782
Energy: 1.3858702834801029
Energy: 1.179150929565169
Energy: 1.4634279825751306
Energy: 1.179150929564547
Energy: 1.4634279825751306
Energy: 1.179150929565169
Energy: 1.4634279825757526
Energy: 1.2753152591907317
Energy: 1.1792041862364468
Energy: 1.2753152591901098
Energy: 1.1792041862370406
Energy: 1.2753152591901098
Energy: 1.1792041862364468
Energy: 1.205178324323664
Energy: 1.2577838617351251
Energy: 1.205178324323664
Energy: 1.257783861734503
Energy: 1.205178324323664
Energy: 1.2577838617351251
Energy: 1.205116811297338
Energy: 1.257953487963272
Energy: 1.205116811296716
Energy: 1.257953487963272
Energy: 1.205116811297338
Energy: 1.257953487963272
Energy: 1.2753291737911232
Energy: 1.1791693879065046
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.2753291737911232
Energy: 1.1791693879058827
Energy: 1.179310569787457
Energy: 1.463539633860602
Energy: 1.179310569787457
Energy: 1.463539633860602
Energy: 1.179310569787457
Energy: 1.4635396338599804
Energy: 1.2914369445524254
Energy: 1.3859797069857447
Energy: 1.2914369445524254
Energy: 1.3859797069857447
Energy: 1.2914369445518035
Energy: 1.3859797069857447
Energy: 1.2395102787164813
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2395102787158596
Energy: 1.23290184952368
Energy: 1.2913670133568562
Energy: 1.385870283480725
Energy: 1.2913670133568562
Energy: 1.385870283480725
Energy: 1.291367013356234
Energy: 1.3858702834801029
Energy: 1.179150929565169
Energy: 1.4634279825757526
Energy: 1.179150929565169
Energy: 1.4634279825757526
Energy: 1.179150929565169
Energy: 1.4634279825751306

minimum gb energy = 1.179150929564547 eV
minimum distance =  2.28813321179576 Angstroms
sigma value = 27


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

Energy: 1.1846695250906414
Energy: 1.1192420488370023
Energy: 1.1846695250906414
Energy: 1.1192420488370023
Energy: 1.1846695250906414
Energy: 1.1192420488370023
Energy: 1.4418262568549673
Energy: 1.1709612425041032
Energy: 1.4418262568564906
Energy: 1.1709612425041032
Energy: 1.4418262568564906
Energy: 1.1709612425041032
Energy: 1.2003240480102306
Energy: 1.2851687528423197
Energy: 1.2003240480102306
Energy: 1.2851687528377498
Energy: 1.2003240480102306
Energy: 1.2851687528377498
Energy: 1.388636452966981
Energy: 1.1099053893908757
Energy: 1.3886364529654576
Energy: 1.1099053893908757
Energy: 1.388636452966981
Energy: 1.1099053893893525
Energy: 1.317125234389825
Energy: 1.1085936037548356
Energy: 1.3171252343913487
Energy: 1.108593603753347
Energy: 1.317125234389825
Energy: 1.108593603753347
Energy: 1.287367730755035
Energy: 1.3082855464005132
Energy: 1.2873677307565583
Energy: 1.3082855464020364
Energy: 1.287367730755035
Energy: 1.3082855464020364
Energy: 1.187002189359985
Energy: 1.1618770851249858
Energy: 1.1870021893584615
Energy: 1.1618770851249858
Energy: 1.187002189359985
Energy: 1.1618770851249858
Energy: 1.1808090737896482
Energy: 1.122449303639095
Energy: 1.1808090737896482
Energy: 1.122449303639095
Energy: 1.1808090737896482
Energy: 1.122449303639095
Energy: 1.2132908211660767
Energy: 1.2006465088399154
Energy: 1.2132908211660767
Energy: 1.2006465088429619
Energy: 1.2132908211660767
Energy: 1.200646508838392
Energy: 1.3812667403712329
Energy: 1.2668532491831908
Energy: 1.3812667403712329
Energy: 1.2668532491831908
Energy: 1.3812667403697096
Energy: 1.2668532491831908
Energy: 1.2831353628895352
Energy: 1.1116845830691715
Energy: 1.2831353628895352
Energy: 1.1116845830691715
Energy: 1.1203940251184779
Energy: 1.1116845830691715
Energy: 1.2981818637577445
Energy: 1.2128343717589096
Energy: 1.2981818637577445
Energy: 1.2128343717589096
Energy: 1.2981818637577445
Energy: 1.2128343717589096

minimum gb energy = 1.108593603753347 eV
minimum distance =  2.2295361350657 Angstroms
sigma value = 9


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

Energy: 1.0655534343282085
Energy: 1.1935812406366466
Energy: 1.0655534343273527
Energy: 1.1935812406366466
Energy: 1.0655534343273527
Energy: 1.1935812406366466
Energy: 1.1377917783421374
Energy: 1.05626505161229
Energy: 1.137791778341709
Energy: 1.0417348242555338
Energy: 1.1377917783421374
Energy: 1.074943919784676
Energy: 0.9956609383081283
Energy: 1.1899340978365875
Energy: 0.9956609383081283
Energy: 1.1899340978348754
Energy: 0.9956609383081283
Energy: 1.1899340978361594
Energy: 0.9904728943326631
Energy: 0.9764451248409537
Energy: 0.990472894332235
Energy: 0.9764451248400976
Energy: 0.990472894332235
Energy: 0.9764451248405257
Energy: 1.0565171756166667
Energy: 1.0934284822846807
Energy: 1.0565171756166667
Energy: 1.0934284822842526
Energy: 1.0565171756162386
Energy: 1.0934284822846807
Energy: 1.0819544515757953
Energy: 1.0377590999027213
Energy: 1.0819544515753674
Energy: 1.0377590999005812
Energy: 1.0819544515766515
Energy: 1.0661804869137164
Energy: 1.0032832297825924
Energy: 1.1488923655589334
Energy: 1.0032832297825924
Energy: 1.1488923655602177
Energy: 1.0032832297825924
Energy: 1.1488923655593617
Energy: 0.948307081995637
Energy: 1.1267548722965066
Energy: 0.948307081995637
Energy: 1.1267548722956506
Energy: 0.948307081995637
Energy: 1.1267548722956506
Energy: 1.417977166678794
Energy: 1.0930884642572252
Energy: 1.4179771666775098
Energy: 1.093088464257653
Energy: 1.4179771666783658
Energy: 1.093088464256797
Energy: 1.057437690993864
Energy: 1.344788785303977
Energy: 1.0574376909930079
Energy: 1.3447887853048333
Energy: 1.057437690991296
Energy: 1.3447887853048333
Energy: 0.9910693092089112
Energy: 0.9820114398287245
Energy: 0.9910693092080551
Energy: 0.9820114398282963
Energy: 0.9910693092076273
Energy: 0.9820114398282963
Energy: 1.030223397906053
Energy: 1.080749106266028
Energy: 1.030223397906481
Energy: 1.0807491062668841
Energy: 1.030223397906481
Energy: 1.080749106267312
Energy: 1.0425827445886886
Energy: 1.04350125305038
Energy: 1.0425827445907898
Energy: 1.0435012530499521
Energy: 1.0425827445891165
Energy: 1.0435012530499521
Energy: 1.0625551764378114
Energy: 1.4472920117676737
Energy: 1.0625551764378114
Energy: 1.4472920117663894
Energy: 1.0625551764382397
Energy: 1.4472920117672454
Energy: 0.9788809752705891
Energy: 1.1582696897205136
Energy: 0.9788809752701613
Energy: 1.1582696897205136
Energy: 0.9788809752705891
Energy: 1.1582696897205136
Energy: 0.9525209127249725
Energy: 1.0033972291258437
Energy: 0.9525209127254005
Energy: 1.0033972291112905
Energy: 0.9525209127258285
Energy: 1.003397229080472
Energy: 1.3327638829310442
Energy: 0.9753034494053341
Energy: 1.3327638829314725
Energy: 0.9753034494061901
Energy: 1.3327638829314725
Energy: 0.975303449404906
Energy: 0.9932242984232776
Energy: 1.0762289933813696
Energy: 0.9932242984232776
Energy: 1.0762289933813696
Energy: 0.9932242984228494
Energy: 1.0762289933817977
Energy: 0.9477420617196365
Energy: 1.329181542139105
Energy: 0.9477420617200645
Energy: 1.329181542139105
Energy: 0.9477420617196365
Energy: 1.329181542139105
Energy: 1.4053518605786532
Energy: 1.1648481522976009
Energy: 1.4053518605790811
Energy: 0.9788492602775144
Energy: 1.4053518605782251
Energy: 0.9911364468664976
Energy: 0.9477257574129622
Energy: 1.3292237865669319
Energy: 0.9477257574129622
Energy: 1.3292237865660756
Energy: 0.9477257574129622
Energy: 1.3292237865669319
Energy: 0.9932544273949576
Energy: 1.0762157012846862
Energy: 0.9932544273945296
Energy: 1.0762157012851141
Energy: 0.9932544273945296
Energy: 1.0762157012851141
Energy: 1.3330583578540083
Energy: 0.9753422900327192
Energy: 1.3330583578540083
Energy: 0.9753422900365714
Energy: 1.3330583578540083
Energy: 0.9753422900361435
Energy: 0.9526330350714409
Energy: 1.0348341982725202
Energy: 0.9526330350714409
Energy: 1.0348341982738045
Energy: 0.9526330350697287
Energy: 1.034834198270808
Energy: 0.9789766278448543
Energy: 1.158440348612209
Energy: 0.9789766278448543
Energy: 1.1584403486126373
Energy: 0.9789766278448543
Energy: 1.1584403486126373
Energy: 1.0622725623791405
Energy: 1.1532485920601956
Energy: 1.0622725623795686
Energy: 1.1532485920597675
Energy: 1.0622725623791405
Energy: 1.1532485920606237
Energy: 1.0425193228425786
Energy: 1.04362286535815
Energy: 1.0425193228430065
Energy: 1.0436228653577222
Energy: 1.0425193228434346
Energy: 1.04362286535815
Energy: 1.0303004352590048
Energy: 1.0194749457755345
Energy: 1.030300435258577
Energy: 1.0194749457755345
Energy: 1.030300435258577
Energy: 1.0194749457751064
Energy: 0.9907609952470611
Energy: 0.9821664450815719
Energy: 0.9907609952470611
Energy: 0.9821664450811438
Energy: 0.9907609952474892
Energy: 0.9821664450815719
Energy: 1.0576209244035517
Energy: 1.0761338917406444
Energy: 1.0576209244031238
Energy: 1.0761338917385042
Energy: 1.0576209244035517
Energy: 1.076133891733368
Energy: 1.4180656009016486
Energy: 1.0932846307615762
Energy: 1.4180656009012205
Energy: 1.0932846307611481
Energy: 1.4180656009003645
Energy: 1.09328463076072
Energy: 0.948220870880997
Energy: 1.1268048863601159
Energy: 0.948220870880997
Energy: 1.1268048863614
Energy: 0.948220870880997
Energy: 1.1268048863614
Energy: 1.003145763007344
Energy: 1.1493279625128876
Energy: 1.003145763006916
Energy: 1.1493279625128876
Energy: 1.003145763006916
Energy: 1.1493279625124597
Energy: 1.082370078430815
Energy: 1.054150363347226
Energy: 1.082370078430815
Energy: 1.1033801045005969
Energy: 1.0823700784303867
Energy: 1.0884341554920995
Energy: 1.0564736381684443
Energy: 1.0933479150372014
Energy: 1.0564736381684443
Energy: 1.0933479150380574
Energy: 1.0564736381688724
Energy: 1.0933479150380574
Energy: 0.9908141550712513
Energy: 0.9762745727569975
Energy: 0.9908141550712513
Energy: 0.9762745727557134
Energy: 0.9908141550708234
Energy: 0.9762745727531452
Energy: 0.9957008676023814
Energy: 1.1901057077599124
Energy: 0.9957008676019535
Energy: 1.1901057077616244
Energy: 0.9957008676015255
Energy: 1.1901057077603403
Energy: 1.137519099537272
Energy: 0.9771843226544102
Energy: 1.1375190995377003
Energy: 0.9837956335692575
Energy: 1.1375190995377003
Energy: 0.9837956335696856
Energy: 1.0655534343277804
Energy: 1.1935812406362185
Energy: 1.0655534343273527
Energy: 1.1935812406362185
Energy: 1.0655534343277804
Energy: 1.1935812406362185
Energy: 1.1377917783447056
Energy: 1.074943919784248
Energy: 1.1377917783455616
Energy: 1.074943919784248
Energy: 1.1377917783459894
Energy: 1.074943919785104
Energy: 0.9956609383077003
Energy: 1.1899340978357316
Energy: 0.9956609383077003
Energy: 1.1899340978353035
Energy: 0.9956609383085564
Energy: 1.1899340978357316
Energy: 0.9904728943326631
Energy: 0.9764451248409537
Energy: 0.990472894332235
Energy: 0.9764451248409537
Energy: 0.9904728943318071
Energy: 0.9764451248400976
Energy: 1.0565171756162386
Energy: 1.0934284822846807
Energy: 1.0565171756162386
Energy: 1.0934284822846807
Energy: 1.0565171756166667
Energy: 1.093428482285537

minimum gb energy = 0.9477257574129622 eV
minimum distance =  2.3057636717159 Angstroms
sigma value = 57


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

Energy: 0.5176472665394642
Energy: 0.5123087564319423
Energy: 0.39321458220719546
Energy: 0.512308756430968
Energy: 0.5176472665384898
Energy: 0.5123087564319423
Energy: 0.672865243288338
Energy: 0.5097526664128804
Energy: 0.6728652432873636
Energy: 0.5097526664128804
Energy: 0.6728652432873636
Energy: 0.5097526664128804
Energy: 0.5745530905814789
Energy: 1.0625007906106498
Energy: 0.5745530905814789
Energy: 1.0625007906116244
Energy: 0.5745530905814789
Energy: 1.0625007906116244
Energy: 0.513736949760969
Energy: 0.39293350462335597
Energy: 0.513736949760969
Energy: 0.39293350462433035
Energy: 0.5137369497599946
Energy: 0.39293350462433035
Energy: 0.5633754080339658
Energy: 0.6792843817929908
Energy: 0.5633754080329915
Energy: 0.6792843817929908
Energy: 0.5633754080339658
Energy: 0.6792843817929908
Energy: 0.3931181938224508
Energy: 1.609574980351998
Energy: 0.3931181938224508
Energy: 1.6095749803510238
Energy: 0.3931181938224508
Energy: 1.6095749803510238
Energy: 0.3932288328306196
Energy: 0.4673671098085327
Energy: 0.3932288328306196
Energy: 0.46736711060520425
Energy: 0.3932288328306196
Energy: 0.4673671100685537
Energy: 0.6731615269021687
Energy: 0.5700523676365701
Energy: 0.6731615269021687
Energy: 0.5700523676375444
Energy: 0.6731615269021687
Energy: 0.5700523676365701
Energy: 0.5137217573669591
Energy: 0.39293014660774733
Energy: 0.5137217573669591
Energy: 0.39293014660774733
Energy: 0.5137217573659849
Energy: 0.39293014660774733
Energy: 0.4674958472989813
Energy: 1.2651733101612737
Energy: 0.4674958472989813
Energy: 1.2651733101612737
Energy: 0.4674958472989813
Energy: 1.2651733101612737
Energy: 0.562563909182993
Energy: 1.3240376480659743
Energy: 0.562563909182993
Energy: 1.3240376480650002
Energy: 0.562563909182993
Energy: 1.3240376480669487
Energy: 0.5176472665384898
Energy: 0.512308756430968
Energy: 0.3932145822062211
Energy: 0.5123087564319423
Energy: 0.5176472665384898
Energy: 0.5123087564319423
Energy: 0.6728652432873636
Energy: 0.5097526664128804
Energy: 0.6728652432873636
Energy: 0.5097526664128804
Energy: 0.6728652432873636
Energy: 0.5097526664128804
Energy: 0.5745530905814789
Energy: 1.0625007906125987
Energy: 0.5745530905814789
Energy: 1.0625007906125987
Energy: 0.5745530905814789
Energy: 1.0625007906125987
Energy: 0.5137369497599946
Energy: 0.39293350462335597
Energy: 0.5137369497599946
Energy: 0.39293350462433035
Energy: 0.5137369497599946
Energy: 0.39293350462335597
Energy: 0.5633754080329915
Energy: 0.6792843817920609
Energy: 0.5633754080339658
Energy: 0.6792843817920609
Energy: 0.5633754080329915
Energy: 0.6792843817920609
Energy: 0.3931181938224508
Energy: 1.6095749803510238
Energy: 0.3931181938224508
Energy: 1.6095749803500494
Energy: 0.3931181938224508
Energy: 1.6095749803510238
Energy: 0.3932288328306196
Energy: 0.46736707380245707
Energy: 0.3932288328306196
Energy: 0.4673670723162491
Energy: 0.3932288328306196
Energy: 0.46736707325216553
Energy: 0.6731615269021687
Energy: 0.5700523676365701
Energy: 0.6731615269021687
Energy: 0.5700523676365701
Energy: 0.6731615269021687
Energy: 0.5700523676365701

minimum gb energy = 0.39293014660774733 eV
minimum distance =  2.40107542069691 Angstroms
sigma value = 11


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

Energy: 0.9492191590161583
Energy: 1.0185558473080683
Energy: 0.949219159016872
Energy: 1.0185558473080683
Energy: 0.949219159016872
Energy: 1.0185558473073544
Energy: 1.0531234510552325
Energy: 0.9749057510418516
Energy: 1.0531234510545189
Energy: 0.9749057510425653
Energy: 1.053123451053805
Energy: 0.9749057510418516
Energy: 1.1798750909421025
Energy: 1.4405980478589513
Energy: 1.1798750909413889
Energy: 1.4405980478589513
Energy: 1.1798750909428164
Energy: 1.4405980478589513
Energy: 1.2595616903483329
Energy: 0.841647046238256
Energy: 1.2595616903490467
Energy: 0.8416470462375424
Energy: 1.2595616903469053
Energy: 0.8416470462368286
Energy: 1.0107827159867488
Energy: 0.8804321757556968
Energy: 1.010782715987463
Energy: 0.8804321757564105
Energy: 1.0107827159867488
Energy: 0.8804321757556968
Energy: 0.968550153741752
Energy: 1.0900420278984653
Energy: 0.968550153741752
Energy: 1.0900420278977516
Energy: 0.9685501537410383
Energy: 1.0900420278984653
Energy: 0.8088995167144797
Energy: 1.1451221541722423
Energy: 0.8088995167151933
Energy: 1.1451221541701013
Energy: 0.8088995167159072
Energy: 1.145122154175097
Energy: 1.0306710179783332
Energy: 0.7758978556861612
Energy: 1.0306710179783332
Energy: 0.775897855686875
Energy: 1.0306710179783332
Energy: 0.775897855686875
Energy: 1.0132809820726962
Energy: 0.7749630909070496
Energy: 1.0132809820734099
Energy: 0.7749630909056222
Energy: 1.0132809820741235
Energy: 0.7749630909056222
Energy: 0.7810142047649987
Energy: 1.1857649093706588
Energy: 0.7810142047664262
Energy: 1.185764909380651
Energy: 0.7810142047649987
Energy: 1.1857649093706588
Energy: 0.9754025253162876
Energy: 1.2290781197486742
Energy: 0.9754025253170012
Energy: 1.2290781197479603
Energy: 0.9754025253170012
Energy: 1.2290781197486742
Energy: 1.0021894437628038
Energy: 0.883924438798801
Energy: 1.0021894437628038
Energy: 0.883924438798801
Energy: 1.0021894437628038
Energy: 0.883924438798801
Energy: 1.0317344181668497
Energy: 0.8493222761783435
Energy: 1.0317344181675638
Energy: 0.8493222761790571
Energy: 1.0317344181668497
Energy: 0.8493222761783435
Energy: 1.1669363790285927
Energy: 1.4077305861686338
Energy: 1.1669363790293066
Energy: 1.4077305861693474
Energy: 1.166936379027879
Energy: 1.4077305861693474
Energy: 1.0668275629490425
Energy: 0.97595474228993
Energy: 1.066827562952611
Energy: 0.9759547422906437
Energy: 1.0668275629540385
Energy: 0.97595474228993
Energy: 0.869997898127001
Energy: 1.0201706736676932
Energy: 0.8699978981255735
Energy: 1.0201706736676932
Energy: 0.869997898127001
Energy: 1.0201706736669793
Energy: 0.8797048843476538
Energy: 0.9778427258452381
Energy: 0.8797048843469402
Energy: 0.9778427258459518
Energy: 0.8797048843469402
Energy: 0.9778427258452381
Energy: 1.2546023813778155
Energy: 1.2381525181570487
Energy: 1.2546023813778155
Energy: 1.2381525181577626
Energy: 1.2546023813778155
Energy: 1.2381525181570487
Energy: 1.1888828180445075
Energy: 0.8366058141918694
Energy: 1.1888828180395112
Energy: 0.8366058141925831
Energy: 1.1888828180445075
Energy: 0.8366058141925831
Energy: 1.002017839420129
Energy: 0.9066424655266087
Energy: 1.002017839420129
Energy: 0.9066424655266087
Energy: 1.002017839420129
Energy: 0.9066424655266087
Energy: 0.7984553724976664
Energy: 0.9052582796609798
Energy: 0.7984553724990938
Energy: 0.9052582796616937
Energy: 0.7984553724969526
Energy: 0.9052582796609798
Energy: 1.055639460400085
Energy: 1.183472129105659
Energy: 1.0556394603986574
Energy: 1.1834721291042314
Energy: 1.0556394603993713
Energy: 1.1834721291070862
Energy: 1.0305946017731913
Energy: 0.9329567900105012
Energy: 1.0305946017731913
Energy: 0.9329567900097876
Energy: 1.030594601773905
Energy: 0.9329567900097876
Energy: 1.0152597213434653
Energy: 0.8908896953447152
Energy: 1.015259721344179
Energy: 0.8908896953440014
Energy: 1.0152597213434653
Energy: 0.8908896953447152
Energy: 0.8195460827801733
Energy: 1.2240583750408724
Energy: 0.8195460827823146
Energy: 1.2240583750451548
Energy: 0.8195460827823146
Energy: 1.224058375041586
Energy: 1.4524251599066484
Energy: 1.2429796408841596
Energy: 1.452425159904507
Energy: 1.242979640883446
Energy: 1.4524251599066484
Energy: 1.242979640883446

minimum gb energy = 0.7749630909056222 eV
minimum distance =  2.28893738211733 Angstroms
sigma value = 41


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

Energy: 1.0862535219216456
Energy: 0.974314890243372
Energy: 1.0862535219216456
Energy: 0.9743148902439346
Energy: 1.0862535219222085
Energy: 0.9743148902439346
Energy: 1.1136496754840743
Energy: 1.1663700873015552
Energy: 1.1136496754840743
Energy: 1.1663700873015552
Energy: 1.1136496754840743
Energy: 1.1663700873021179
Energy: 1.3989342578301152
Energy: 1.641233066861548
Energy: 1.3989342578295527
Energy: 1.641233066861548
Energy: 1.3989342578301152
Energy: 1.641233066861548
Energy: 1.1016302084351406
Energy: 0.9541468870947796
Energy: 1.1016302084328904
Energy: 0.9541468870947796
Energy: 1.1016302084368284
Energy: 0.9541468870953421
Energy: 0.875012615261746
Energy: 1.0158938512219018
Energy: 0.8750126152623086
Energy: 1.0158938512219018
Energy: 0.8750126152623086
Energy: 1.0158938512219018
Energy: 1.1135245930771882
Energy: 1.3490267313883322
Energy: 1.1135245930777506
Energy: 1.3490267313883322
Energy: 1.1135245930777506
Energy: 1.3490267313883322
Energy: 0.9049856057414618
Energy: 1.0368990548190082
Energy: 0.9049856057414618
Energy: 1.0368990548178831
Energy: 0.9049856057408993
Energy: 1.0368990548190082
Energy: 0.9106210593539155
Energy: 0.9540591834766736
Energy: 0.910621059354478
Energy: 0.9540591834777987
Energy: 0.9106210593533528
Energy: 0.9540591834766736
Energy: 0.883649149756928
Energy: 1.010065661334924
Energy: 0.8836491497563654
Energy: 1.0100656613354866
Energy: 0.883649149756928
Energy: 1.0100656613360492
Energy: 0.9807663543142803
Energy: 1.374112534958161
Energy: 0.9807663543142803
Energy: 1.3741125349587238
Energy: 0.9807663543148426
Energy: 1.374112534958161
Energy: 0.9813292701275179
Energy: 1.3591012918907528
Energy: 0.9813292701280805
Energy: 1.3591012918907528
Energy: 0.9813292701269554
Energy: 1.3591012918913152
Energy: 0.8846487456438583
Energy: 1.1519469666856268
Energy: 0.8846487456444209
Energy: 1.073679998235996
Energy: 0.8846487456438583
Energy: 1.0736799982365584
Energy: 0.8753205222954126
Energy: 0.9582633633017427
Energy: 0.8753205222954126
Energy: 0.9582633633017427
Energy: 0.8753205222954126
Energy: 0.9582633633017427
Energy: 0.8726414542044595
Energy: 1.2736818427461047
Energy: 0.8726414542038969
Energy: 1.2736818427449799
Energy: 0.8726414542044595
Energy: 1.2736818427466674
Energy: 1.1122568041879048
Energy: 1.3484148345188673
Energy: 1.112256804186217
Energy: 1.348414834518305
Energy: 1.112256804185092
Energy: 1.3484148345188673
Energy: 0.8755286192188811
Energy: 1.0386369887990097
Energy: 0.8755286192194438
Energy: 1.0386369887984472
Energy: 0.8755286192194438
Energy: 1.0386369887973221
Energy: 0.9490067526663276
Energy: 0.958239966401682
Energy: 0.9490067526663276
Energy: 0.9582399664011194
Energy: 0.9490067526657654
Energy: 0.958239966401682
Energy: 1.1656338857525976
Energy: 1.6534919263793213
Energy: 1.1656338857514728
Energy: 1.6534919263793213
Energy: 1.1656338857520352
Energy: 1.653491926381009
Energy: 1.1500178566994461
Energy: 1.150422755735567
Energy: 1.1500178566994461
Energy: 1.150422755735567
Energy: 1.1500178566988835
Energy: 1.150422755735567
Energy: 0.9810355095651463
Energy: 1.2188289232992677
Energy: 0.9810355095645837
Energy: 1.2188289232998302
Energy: 0.9810355095651463
Energy: 1.325279184808347
Energy: 0.8830389061493149
Energy: 1.169965944264925
Energy: 0.8830389061493149
Energy: 1.169965944264925
Energy: 0.8830389061481898
Energy: 1.1699659442654877
Energy: 1.3970005553711968
Energy: 1.480489534693865
Energy: 1.3970005553717593
Energy: 1.4804895347011269
Energy: 1.3970005553711968
Energy: 1.4804895346966778
Energy: 1.1000058283999272
Energy: 0.9543314716022065
Energy: 1.1000058283959895
Energy: 0.9543314716022065
Energy: 1.1000058283971146
Energy: 0.9543314716016439
Energy: 0.8754645589117486
Energy: 1.2060074863562564
Energy: 0.8754645589117486
Energy: 1.2060074863562564
Energy: 0.8754645589117486
Energy: 1.2663452571784217
Energy: 0.8366849934620764
Energy: 1.2160758273296053
Energy: 0.8366849934620764
Energy: 1.216075827330168
Energy: 0.836684993461514
Energy: 1.2160758273296053
Energy: 0.9043181250971789
Energy: 0.9070149941942572
Energy: 0.9043181250977415
Energy: 0.9070149941931323
Energy: 0.9043181250971789
Energy: 0.9070149941931323
Energy: 0.9093295954918477
Energy: 0.9542013081555529
Energy: 0.9093295954918477
Energy: 0.9542013081561155
Energy: 0.9093295954912851
Energy: 0.9542013081555529
Energy: 0.8833218995933232
Energy: 1.2102737557920358
Energy: 0.8833218995938859
Energy: 1.2102737557914731
Energy: 0.8833218995944483
Energy: 1.2386360654070752
Energy: 0.9805311138645337
Energy: 1.1650977258412567
Energy: 0.9805311138650963
Energy: 1.1650977258412567
Energy: 0.9805311138650963
Energy: 1.1650977258418191
Energy: 1.3449626145790687
Energy: 0.8366195194821552
Energy: 1.3449626145779436
Energy: 0.8366195194821552
Energy: 1.344962614578506
Energy: 0.8366195194821552
Energy: 0.8642765051858085
Energy: 1.0746311369737762
Energy: 0.8642765051829958
Energy: 1.0746311369737762
Energy: 0.8642765051858085
Energy: 1.0746311369737762
Energy: 0.9718764512486606
Energy: 0.9554362801564313
Energy: 0.971876451248149
Energy: 0.955436280156994
Energy: 0.971876451248149
Energy: 0.9554362801564313
Energy: 0.8357635129595914
Energy: 1.0598926603345002
Energy: 0.8357635129595914
Energy: 1.0598926603345002
Energy: 0.8357635129595914
Energy: 1.0598926603345002

minimum gb energy = 0.8357635129595914 eV
minimum distance =  2.29910361288128 Angstroms
sigma value = 33


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

Energy: 1.058445667284727
Energy: 0.9981866629892211
Energy: 1.0584456672855167
Energy: 0.9981866629888622
Energy: 1.0584456672850862
Energy: 0.9981866629884315
Energy: 1.584584357556756
Energy: 0.9202558323077956
Energy: 1.5845843575516594
Energy: 0.9202558323085852
Energy: 1.5845843575753475
Energy: 0.9202558323081544
Energy: 1.0012532873550084
Energy: 1.8358628028024941
Energy: 1.001253291290168
Energy: 1.8358628028024941
Energy: 1.0012532812903647
Energy: 1.8358628028024941
Energy: 1.0161527353700401
Energy: 0.9775429610616009
Energy: 1.0161527353688917
Energy: 0.9775429610608113
Energy: 1.0161527353696813
Energy: 0.9775429610608113
Energy: 0.986636822846744
Energy: 1.4652292174741313
Energy: 0.986636822846744
Energy: 1.465229217474562
Energy: 0.9866368228471748
Energy: 1.4652292174741313
Energy: 1.2643970272137564
Energy: 0.9880966316571195
Energy: 1.2643970272137564
Energy: 0.9880966316574784
Energy: 1.2643970272133973
Energy: 0.9880966316574784
Energy: 1.0051440176066
Energy: 1.5320326324846443
Energy: 1.0051440176073896
Energy: 1.5320326324846443
Energy: 1.0051440176069588
Energy: 1.5320326324850746
Energy: 1.0501252179227614
Energy: 1.0627418392878591
Energy: 1.0501252179219718
Energy: 1.0627418392878591
Energy: 1.0501252179224025
Energy: 1.0627418392878591
Energy: 1.463468837009711
Energy: 1.0757667491586238
Energy: 1.4634688370105007
Energy: 1.0757667491589828
Energy: 1.4634688370105007
Energy: 1.0757667491589828
Energy: 1.3157593554907645
Energy: 0.9545788271353157
Energy: 1.3157593554883957
Energy: 0.9545788271353157
Energy: 1.3157593554899747
Energy: 0.9545788271356745
Energy: 1.0508649625792748
Energy: 1.0492267843241674
Energy: 1.0508649625804234
Energy: 1.0492267843237368
Energy: 1.0508649625800643
Energy: 1.0492267843237368
Energy: 1.473229277700086
Energy: 0.9769062528541069
Energy: 1.473229277700086
Energy: 0.976906252854466
Energy: 1.4732292777005167
Energy: 0.9769062528560453
Energy: 1.0765568732373727
Energy: 1.4607752681729749
Energy: 1.0765568732381623
Energy: 1.4607752681729749
Energy: 1.0765568732377317
Energy: 1.4607752681729749
Energy: 1.0739364173339525
Energy: 1.0491821558043946
Energy: 1.073936417333163
Energy: 1.0491821558040353
Energy: 1.0739364173335937
Energy: 1.049182155803246
Energy: 1.0595281321989751
Energy: 1.005956617830275
Energy: 1.0595281321994057
Energy: 1.005956617830275
Energy: 1.0595281321989751
Energy: 1.005956617830275
Energy: 1.0027530329532057
Energy: 1.26603097115067
Energy: 1.0027530329536365
Energy: 1.26603097115067
Energy: 1.0027530329536365
Energy: 1.26603097115067
Energy: 1.4725092923824994
Energy: 0.9879833739520201
Energy: 1.47250929238293
Energy: 0.9879833739507999
Energy: 1.4725092923824994
Energy: 0.9879833739515895
Energy: 0.9557193136152811
Energy: 1.0144141837031944
Energy: 0.9557193136144916
Energy: 1.0144141837036247
Energy: 0.955719313613702
Energy: 1.0144141837031944
Energy: 1.3136106547407684
Energy: 1.4832049531962646
Energy: 1.3136106547447166
Energy: 1.4832049531966238
Energy: 1.3136106547447166
Energy: 1.4832049531962646
Energy: 1.2293485929265755
Energy: 1.076063245438284
Energy: 1.2293485929348307
Energy: 1.076063245438643
Energy: 1.2293485929371992
Energy: 1.076063245438643
Energy: 1.000642127600889
Energy: 1.0593243572927853
Energy: 1.0006421276012478
Energy: 1.0593243572927853
Energy: 1.000642127600889
Energy: 1.0593243572932158
Energy: 0.948444737156769
Energy: 1.5870620325291078
Energy: 0.948444737156769
Energy: 1.5870620325294669
Energy: 0.948444737156769
Energy: 1.5870620325298974
Energy: 1.0580820457822262
Energy: 1.249896717838771
Energy: 1.0580820457822262
Energy: 1.249896717838771
Energy: 1.0580820457814366
Energy: 1.2498967178391298
Energy: 0.9916749870116086
Energy: 1.016265249884712
Energy: 0.9916749870116086
Energy: 1.0162652498839224
Energy: 0.9916749870116086
Energy: 1.0162652498913878
Energy: 1.4560164157924236
Energy: 0.9880024586496483
Energy: 1.4560164157927824
Energy: 0.9880024586496483
Energy: 1.4560164157924236
Energy: 0.9880024586500789
Energy: 0.9695393842214031
Energy: 1.2611288744274785
Energy: 0.9695393842214031
Energy: 1.2611288744274785
Energy: 0.9695393842218338
Energy: 1.2611288744274785
Energy: 1.0951631153601848
Energy: 1.0086608405633817
Energy: 1.0951631041662886
Energy: 1.0086608405641715
Energy: 1.0951631273694526
Energy: 1.0086608405637407
Energy: 1.0624755680573623
Energy: 1.0006473355195238
Energy: 1.062475568058152
Energy: 1.0006473355199546
Energy: 1.0624755680569316
Energy: 1.0006473355199546
Energy: 1.0739299433415943
Energy: 1.4606199822836148
Energy: 1.073929943342025
Energy: 1.4606199822832557
Energy: 1.073929943342025
Energy: 1.4606199822832557
Energy: 0.9837324863885749
Energy: 1.313839397702233
Energy: 0.9837324863890058
Energy: 1.313839397702592
Energy: 0.9837324863877854
Energy: 1.3138393977030225
Energy: 1.0161769464788772
Energy: 0.9552219461343701
Energy: 1.016176946476867
Energy: 0.9552219461343701
Energy: 1.0161769464780877
Energy: 0.9552219461343701
Energy: 0.991919962672184
Energy: 1.4834754268755537
Energy: 0.9919199626726146
Energy: 1.4834754268759127
Energy: 0.9919199626726146
Energy: 1.4834754268763435
Energy: 1.464426552480854
Energy: 0.9999200818922971
Energy: 1.4644265524820026
Energy: 0.9999200818934456
Energy: 1.4644265524812132
Energy: 0.9999200818938764
Energy: 1.0475745916100163
Energy: 1.0647933577203081
Energy: 1.047574591610734
Energy: 1.0647933577203081
Energy: 1.0475745916103751
Energy: 1.0647933577207385
Energy: 1.04721610707534
Energy: 1.0649479194027012
Energy: 1.047216107074981
Energy: 1.0649479194022708
Energy: 1.0472161070745505
Energy: 1.0649479194027012
Energy: 1.4646166328738948
Energy: 0.9996071134380953
Energy: 1.464616632873536
Energy: 0.9996071134376645
Energy: 1.464616632873536
Energy: 0.9996071134392438
Energy: 0.9916769571031878
Energy: 1.4834594862387016
Energy: 0.9916769571036187
Energy: 1.483459486237912
Energy: 0.9916769571036187
Energy: 1.4834594862383426
Energy: 1.0162858005528521
Energy: 0.9550741148969203
Energy: 1.0162858005540008
Energy: 0.9550741148969203
Energy: 1.0162858005536417
Energy: 0.9550741148961308
Energy: 0.9839746495066001
Energy: 1.3139860039706144
Energy: 0.9839746495061692
Energy: 1.3139860039693942
Energy: 0.9839746495061692
Energy: 1.3139860039698248
Energy: 1.073802681695377
Energy: 1.46068942460681
Energy: 1.073802681695377
Energy: 1.4606894246072408
Energy: 1.073802681695377
Energy: 1.4606894246072408
Energy: 1.0625345351555489
Energy: 1.000584528768904
Energy: 1.0625345351563384
Energy: 1.0005845287696935
Energy: 1.0625345351555489
Energy: 1.0005845287693347
Energy: 1.5820876123462495
Energy: 1.008165169623932
Energy: 1.5820876361587706
Energy: 1.008165169623573
Energy: 1.5820876302563542
Energy: 1.008165169623573
Energy: 0.9698394713519362
Energy: 1.2609752605410556
Energy: 0.9698394713515054
Energy: 1.2609752605402658
Energy: 0.9698394713511463
Energy: 1.2609752605410556
Energy: 1.4559979150952016
Energy: 0.9880069401171248
Energy: 1.4559979150952016
Energy: 0.9880069401171248
Energy: 1.4559979150952016
Energy: 0.988006940116694
Energy: 0.9911215937516346
Energy: 1.2458228240653375
Energy: 0.9911215937519936
Energy: 1.2458228240664861
Energy: 0.9911215937532138
Energy: 1.2458228240637583
Energy: 1.0548185005213995
Energy: 1.2497494898251553
Energy: 1.0548185005206099
Energy: 1.249749489823576
Energy: 1.0548185005186002
Energy: 1.2497494898243657
Energy: 0.948300561454364
Energy: 1.300906631252738
Energy: 0.9483005614540051
Energy: 1.300906551071125
Energy: 0.9483005614547947
Energy: 1.300906713106799

minimum gb energy = 0.9202558323077956 eV
minimum distance =  2.302126874311 Angstroms
sigma value = 67


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

Energy: 0.9764734896795052
Energy: 0.9164789340964581
Energy: 0.9764734896795052
Energy: 0.9164789340964581
Energy: 0.9764734896795052
Energy: 0.9164789340964581
Energy: 0.8813066924284295
Energy: 0.8259041091701276
Energy: 0.881306692431068
Energy: 0.8259041091701276
Energy: 0.8813066924284295
Energy: 0.8259041091727062
Energy: 0.915825162988792
Energy: 1.2819912922093515
Energy: 0.915825162988792
Energy: 1.2819912922093515
Energy: 0.915825162988792
Energy: 1.2819912922093515
Energy: 0.88125876333106
Energy: 0.8257965232086978
Energy: 0.88125876333106
Energy: 0.8257965232086978
Energy: 0.88125876333106
Energy: 0.8257965232086978
Energy: 0.9764734896795052
Energy: 0.9164789340964581
Energy: 0.9764734896795052
Energy: 0.9164789340964581
Energy: 0.9764734896795052
Energy: 0.9164789340964581
Energy: 0.8813066924284295
Energy: 0.8259041091701276
Energy: 0.8813066924284295
Energy: 0.8259041091701276
Energy: 0.8813066924284295
Energy: 0.8259041091701276
Energy: 0.915825162988792
Energy: 1.2819912922093515
Energy: 0.915825162988792
Energy: 1.2819912922093515
Energy: 0.915825162988792
Energy: 1.2819912922093515

minimum gb energy = 0.8257965232086978 eV
minimum distance =  2.35738704551307 Angstroms
sigma value = 3


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

Energy: 1.5012710002581675
Energy: 1.0912743234230597
Energy: 1.5012710002581675
Energy: 1.0912743234230597
Energy: 1.5012710002581675
Energy: 1.0912743234230597
Energy: 1.1744080360134102
Energy: 1.0725842048813448
Energy: 1.1744080360170006
Energy: 1.0725842048813448
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Energy: 1.3354825492934594
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Energy: 1.2543787776993933
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Energy: 1.1571177151418048
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Energy: 1.4141713277150614
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Energy: 1.414171327718652
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Energy: 1.4790396023518475
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Energy: 1.4790396023518475
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Energy: 1.2429068647222241
Energy: 1.2085077166050893
Energy: 1.2429068647222241
Energy: 1.2085077166050893
Energy: 1.2429068647222241
Energy: 1.2085077166050893
Energy: 1.5229500574418275
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Energy: 1.522950057427465
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Energy: 1.5229500583247357
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Energy: 1.0687763818381844
Energy: 1.4809512656682746
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Energy: 1.4809512656682746
Energy: 1.0687763818381844
Energy: 1.4809512656682746
Energy: 1.2621147536930175
Energy: 1.338450123928097
Energy: 1.2621147536930175
Energy: 1.3384501239245064
Energy: 1.2621147536930175
Energy: 1.3384501239245064
Energy: 1.4477084354748317
Energy: 1.1348529748598388
Energy: 1.447708435471241
Energy: 1.1348529748598388
Energy: 1.447708435471241
Energy: 1.1348529748598388
Energy: 1.5091238782418526
Energy: 1.1634086023113515
Energy: 1.5091238764580834
Energy: 1.1634086023113515
Energy: 1.5091238764401953
Energy: 1.1634086023113515
Energy: 1.1397363926241217
Energy: 1.394916195419558
Energy: 1.1397363926241217
Energy: 1.3949161954303297
Energy: 1.1397363926241217
Energy: 1.394916195426739
Energy: 1.133927857926978
Energy: 1.2436768586873215
Energy: 1.133927857926978
Energy: 1.2436768586837308
Energy: 1.133927857926978
Energy: 1.2436768586873215
Energy: 1.244245210367544
Energy: 1.2152374817589808
Energy: 1.244245210367544
Energy: 1.2152374817589808
Energy: 1.244245210367544
Energy: 1.2152374817589808
Energy: 1.3310574525963732
Energy: 1.2275930089155769
Energy: 1.3310574525568761
Energy: 1.2275930089191673
Energy: 1.331057452449222
Energy: 1.2275930089191673
Energy: 1.1965724123898294
Energy: 1.26158722902492
Energy: 1.1965724123898294
Energy: 1.2615872290285104
Energy: 1.1965724123898294
Energy: 1.261587229021329

minimum gb energy = 1.0598285020167526 eV
minimum distance =  2.26446253723907 Angstroms
sigma value = 81


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

Energy: 1.1768815051626602
Energy: 1.1399262059912738
Energy: 1.1768815051626602
Energy: 1.1399262059917668
Energy: 1.1768815051626602
Energy: 1.1399262059917668
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Energy: 1.225518543504133
Energy: 1.0463499911096086
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Energy: 1.0463499911091159
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Energy: 1.3696518176789698
Energy: 1.0395950470337618
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Energy: 1.0395950470342548
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Energy: 1.2054395411461225
Energy: 1.1217315053770098
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Energy: 1.0414670622916156
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Energy: 1.2087589400354073
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Energy: 1.5310766940609601
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Energy: 1.1159690887907405
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Energy: 1.1159690887907405
Energy: 1.0414783155346483
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Energy: 1.177122987422523
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Energy: 1.1439029575689394
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Energy: 1.2053818571473602
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Energy: 1.0395049282820745
Energy: 1.0262095979831636
Energy: 1.0395049282815818
Energy: 1.0262095979836565
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Energy: 1.021713278346791
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Energy: 1.0395825681465012
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Energy: 1.1097699108108454
Energy: 1.0439529677752357
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Energy: 1.2057412741906361
Energy: 1.2635434277642386
Energy: 1.2057412741926075
Energy: 1.2635434277637456
Energy: 1.2057412741921147
Energy: 1.2635434277647313
Energy: 1.0408004890193518
Energy: 1.3713397466447275
Energy: 1.0408004890223086
Energy: 1.3713397466442347
Energy: 1.0408004890193518
Energy: 1.3713397466447275
Energy: 1.0164380201748051
Energy: 1.1218805251228376
Energy: 1.0164380201748051
Energy: 1.1218805251228376
Energy: 1.0164380201748051
Energy: 1.121880525122345
Energy: 1.1440891480797555
Energy: 1.1774201682769336
Energy: 1.1440891480802484
Energy: 1.1774201682769336
Energy: 1.1440891480802484
Energy: 1.1774201682769336
Energy: 1.115830866617591
Energy: 1.0413888112692788
Energy: 1.115830866617591
Energy: 1.0413888112697718
Energy: 1.115830866617591
Energy: 1.0413888112692788
Energy: 1.520697730015454
Energy: 1.0890303465463593
Energy: 1.520697730015947
Energy: 1.0890303465463593
Energy: 1.520697730015454
Energy: 1.089030346546852
Energy: 1.2090639608246478
Energy: 1.4992775916150254
Energy: 1.2090639608251406
Energy: 1.4992775916125614
Energy: 1.2090639608246478
Energy: 1.4992775916253742
Energy: 1.0424891935799518
Energy: 1.1100456631026692
Energy: 1.0424891935804446
Energy: 1.1100456631021762
Energy: 1.0424891935804446
Energy: 1.1100456631021762
Energy: 1.0394944747354815
Energy: 1.200728011347823
Energy: 1.0394944747359744
Energy: 1.20072801134733
Energy: 1.0394944747354815
Energy: 1.20072801134733
Energy: 1.042275379486716
Energy: 1.0228854099423481
Energy: 1.0422753794872086
Energy: 1.0228854099423481
Energy: 1.042275379486716
Energy: 1.0228854099423481
Energy: 1.22011134830115
Energy: 1.6009008547323176
Energy: 1.2201113483016428
Energy: 1.6009008547303463
Energy: 1.2201113483016428
Energy: 1.6009008547323176
Energy: 1.3384972758301448
Energy: 1.3404371801550892
Energy: 1.3384972758301448
Energy: 1.3404371801545965
Energy: 1.3384972758306375
Energy: 1.3404371801545965
Energy: 1.1160454460646776
Energy: 1.0429778056982286
Energy: 1.1160454460641849
Energy: 1.0429778056982286
Energy: 1.1160454460651705
Energy: 1.0429778056987216
Energy: 1.025767574304143
Energy: 1.0394054991492172
Energy: 1.025767574304143
Energy: 1.0394054991502029
Energy: 1.0257675743036503
Energy: 1.0394054991492172

minimum gb energy = 1.0163281176640635 eV
minimum distance =  2.36940377287608 Angstroms
sigma value = 43


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

Energy: 1.4745031221350853
Energy: 1.1360095415763771
Energy: 1.4745031221350853
Energy: 1.1360095415763771
Energy: 1.4745031221350853
Energy: 1.1360095415763771
Energy: 1.391867935970792
Energy: 1.0750994312745352
Energy: 1.3918679359713972
Energy: 1.075099431275746
Energy: 1.391867935970792
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Energy: 1.2815771272553853
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Energy: 1.1855864202594006
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Energy: 1.2304896555956788
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Energy: 1.1434314462710031
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Energy: 1.3569304108661107
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Energy: 1.3498349855502054
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Energy: 1.4830633021621022
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Energy: 1.4830633021112818
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Energy: 1.1936469298616899
Energy: 1.2571803381635231
Energy: 1.1936469298622951
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Energy: 1.1936469298622951
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Energy: 1.2944784504750046
Energy: 1.1967824762579844
Energy: 1.2944784504750046
Energy: 1.196782476257379
Energy: 1.2944784504743996
Energy: 1.1967824762579844
Energy: 1.199511215368404
Energy: 1.0787971442934612
Energy: 1.199511215368404
Energy: 1.078797144292856
Energy: 1.199511215368404
Energy: 1.0787971442946718
Energy: 1.358956804295637
Energy: 1.2495631944872174
Energy: 1.358956804296242
Energy: 1.2495631944872174
Energy: 1.358956804295637
Energy: 1.2495631944872174
Energy: 1.2783771066220107
Energy: 1.2458128738150083
Energy: 1.2783771066226162
Energy: 1.2458128738150083
Energy: 1.2783771066226162
Energy: 1.2458128738150083
Energy: 1.199948833275534
Energy: 1.2064175791437899
Energy: 1.199948833275534
Energy: 1.2064175791437899
Energy: 1.199948833275534
Energy: 1.2064175791437899
Energy: 1.293569652454542
Energy: 1.235030913975475
Energy: 1.293569652454542
Energy: 1.235030913975475
Energy: 1.293569652454542
Energy: 1.2350309139748696
Energy: 1.2845226890969825
Energy: 1.187007301598718
Energy: 1.284522689095772
Energy: 1.187007301598718
Energy: 1.2845226890975878
Energy: 1.187007301598718
Energy: 1.0606802706994864
Energy: 1.3148483835524591
Energy: 1.0606802706994864
Energy: 1.3148483835524591
Energy: 1.0606802706994864
Energy: 1.3148483835530644
Energy: 1.2097089416039875
Energy: 1.4250227950600227
Energy: 1.2097089416045927
Energy: 1.4250227950606278
Energy: 1.2097089416039875
Energy: 1.4250227950606278
Energy: 1.2366737991055736
Energy: 1.2581566711059247
Energy: 1.2366737991055736
Energy: 1.2581566711059247
Energy: 1.2366737991055736
Energy: 1.2581566711059247
Energy: 1.3702494180642053
Energy: 1.203866924295028
Energy: 1.3702494180714693
Energy: 1.2038669242956332
Energy: 1.3702494180611786
Energy: 1.203866924295028
Energy: 1.2940717266289996
Energy: 1.331373676962907
Energy: 1.294071726629605
Energy: 1.3313736769635123
Energy: 1.2940717266289996
Energy: 1.331373676962907
Energy: 1.329904755961757
Energy: 1.158771306997698
Energy: 1.3299047559611517
Energy: 1.1587713069983032
Energy: 1.329904755961757
Energy: 1.1587713069983032
Energy: 1.237263069514273
Energy: 1.1919596886185972
Energy: 1.2372630695148783
Energy: 1.1919596886185972
Energy: 1.237263069514273
Energy: 1.1919596886185972
Energy: 1.185453720843367
Energy: 1.3033820516806625
Energy: 1.185453720843367
Energy: 1.3033820516824783
Energy: 1.1854537208421565
Energy: 1.3033820516824783
Energy: 1.2304580630353221
Energy: 1.143157334001752
Energy: 1.2304580630353221
Energy: 1.1431573340011465
Energy: 1.2304580630359274
Energy: 1.1431573340011465

minimum gb energy = 1.0556006281205061 eV
minimum distance =  2.3436191682531 Angstroms
sigma value = 57


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

Energy: 1.2458398308239078
Energy: 1.0785344542086261
Energy: 1.2458398308239078
Energy: 1.0785344542086261
Energy: 1.2458398308239078
Energy: 1.0785344542086261
Energy: 1.1600389078709115
Energy: 1.2102509867854114
Energy: 1.1600389078709115
Energy: 1.2102509867854114
Energy: 1.1600389078709115
Energy: 1.2102509867854114
Energy: 1.230592064309614
Energy: 1.2945308966544289
Energy: 1.230592064309614
Energy: 1.2945308966544289
Energy: 1.2305920643088302
Energy: 1.2945308966552125
Energy: 1.5291418021313983
Energy: 1.223770712518584
Energy: 1.5291418021313983
Energy: 1.223770712518584
Energy: 1.5291418021313983
Energy: 1.2237707125170163
Energy: 1.5207412252607708
Energy: 1.2199222888080148
Energy: 1.5207412252607708
Energy: 1.2199222888087986
Energy: 1.5207412252607708
Energy: 1.2199222888087986
Energy: 1.2311895754394369
Energy: 1.3217765028320274
Energy: 1.2311895754394369
Energy: 1.3217765028320274
Energy: 1.2311895754394369
Energy: 1.3217765028320274
Energy: 1.295072228500323
Energy: 1.2572311106795968
Energy: 1.295072228500323
Energy: 1.2572311106795968
Energy: 1.295072228500323
Energy: 1.2572311106795968
Energy: 1.246317676667112
Energy: 1.0786449304378438
Energy: 1.246317676666328
Energy: 1.0786449304378438
Energy: 1.246317676667112
Energy: 1.0786449304378438
Energy: 1.3581708752723716
Energy: 1.1300701230083612
Energy: 1.3581708752723716
Energy: 1.1300701230075774
Energy: 1.3581708752715878
Energy: 1.1300701230083612
Energy: 1.0049522885671385
Energy: 1.1656360075888086
Energy: 1.0049522885671385
Energy: 1.1656360075888086
Energy: 1.0049522885671385
Energy: 1.1656360075888086
Energy: 1.207720909824487
Energy: 1.4444465417762062
Energy: 1.207720909824487
Energy: 1.4444465417769898
Energy: 1.207720909824487
Energy: 1.4444465417769898
Energy: 1.3730948819229294
Energy: 1.2073578741821422
Energy: 1.3730948819229294
Energy: 1.2073578741813584
Energy: 1.3730948819229294
Energy: 1.2073578741813584
Energy: 1.1607548108973897
Energy: 1.1312586626500973
Energy: 1.1607548108973897
Energy: 1.1312586626508812
Energy: 1.1607548108981738
Energy: 1.1312586626500973
Energy: 1.2959416222169273
Energy: 1.082766128001764
Energy: 1.2959416222169273
Energy: 1.082766128001764
Energy: 1.2959416222161435
Energy: 1.082766128001764
Energy: 1.293769885490608
Energy: 1.0791312889610274
Energy: 1.2937698854913917
Energy: 1.0791312889610274
Energy: 1.2937698854913917
Energy: 1.0791312889610274
Energy: 1.1703694858431077
Energy: 1.1302862689002304
Energy: 1.1703694858431077
Energy: 1.1302862688994464
Energy: 1.1703694858423237
Energy: 1.1302862689002304
Energy: 1.004982249790689
Energy: 1.160471941730955
Energy: 1.004982249790689
Energy: 1.160471941730955
Energy: 1.004982249790689
Energy: 1.160471941730955
Energy: 1.2054763274140077
Energy: 1.3582085699556765
Energy: 1.2054763274140077
Energy: 1.3582085699548927
Energy: 1.2054763274140077
Energy: 1.3582085699556765
Energy: 1.0051120554093191
Energy: 1.160077678655396
Energy: 1.0051120554093191
Energy: 1.160077678655396
Energy: 1.0051120554093191
Energy: 1.160077678655396
Energy: 1.1701701222767136
Energy: 1.1301899004651608
Energy: 1.1701701222767136
Energy: 1.1301899004651608
Energy: 1.1701701222767136
Energy: 1.1301899004651608
Energy: 1.293782755685776
Energy: 1.078899378520262
Energy: 1.293782755685776
Energy: 1.078899378520262
Energy: 1.293782755685776
Energy: 1.078899378520262
Energy: 1.2960574476701845
Energy: 1.2945741438319303
Energy: 1.2960574476717521
Energy: 1.2945741438311467
Energy: 1.296057447672536
Energy: 1.2945741438311467
Energy: 1.1608311257907695
Energy: 1.1311139777817318
Energy: 1.1608311257915531
Energy: 1.1311139777825159
Energy: 1.1608311257907695
Energy: 1.1311139777832995
Energy: 1.3722229370701104
Energy: 1.2069320145550353
Energy: 1.3722229370701104
Energy: 1.2069320145550353
Energy: 1.3722229370701104
Energy: 1.2069320145558189

minimum gb energy = 1.0049522885671385 eV
minimum distance =  2.27645796756707 Angstroms
sigma value = 17


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

Energy: 1.1977313421094486
Energy: 1.0766745314116766
Energy: 1.197731342110557
Energy: 1.0766745314116766
Energy: 1.1977313421094486
Energy: 1.0766745314116766
Energy: 1.1851185113811888
Energy: 1.2660428463336284
Energy: 1.1851185113811888
Energy: 1.2660428463347366
Energy: 1.1851185113811888
Energy: 1.2660428463336284
Energy: 1.170358889780611
Energy: 1.177142895913369
Energy: 1.170358889780611
Energy: 1.177142895913369
Energy: 1.170358889780611
Energy: 1.177142895913369
Energy: 1.0956155833563588
Energy: 1.3648008853699272
Energy: 1.0956155833563588
Energy: 1.3648008853732525
Energy: 1.0956155833563588
Energy: 1.3648008853710356
Energy: 1.305062796201969
Energy: 1.311186950395626
Energy: 1.305062796201969
Energy: 1.3111869503967344
Energy: 1.305062796201969
Energy: 1.311186950395626
Energy: 1.29921870400174
Energy: 1.1765272535331226
Energy: 1.29921870400174
Energy: 1.1765272535331226
Energy: 1.29921870400174
Energy: 1.1765272535331226
Energy: 1.1160481294232085
Energy: 1.2148609482976218
Energy: 1.1160481294243172
Energy: 1.2148609482965134
Energy: 1.1160481294232085
Energy: 1.2148609482976218
Energy: 1.0959893544601096
Energy: 1.3014851366126448
Energy: 1.0959893544601096
Energy: 1.3014851366126448
Energy: 1.0959893544601096
Energy: 1.3014851366126448
Energy: 1.092302445082017
Energy: 1.223878858261473
Energy: 1.092302445082017
Energy: 1.223878858261473
Energy: 1.092302445082017
Energy: 1.223878858261473
Energy: 1.265946887671183
Energy: 1.2543460230471073
Energy: 1.265946887671183
Energy: 1.2543460230471073
Energy: 1.2659468876700748
Energy: 1.2543460230471073
Energy: 1.0716127444142207
Energy: 1.169311123555178
Energy: 1.071612744412004
Energy: 1.169311123555178
Energy: 1.0716127444142207
Energy: 1.169311123555178
Energy: 1.1272411276500869
Energy: 1.345462867597986
Energy: 1.1272411276500869
Energy: 1.345462867597986
Energy: 1.127241127651195
Energy: 1.345462867597986
Energy: 0.9565666282029163
Energy: 1.175808827734844
Energy: 0.9565666282029163
Energy: 1.175808827734844
Energy: 0.9565666282029163
Energy: 1.175808827734844
Energy: 1.0876906624562335
Energy: 1.1230781533043763
Energy: 1.0876906624551252
Energy: 1.1230781533043763
Energy: 1.0876906624551252
Energy: 1.1230781533043763
Energy: 1.284572802375386
Energy: 1.3158183939443855
Energy: 1.284572802375386
Energy: 1.3158183939454937
Energy: 1.284572802375386
Energy: 1.3158183939454937
Energy: 1.072556037205592
Energy: 1.348910140950463
Energy: 1.072556037205592
Energy: 1.3489101409515714
Energy: 1.072556037205592
Energy: 1.3489101409515714
Energy: 1.0817015015804652
Energy: 1.1226053329802865
Energy: 1.0817015015804652
Energy: 1.1226053329802865
Energy: 1.0817015015804652
Energy: 1.1226053329802865

minimum gb energy = 0.9565666282029163 eV
minimum distance =  2.31190361727577 Angstroms
sigma value = 17


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

Energy: 1.42517933574858
Energy: 1.013294546812167
Energy: 1.392514328771466
Energy: 1.013294546812167
Energy: 1.425179335748152
Energy: 1.013294546812167
Energy: 1.1924996396530705
Energy: 1.0685464119033083
Energy: 1.15385628052526
Energy: 1.0685464119020245
Energy: 1.1924996396539267
Energy: 1.0685464119011685
Energy: 1.1324293808617614
Energy: 1.0146620779410427
Energy: 1.151742546853572
Energy: 1.0146620779393305
Energy: 1.1324293808617614
Energy: 1.0146620779401865
Energy: 1.2712872090792569
Energy: 1.0667831885945052
Energy: 1.2712556450276296
Energy: 1.0667831885945052
Energy: 1.2712872090792569
Energy: 1.0667831885945052
Energy: 1.365488190576121
Energy: 1.130320527402962
Energy: 1.365488190576121
Energy: 1.130320527402962
Energy: 1.365488190575693
Energy: 1.130320527402962
Energy: 1.0705218441380935
Energy: 1.0220502683023547
Energy: 1.0696795010100777
Energy: 1.0230375761103354
Energy: 1.0705218441380935
Energy: 1.0220502683023547
Energy: 1.1280531897367394
Energy: 1.2034180645610852
Energy: 1.1280531897363113
Energy: 1.2034180645606571
Energy: 1.1280531897363113
Energy: 1.203418064560229
Energy: 1.2823794168216929
Energy: 1.2209658431726333
Energy: 1.2823794168212648
Energy: 1.2209658431722055
Energy: 1.2823794168216929
Energy: 1.2209658431722055
Energy: 1.1293743770779974
Energy: 1.1662466477878568
Energy: 1.1293743770784255
Energy: 1.1662466477874287
Energy: 1.1293743770784255
Energy: 1.1662466477874287
Energy: 1.142238177918165
Energy: 0.9217640604817088
Energy: 1.142238177917737
Energy: 0.9217640604817088
Energy: 1.142238177917737
Energy: 0.9217640604817088
Energy: 1.15801007418749
Energy: 1.1908382156473414
Energy: 1.15801007418749
Energy: 1.1908382156473414
Energy: 1.15801007418749
Energy: 1.1908382156477695
Energy: 1.072961802327877
Energy: 1.3135473785126937
Energy: 1.072961802327877
Energy: 1.313547378513122
Energy: 1.072961802327877
Energy: 1.3135473785126937
Energy: 1.2002363757945365
Energy: 1.1868406457818754
Energy: 1.2002363757941084
Energy: 1.1868406457823035
Energy: 1.2002363757945365
Energy: 1.1868406457818754
Energy: 0.9849978656978857
Energy: 1.125904893482654
Energy: 0.9849978656991698
Energy: 1.125904893482654
Energy: 0.9849978656978857
Energy: 1.12590489348351
Energy: 1.2408651243824573
Energy: 1.3289622054568941
Energy: 1.2408675072800839
Energy: 1.3289622054568941
Energy: 1.2408651243824573
Energy: 1.328962205456466
Energy: 1.1348331248437136
Energy: 1.1523307918594834
Energy: 1.1349496214946775
Energy: 1.152330791891586
Energy: 1.1348331248437136
Energy: 1.1523307918718966
Energy: 0.9985656773431817
Energy: 1.0822637646190252
Energy: 0.9985656773427538
Energy: 1.0822637646190252
Energy: 0.9985656773427538
Energy: 1.0822637646185973
Energy: 1.3573598899144774
Energy: 1.2558804620580608
Energy: 1.3573598885252742
Energy: 1.255880462057633
Energy: 1.3573598798807038
Energy: 1.255880462057633
Energy: 1.200676639233678
Energy: 1.375953701609411
Energy: 1.200676639234534
Energy: 1.375953701609411
Energy: 1.2006766392323938
Energy: 1.375953701609411
Energy: 0.9975447344701629
Energy: 1.0850570605380925
Energy: 0.9975447344697349
Energy: 1.0016256329626119
Energy: 0.9975447344697349
Energy: 1.0016256329621835
Energy: 1.1051501711094691
Energy: 1.3552138118095631
Energy: 1.1051501711094691
Energy: 1.3552138118095631
Energy: 1.1051501711094691
Energy: 1.3552138118099912
Energy: 1.1963758317397812
Energy: 1.2560619330047542
Energy: 1.1963758317419217
Energy: 1.2560619330047542
Energy: 1.1963758317393534
Energy: 1.2560619330047542
Energy: 1.0453889988379685
Energy: 1.0293085171179948
Energy: 1.0453889988379685
Energy: 1.0293085171179948
Energy: 1.0453889988379685
Energy: 1.0293085171179948
Energy: 1.1456348936878664
Energy: 1.2659497758511205
Energy: 1.1456348936870493
Energy: 1.2659497758511205
Energy: 1.1456348936874772
Energy: 1.2659497758511205
Energy: 1.2073466546313711
Energy: 1.305629692232356
Energy: 1.207346654630943
Energy: 1.305629692232356
Energy: 1.207346654630943
Energy: 1.305629692232356
Energy: 1.0217295913870863
Energy: 1.1230276384259008
Energy: 0.9852158965408674
Energy: 1.123027638425473
Energy: 1.0217295913866584
Energy: 1.123027638425473
Energy: 1.2122773690476227
Energy: 1.17610538966282
Energy: 1.179972480168115
Energy: 1.176105389663248
Energy: 1.2122773690480506
Energy: 1.17610538966282
Energy: 1.141304401872432
Energy: 1.303143703473547
Energy: 1.1380532105597252
Energy: 1.303143703474831
Energy: 1.141304401872004
Energy: 1.3031437034752589
Energy: 1.2798331793939268
Energy: 1.2369564574280938
Energy: 1.2800765079318306
Energy: 1.2369564574276655
Energy: 1.2798331793939268
Energy: 1.2369564574276655
Energy: 1.127656592332308
Energy: 0.9198641904086091
Energy: 1.1276565923318798
Energy: 0.9198641904081811
Energy: 1.127656592332308
Energy: 0.9198641904081811
Energy: 1.1968172452875125
Energy: 1.1721603083988348
Energy: 1.1968172452879406
Energy: 1.1721603084001189
Energy: 1.1968172452875125
Energy: 1.1721603083984067
Energy: 1.2352943495265476
Energy: 1.268575636658349
Energy: 1.2352943495269755
Energy: 1.268575636658349
Energy: 1.2352943495265476
Energy: 1.268575636658349
Energy: 1.1253329123635636
Energy: 1.1299722823907528
Energy: 1.1253329123644196
Energy: 1.1299722823941771
Energy: 1.1253329123639915
Energy: 1.1299722823856164
Energy: 1.0385890248902605
Energy: 0.9993267213417331
Energy: 1.0385890248906886
Energy: 0.999326721342161
Energy: 1.0385890248902605
Energy: 0.999326721341305
Energy: 1.3457064031071162
Energy: 1.1445173609603168
Energy: 1.3457064031075443
Energy: 1.1445173609594608
Energy: 1.3457064031071162
Energy: 1.1445173609594608
Energy: 1.2803265107395307
Energy: 1.139720655387073
Energy: 1.2803265107399588
Energy: 1.1397206553875008
Energy: 1.2803265107399588
Energy: 1.1397206553875008
Energy: 1.0791560824416906
Energy: 1.0419610966096076
Energy: 1.0791560824416906
Energy: 1.0419610966091795
Energy: 1.0791560824416906
Energy: 1.0419610966096076
Energy: 1.178625294501047
Energy: 0.9755334715708881
Energy: 1.1786252945014748
Energy: 0.9755334715700319
Energy: 1.178625294501047
Energy: 0.97553347157046
Energy: 1.392514328771894
Energy: 1.013294546812167
Energy: 1.392514328771894
Energy: 1.013294546812167
Energy: 1.392514328771894
Energy: 1.013294546812167
Energy: 1.1538562805248318
Energy: 1.1746399998522277
Energy: 1.1538562805248318
Energy: 1.1746399998513715
Energy: 1.153856280525688
Energy: 1.1746399998535118
Energy: 1.1483069971849047
Energy: 1.020337858851182
Energy: 1.1483071063697878
Energy: 1.020337858851182
Energy: 1.1483069971853328
Energy: 1.020337858851182
Energy: 1.2712672046445799
Energy: 1.1139439255245511
Energy: 1.271270708895019
Energy: 1.1139439255245511
Energy: 1.2712672046445799
Energy: 1.113943925524979
Energy: 1.3654881905769771
Energy: 1.1370339960216718
Energy: 1.3654881905769771
Energy: 1.1370339960208156
Energy: 1.3654881905769771
Energy: 1.1370339960212437

minimum gb energy = 0.9198641904081811 eV
minimum distance =  2.26677992873952 Angstroms
sigma value = 57


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

Energy: 1.3355335284139727
Energy: 0.90907766512844
Energy: 1.3355335284139727
Energy: 0.9090776651263489
Energy: 1.3355335284139727
Energy: 0.9090776651291368
Energy: 1.044069449774427
Energy: 0.8820096267577255
Energy: 1.044069449774427
Energy: 0.8820096267598162
Energy: 1.04406944977373
Energy: 0.8820096267577255
Energy: 0.9889557791123704
Energy: 1.0505270442900445
Energy: 0.9889557791123704
Energy: 1.0505270442907415
Energy: 0.9889557791123704
Energy: 1.0505270442900445
Energy: 1.1970856991661105
Energy: 0.9583372358418694
Energy: 1.1970856991661105
Energy: 0.9583372358418694
Energy: 1.1970856991661105
Energy: 0.9583372358411725
Energy: 1.220011190312159
Energy: 0.8417156293544423
Energy: 1.220011190312159
Energy: 0.8417156293544423
Energy: 1.220011190312159
Energy: 0.8417156293551391
Energy: 0.9545905243450582
Energy: 0.8890805219920436
Energy: 0.9545905243450582
Energy: 0.8890805219920436
Energy: 0.9545905243450582
Energy: 0.8890805219920436
Energy: 1.1637504014228133
Energy: 1.0617869805534959
Energy: 1.1637504014228133
Energy: 1.0617869805541928
Energy: 1.1637504014228133
Energy: 1.0617869805541928
Energy: 1.1343843046940614
Energy: 1.141742201733189
Energy: 1.1343843046947581
Energy: 1.141742201732492
Energy: 1.1343843046947581
Energy: 1.141742201732492
Energy: 1.029642678576514
Energy: 1.0113436690428774
Energy: 1.0296426785772108
Energy: 1.0113436690428774
Energy: 1.029642678576514
Energy: 1.0113436690428774
Energy: 1.0397488982165706
Energy: 0.9087762269387346
Energy: 1.0397488982165706
Energy: 0.9087762269394315
Energy: 1.0397488982158738
Energy: 0.9087762269387346
Energy: 1.1637345077206798
Energy: 1.1403313626119094
Energy: 1.1637345077199825
Energy: 1.1403313626112124
Energy: 1.1637345077199825
Energy: 1.1403313626119094
Energy: 0.9224194765068383
Energy: 1.16307008591733
Energy: 0.9224194765075352
Energy: 1.1630700859145422
Energy: 0.9224194765068383
Energy: 1.16307008591733
Energy: 1.0405961184405745
Energy: 1.013021117346465
Energy: 1.0405961184377868
Energy: 1.013021117346465
Energy: 1.0405961184391805
Energy: 1.013021117346465
Energy: 1.1476407124409396
Energy: 1.2791268751067564
Energy: 1.1476407124409396
Energy: 1.2791268751074532
Energy: 1.1476407124409396
Energy: 1.2791268751074532
Energy: 0.970632621595216
Energy: 1.227873124530983
Energy: 0.9706326215959129
Energy: 1.227873124530286
Energy: 0.9706326215959129
Energy: 1.227873124530286
Energy: 1.0804848542499172
Energy: 1.051789129626715
Energy: 1.0804848542520082
Energy: 1.0517891296274118
Energy: 1.0804848542554928
Energy: 1.0517891296295026
Energy: 1.2172702977558338
Energy: 1.0318934829514042
Energy: 1.2172702977551368
Energy: 1.0318934829507072
Energy: 1.2172702977551368
Energy: 1.0318934829507072
Energy: 1.0875029047021636
Energy: 1.2276839400064983
Energy: 1.0875029047021636
Energy: 1.2276839400064983
Energy: 1.0875029047021636
Energy: 1.227683940007195
Energy: 1.0481942084692537
Energy: 1.2074838626022013
Energy: 1.0481942084692537
Energy: 1.2074838626022013
Energy: 1.048194208468557
Energy: 1.2074838626022013
Energy: 1.0104288499862757
Energy: 0.9591107355979824
Energy: 1.0104288499855787
Energy: 0.9591107355979824
Energy: 1.0104288499869725
Energy: 0.9591107355979824
Energy: 1.063679960748511
Energy: 1.1842608234620524
Energy: 1.0636799607492078
Energy: 1.1842608234627494
Energy: 1.063679960748511
Energy: 1.1842608234627494
Energy: 0.8554265016413529
Energy: 1.2565252331614856
Energy: 0.8554265016601702
Energy: 1.2565252331614856
Energy: 0.855426501639959
Energy: 1.2565252331621826
Energy: 0.9278758238715521
Energy: 0.9198115444294866
Energy: 0.9278758238778243
Energy: 0.9198115444287898
Energy: 0.9278758238771275
Energy: 0.9198115444294866
Energy: 0.9424335542960727
Energy: 1.2825086729799828
Energy: 0.9424335542960727
Energy: 1.2825086729792858
Energy: 0.9424335542960727
Energy: 1.2825086729792858
Energy: 1.0089770648904823
Energy: 1.1614412208256149
Energy: 1.0089770648904823
Energy: 1.1614412208242209
Energy: 1.0089770648897856
Energy: 1.1614412208235239
Energy: 1.038760505526794
Energy: 0.9196766475176877
Energy: 1.0387605055281879
Energy: 0.919676647516991
Energy: 1.0387605055281879
Energy: 0.9196766475176877
Energy: 0.9845332324560696
Energy: 1.0916948495309315
Energy: 0.9845332324560696
Energy: 1.091694849977481
Energy: 0.9845332324560696
Energy: 1.091694849650045

minimum gb energy = 0.8417156293544423 eV
minimum distance =  2.28351475628213 Angstroms
sigma value = 43


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

Energy: 1.2641418449127986
Energy: 1.0227279123214663
Energy: 1.2641418449122908
Energy: 1.0227279123214663
Energy: 1.2641418449127986
Energy: 1.0227279123219741
Energy: 0.921179374390634
Energy: 0.9537869736004256
Energy: 0.9211793743886029
Energy: 0.95378697359941
Energy: 0.9211793743921575
Energy: 0.9537869736004256
Energy: 0.8947014324273203
Energy: 0.9540970486565425
Energy: 0.8947014324273203
Energy: 0.9540970486565425
Energy: 0.8947014324283357
Energy: 0.9540970486565425
Energy: 1.0664477856112804
Energy: 0.8573092738498571
Energy: 1.0664477856107726
Energy: 0.8573092738498571
Energy: 1.0664477856107726
Energy: 0.8573092738498571
Energy: 1.0428004705773228
Energy: 1.0245210176867328
Energy: 1.0428004705763072
Energy: 1.0245210176872406
Energy: 1.042800470576815
Energy: 1.0245210176872406
Energy: 0.8341295110062006
Energy: 0.9014450089016041
Energy: 0.8341295110062006
Energy: 0.9014450089010961
Energy: 0.8341295110056927
Energy: 0.9014450089016041
Energy: 1.0520066172015885
Energy: 0.9011740871011215
Energy: 1.0520066172015885
Energy: 0.9011740871011215
Energy: 1.0520066172015885
Energy: 0.9011740871016292
Energy: 1.0770535141356306
Energy: 1.0043240005425895
Energy: 1.0770535141351225
Energy: 1.0043240005430971
Energy: 1.0770535141356306
Energy: 1.0043240005430971
Energy: 0.7958159261329478
Energy: 0.8911701060567224
Energy: 0.7958159261329478
Energy: 0.8911701060572301
Energy: 0.7958159261329478
Energy: 0.8911701060562146
Energy: 0.9073299538870094
Energy: 0.8714131118088998
Energy: 0.9073299538875172
Energy: 0.8714131118094076
Energy: 0.9073299538870094
Energy: 0.8714131118099155
Energy: 0.993637911231798
Energy: 0.9597855172611166
Energy: 0.9936379112292588
Energy: 0.9597855172611166
Energy: 0.99363791123129
Energy: 0.9597855172616245
Energy: 0.9325279365952892
Energy: 0.8900592311478794
Energy: 0.9325279365952892
Energy: 0.8900592311483873
Energy: 0.9325279365952892
Energy: 0.8900592311478794
Energy: 0.9146852741726298
Energy: 0.7542638760150713
Energy: 0.9146852741721221
Energy: 0.7542638760145635
Energy: 0.9146852741721221
Energy: 0.7542638760150713
Energy: 1.017503216361367
Energy: 1.003095239601493
Energy: 1.0175032163608593
Energy: 1.0030952396005235
Energy: 1.0175032163608593
Energy: 1.003095239601493
Energy: 0.8643803544499489
Energy: 0.8898521418777939
Energy: 0.864380354449441
Energy: 0.8898521418777939
Energy: 0.864380354449441
Energy: 0.8898521418777939
Energy: 0.939742657290494
Energy: 0.8281045247755201
Energy: 0.939742657290494
Energy: 0.8281045247750123
Energy: 0.9397426572910017
Energy: 0.8281045247755201
Energy: 1.0039873865027924
Energy: 0.9999495754816227
Energy: 1.003987386499238
Energy: 0.999949575480607
Energy: 1.0039873865007611
Energy: 0.999949575480607
Energy: 0.8044435201139822
Energy: 1.075091654305515
Energy: 0.80444352011449
Energy: 1.075091654305007
Energy: 0.8044435201139822
Energy: 1.075091654305515
Energy: 0.9091622581232269
Energy: 0.8827719705777327
Energy: 0.9091622581232269
Energy: 0.8827719705767172
Energy: 0.9091622581232269
Energy: 0.882771970577225
Energy: 1.0659471161903353
Energy: 1.010223775444405
Energy: 1.0659471161903353
Energy: 1.010223775444405
Energy: 1.0659471161903353
Energy: 1.010223775444405
Energy: 0.8768265373206054
Energy: 1.1420517831295809
Energy: 0.87682653731959
Energy: 1.1420517831300887
Energy: 0.87682653731959
Energy: 1.1420517831295809
Energy: 0.9638261238725372
Energy: 0.9263074178297748
Energy: 0.9638261238710137
Energy: 0.9263074178394227
Energy: 0.9638261238715214
Energy: 0.9263074178368838
Energy: 1.071980055691685
Energy: 0.9005371261640513
Energy: 1.0719800556947314
Energy: 0.9005371261635434
Energy: 1.071980055691177
Energy: 0.9005371261640513
Energy: 0.9342956805142305
Energy: 1.078819707420487
Energy: 0.9342956805147382
Energy: 1.0788197074184558
Energy: 0.9342956805142305
Energy: 1.0788197074194714
Energy: 0.9107016797408843
Energy: 0.9275143178960717
Energy: 0.9107016797403766
Energy: 0.9275143178965795
Energy: 0.9107016797408843
Energy: 0.927514317895564
Energy: 1.022695237095678
Energy: 0.8467962556023659
Energy: 1.022695237095678
Energy: 0.8467962556023659
Energy: 1.022695237095678
Energy: 0.8467962556023659
Energy: 0.8295483653197668
Energy: 1.136162437283093
Energy: 0.8295483653197668
Energy: 1.136162437283601
Energy: 0.8407436766112436
Energy: 1.136162437283093
Energy: 0.8812544990096325
Energy: 1.0469908729873725
Energy: 0.8812544990101402
Energy: 1.0469908729873725
Energy: 0.8812544990101402
Energy: 1.0469908729873725
Energy: 0.8844478460513788
Energy: 0.793652743732086
Energy: 0.8844478460513788
Energy: 0.793652743732086
Energy: 0.8844478460503631
Energy: 0.7936527437325939
Energy: 0.8642629686742408
Energy: 1.031228062483006
Energy: 0.8642629686742408
Energy: 1.031228062483006
Energy: 0.8642629686742408
Energy: 1.031228062483006
Energy: 0.8654039869870614
Energy: 1.0919720337958707
Energy: 0.8654039869850302
Energy: 1.0919720337958707
Energy: 0.8654039869865536
Energy: 1.091972033795363
Energy: 0.883903716920512
Energy: 0.7702971456615398
Energy: 0.8839037169200042
Energy: 0.7702971456615398
Energy: 0.883903716920512
Energy: 0.7702971456615398
Energy: 0.7626878438929434
Energy: 1.0898001566030513
Energy: 0.7626878438929434
Energy: 1.0898001566035591
Energy: 0.7626878438929434
Energy: 1.0898001566035591
Energy: 0.9981184781689189
Energy: 1.0100325144008238
Energy: 0.9981184781684111
Energy: 1.0100325144013316
Energy: 0.9981184781694267
Energy: 1.0100325144008238
Energy: 0.9108055167988865
Energy: 0.8470506878533918
Energy: 0.9108055167993943
Energy: 0.8470506878533918
Energy: 0.9108055167988865
Energy: 0.8470506878533918
Energy: 0.7973908363847831
Energy: 0.8838331603018996
Energy: 0.7973908363842753
Energy: 0.8838331603003763
Energy: 0.7973908363847831
Energy: 0.8838331603013919

minimum gb energy = 0.7542638760145635 eV
minimum distance =  2.28358301975101 Angstroms
sigma value = 81


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

Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.5732316540133324
Energy: 0.05350834554598102
Energy: 0.5732316540133324
Energy: 0.05350834556650434
Energy: 0.5732316540133324
Energy: 0.05350834546579591
Energy: 0.573230538594487
Energy: 0.053109601322979434
Energy: 0.573230538594487
Energy: 0.053109601315516404
Energy: 0.573230538594487
Energy: 0.05310960132671094
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.5732316540133324
Energy: 0.05350834550120287
Energy: 0.5732316540133324
Energy: 0.05350834564109217
Energy: 0.5732316540133324
Energy: 0.05350834559071676
Energy: 0.573230538594487
Energy: 0.05310960134532611
Energy: 0.573230538594487
Energy: 0.05310960134532611
Energy: 0.573230538594487
Energy: 0.053109601339728835
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.5732316540133324
Energy: 0.05350834559258252
Energy: 0.5732316540133324
Energy: 0.053508345611240085
Energy: 0.5732316540133324
Energy: 0.05350834559444828
Energy: 0.573230538594487
Energy: 0.053109601322979434
Energy: 0.573230538594487
Energy: 0.05310960133044245
Energy: 0.573230538594487
Energy: 0.053109601324845185
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868
Energy: 0.05219835797542171
Energy: 0.1089479641930868

minimum gb energy = 0.05219835797542171 eV
minimum distance =  2.46632891340473 Angstroms
sigma value = 3


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

Energy: 1.00394524155603
Energy: 0.7967878436916666
Energy: 1.0039452415565884
Energy: 0.7967878436911082
Energy: 1.0039452415571468
Energy: 0.7967878436916666
Energy: 0.8142768355395726
Energy: 0.950653254357843
Energy: 0.8142768355395726
Energy: 0.9506532543572845
Energy: 0.8142768355395726
Energy: 0.950653254357843
Energy: 0.8945794200184137
Energy: 0.9538084165325855
Energy: 0.8518623188584065
Energy: 0.9538084165325855
Energy: 0.8518623188584065
Energy: 0.9538084165325855
Energy: 0.9345843736687218
Energy: 0.8440969173879872
Energy: 0.9345843736692293
Energy: 0.8440969173879872
Energy: 0.9345843736692293
Energy: 0.8440969173879872
Energy: 0.7007213552640279
Energy: 1.0155934943198337
Energy: 0.7007213552645861
Energy: 1.0155934943198337
Energy: 0.7007213552640279
Energy: 1.0155934943198337
Energy: 0.8674137034212017
Energy: 0.906345903481097
Energy: 0.8674137034217599
Energy: 0.906345903482772
Energy: 0.8674137034217599
Energy: 0.9063459034833303
Energy: 0.9101841574818605
Energy: 0.9016123123765319
Energy: 0.9101841574813023
Energy: 0.9016123123770902
Energy: 0.9101841574818605
Energy: 0.9016123123770902
Energy: 0.8526994164799689
Energy: 1.119522313614493
Energy: 0.8526994164799689
Energy: 1.119522313614493
Energy: 0.8526994164805273
Energy: 1.119522313614493
Energy: 0.8808132712005985
Energy: 0.9039430390084661
Energy: 0.8808132712005985
Energy: 0.9039430390079077
Energy: 0.8808132712005985
Energy: 0.9039430390079077
Energy: 0.805731898792685
Energy: 0.8491843135005176
Energy: 0.8057318987949182
Energy: 0.8491843135005176
Energy: 0.8057318987954767
Energy: 0.8491843134999594
Energy: 0.8821099120082353
Energy: 0.8334903367345555
Energy: 0.8821099120087936
Energy: 0.8334903367345555
Energy: 0.8821099120087936
Energy: 0.8334903367339973
Energy: 0.9092619145309987
Energy: 0.9227538899368634
Energy: 0.9092619145309987
Energy: 0.922753889936305
Energy: 0.9092619145298819
Energy: 0.9227538899368634
Energy: 0.9429899200410283
Energy: 0.8597087280495321
Energy: 0.9429899200410283
Energy: 0.8597087280495321
Energy: 0.9429899200410283
Energy: 0.8597087280489738
Energy: 0.8708642817992893
Energy: 0.890720509017832
Energy: 0.8708642817992893
Energy: 0.8907205090189486
Energy: 0.8708642817992893
Energy: 0.8907205090189486
Energy: 0.8948515240753485
Energy: 0.8903623371947273
Energy: 0.8948515240753485
Energy: 0.8903623371947273
Energy: 0.8948515240753485
Energy: 0.8903623371952857
Energy: 0.9155786042460299
Energy: 0.8846693388417948
Energy: 0.9155786042460299
Energy: 0.8846693388417948
Energy: 0.9155786042465881
Energy: 0.8846693388417948
Energy: 0.806553362938842
Energy: 0.9209099816881031
Energy: 0.8065533629399585
Energy: 0.9209099816881031
Energy: 0.8065533629382834
Energy: 0.9209099816886614
Energy: 0.9517047116185393
Energy: 0.8420178440789918
Energy: 0.9517047116185393
Energy: 0.842017844077875
Energy: 0.9517047116185393
Energy: 0.842017844077875
Energy: 0.9507031936084225
Energy: 0.9445955324723075
Energy: 0.950703193607864
Energy: 0.9445953092416979
Energy: 0.950703193607864
Energy: 0.9445956762963298
Energy: 0.8341397748656408
Energy: 0.9846414612472817
Energy: 0.8341397748661994
Energy: 0.9846414612444898
Energy: 0.8341397748661994
Energy: 0.9846414612433734
Energy: 0.9016431606604851
Energy: 0.831799749798056
Energy: 0.9016431606604851
Energy: 0.8317997497986144
Energy: 0.9016431606604851
Energy: 0.8317997497986144
Energy: 0.981198498127052
Energy: 0.8507321208126714
Energy: 0.9811984981264936
Energy: 0.8507321208121131
Energy: 0.9811984981264936
Energy: 0.8507321208121131
Energy: 0.8660466681037534
Energy: 0.9989149354389582
Energy: 0.866046668103195
Energy: 0.9989149354400749
Energy: 0.8660466681037534
Energy: 0.9989149354400749
Energy: 0.9534730988979414
Energy: 0.8320100611980227
Energy: 0.9534730988973831
Energy: 0.8320100611980227
Energy: 0.9534730988979414
Energy: 0.8320100611980227
Energy: 0.9245247118502625
Energy: 0.870642258465005
Energy: 0.9245247118502625
Energy: 0.8706422584661216
Energy: 0.9245247118497042
Energy: 0.870642258465005
Energy: 0.8058416916998684
Energy: 0.9864217044960735
Energy: 0.8058416916998684
Energy: 0.9864217044960735
Energy: 0.8058416916993103
Energy: 0.9864217044966319
Energy: 0.9754686591458491
Energy: 0.7328495505235888
Energy: 0.9754686591458491
Energy: 0.7328495505230306
Energy: 0.9754686591458491
Energy: 0.7328495505247054
Energy: 0.893813267087626
Energy: 0.8821462872077596
Energy: 0.8938132670870675
Energy: 0.8821462872088762
Energy: 0.893813267087626
Energy: 0.8821462872088762
Energy: 0.7677478643799294
Energy: 0.8348303533177821
Energy: 0.7677478643799294
Energy: 0.8348303533183403
Energy: 0.7677478643799294
Energy: 0.8348303533177821
Energy: 0.9747889890060338
Energy: 0.793543514221971
Energy: 0.9747889890054755
Energy: 0.7935435142214127
Energy: 0.9747889890060338
Energy: 0.793543514221971
Energy: 0.9960515675204012
Energy: 0.9001336070150553
Energy: 0.996051567519843
Energy: 0.9001336070150553
Energy: 0.996051567519843
Energy: 0.9001336070150553
Energy: 0.835888260756034
Energy: 0.9207812815563645
Energy: 0.8358882607554755
Energy: 0.9207812815563645
Energy: 0.835888260756034
Energy: 0.9207812815569227
Energy: 0.879318610916899
Energy: 0.905135476395874
Energy: 0.8793186109174573
Energy: 0.905135476395874
Energy: 0.8793186109174573
Energy: 0.905135476395874

minimum gb energy = 0.7007213552640279 eV
minimum distance =  2.34265670822463 Angstroms
sigma value = 67


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

Energy: 1.1549270790212864
Energy: 0.9999299786386846
Energy: 1.154927079020491
Energy: 0.9999299786386846
Energy: 1.1549270790220822
Energy: 0.9999299786386846
Energy: 1.0082139156003191
Energy: 1.108487828271996
Energy: 1.0082139156003191
Energy: 1.108487828271996
Energy: 1.0082139156003191
Energy: 1.108487828271996
Energy: 1.1505078606618724
Energy: 1.1034418019441334
Energy: 1.1505078606618724
Energy: 1.1034418019441334
Energy: 1.0731452727750832
Energy: 1.1034418019441334
Energy: 1.1267307975953946
Energy: 0.9836191076547967
Energy: 1.126730797594599
Energy: 0.9836191076547967
Energy: 1.1267307975969858
Energy: 0.9836191076547967
Energy: 0.9787071930587675
Energy: 1.0056599328498896
Energy: 0.9787071930595632
Energy: 1.0056599328498896
Energy: 0.9787071930595632
Energy: 1.0056599328498896
Energy: 1.0613730475072538
Energy: 1.0761172040066653
Energy: 1.0613730475080494
Energy: 1.076117204007461
Energy: 1.0613730475072538
Energy: 1.0761172040066653
Energy: 1.0376175426851921
Energy: 1.0715142622829676
Energy: 1.0376175426836012
Energy: 1.0715142622821718
Energy: 1.0376175426843968
Energy: 1.0715142622837632
Energy: 0.9699313688314743
Energy: 0.9759561234712077
Energy: 0.9699313688322698
Energy: 0.9759561234712077
Energy: 0.9699313688322698
Energy: 0.9759561234712077
Energy: 1.1273043715663973
Energy: 1.1174021962719418
Energy: 1.1273043715671929
Energy: 1.1174021962719418
Energy: 1.1273043715663973
Energy: 1.1174021962719418
Energy: 1.0844662357971993
Energy: 1.0657548741096066
Energy: 1.0844662357971993
Energy: 1.0657548741096066
Energy: 1.0844662357971993
Energy: 1.0657548741096066
Energy: 1.0809315178211305
Energy: 1.0721363500031291
Energy: 1.080931517821926
Energy: 1.0721363500023338
Energy: 1.080931517821926
Energy: 1.0721363500031291
Energy: 1.074181283744782
Energy: 1.0620771706003358
Energy: 1.074181283744782
Energy: 1.0620771706003358
Energy: 1.074181283744782
Energy: 1.0620771706003358
Energy: 1.070681286189937
Energy: 1.104230591700323
Energy: 1.070681286189937
Energy: 1.104230591700323
Energy: 1.070681286189937
Energy: 1.1042305916995276
Energy: 1.0676524017942142
Energy: 1.1557561420246982
Energy: 1.0676524017942142
Energy: 1.1557561420246982
Energy: 1.0676524017942142
Energy: 1.1557561420239026
Energy: 1.0172343215650446
Energy: 0.9962479862570384
Energy: 1.0172343215650446
Energy: 0.9962479862578341
Energy: 1.0172343215650446
Energy: 0.9962479862570384
Energy: 1.0169200039241557
Energy: 1.0326608977255445
Energy: 1.01692000392336
Energy: 1.032660897724749
Energy: 1.01692000392336
Energy: 1.032660897724749
Energy: 1.0121768192778418
Energy: 1.153145200934859
Energy: 1.0121768192778418
Energy: 1.1531452009340633
Energy: 1.0121768192778418
Energy: 1.153145200934859
Energy: 1.0563973563643785
Energy: 0.9837583599536873
Energy: 1.0563973563643785
Energy: 0.9837583599536873
Energy: 1.0563973563635831
Energy: 0.9837583599536873
Energy: 1.1309300929633288
Energy: 1.1052346197461693
Energy: 1.1309300929625332
Energy: 1.1052346197469651
Energy: 1.1309300929625332
Energy: 1.1052346197469651
Energy: 1.0930867085728069
Energy: 1.124188783643022
Energy: 1.0930867085720113
Energy: 1.1241887836438174
Energy: 1.0930867085720113
Energy: 1.124188783643022
Energy: 1.1206560697155448
Energy: 0.986582648437746
Energy: 1.1206560697155448
Energy: 0.986582648437746
Energy: 1.1206560697155448
Energy: 0.9865826484385415
Energy: 1.1193220851421473
Energy: 1.1498650604442175
Energy: 1.1193220851421473
Energy: 1.1498650604442175
Energy: 1.1193220851421473
Energy: 1.1498650604442175
Energy: 1.0915496751681664
Energy: 1.1204906771990435
Energy: 1.0587198604369092
Energy: 1.1204906771998389
Energy: 1.0587198604369092
Energy: 1.1204906771990435

minimum gb energy = 0.9699313688314743 eV
minimum distance =  2.32584228912403 Angstroms
sigma value = 33


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

Energy: 1.3159048777455897
Energy: 1.058060710933252
Energy: 1.3159048777455897
Energy: 1.058060710933252
Energy: 1.315904877745085
Energy: 1.0580607109327473
Energy: 1.1028211100508203
Energy: 1.1929669333202677
Energy: 1.1028211100508203
Energy: 1.192966933319763
Energy: 1.102821110051325
Energy: 1.192966933319763
Energy: 1.211580272241799
Energy: 1.1939119257810256
Energy: 1.2115802722407898
Energy: 1.1939119257810256
Energy: 1.2115802722412943
Energy: 1.1939119257810256
Energy: 1.217116219543195
Energy: 1.0561706396099992
Energy: 1.217116219543195
Energy: 1.0561706396094945
Energy: 1.217116219543195
Energy: 1.0561706396094945
Energy: 1.1082183312809017
Energy: 1.2301300722903468
Energy: 1.1082183312809017
Energy: 1.2301300722903468
Energy: 1.1082183312824159
Energy: 1.2301300722903468
Energy: 1.3208638459331752
Energy: 1.2589554037189437
Energy: 1.3208638459331752
Energy: 1.2589554037194481
Energy: 1.3208638459331752
Energy: 1.2589554037194481
Energy: 1.105174021726643
Energy: 1.2176474747298929
Energy: 1.105174021726643
Energy: 1.2176474747298929
Energy: 1.105174021726643
Energy: 1.2176474747298929
Energy: 1.179659783814287
Energy: 1.2034904217559237
Energy: 1.179659783814287
Energy: 1.2034904217559237
Energy: 1.179659783814287
Energy: 1.2034904217559237
Energy: 1.1700284236587997
Energy: 1.2016622643596762
Energy: 1.1700284236587997
Energy: 1.2016622643596762
Energy: 1.1700284236587997
Energy: 1.2016622643596762
Energy: 1.2865861937462046
Energy: 1.2735822396540666
Energy: 1.2865861937462046
Energy: 1.2490111722473412
Energy: 1.2865861937467094
Energy: 1.2490111722508739
Energy: 1.1691886960877838
Energy: 1.2307358319360269
Energy: 1.169188696087279
Energy: 1.2307358319355222
Energy: 1.1691886960882885
Energy: 1.2307358319355222
Energy: 1.1188824734818572
Energy: 1.1163210033550928
Energy: 1.1188824734823621
Energy: 1.116321003354588
Energy: 1.1188824734818572
Energy: 1.1163210033550928
Energy: 1.2658564761511026
Energy: 1.1224912393811206
Energy: 1.2658564761516073
Energy: 1.1224912393811206
Energy: 1.2658564761511026
Energy: 1.1224912393811206
Energy: 1.140851171776689
Energy: 1.1990035288255771
Energy: 1.140851171776689
Energy: 1.199003528824063
Energy: 1.140851171776689
Energy: 1.1990035288260819
Energy: 1.1642314143950254
Energy: 1.126891586245784
Energy: 1.1642314143955301
Energy: 1.126891586245784
Energy: 1.1642314143955301
Energy: 1.126891586245784
Energy: 1.216963710127314
Energy: 1.1989140184919478
Energy: 1.2169637101278188
Energy: 1.1989140184924523
Energy: 1.216963710127314
Energy: 1.1989140184919478
Energy: 1.1913677024156613
Energy: 1.2020172530829272
Energy: 1.1913677024176799
Energy: 1.2020172530829272
Energy: 1.1913677024166704
Energy: 1.2020172530829272
Energy: 1.245760208173869
Energy: 1.251554988255492
Energy: 1.245760208173869
Energy: 1.2515549882549872
Energy: 1.245760208173869
Energy: 1.251554988255492
Energy: 1.1063813501379172
Energy: 1.2541533738371724
Energy: 1.1063813501379172
Energy: 1.2541533738371724
Energy: 1.1063813501379172
Energy: 1.2541533738371724
Energy: 1.2151610707702787
Energy: 1.2322774724976095
Energy: 1.215161070769774
Energy: 1.232277472498619
Energy: 1.215161070769774
Energy: 1.2322774724981143
Energy: 1.2576013039739136
Energy: 1.1972024851803835
Energy: 1.2576013039739136
Energy: 1.1972024851803835
Energy: 1.2576013039744183
Energy: 1.1972024851803835
Energy: 1.1674735863427081
Energy: 1.093789385676611
Energy: 1.1674735863427081
Energy: 1.0937893856761063
Energy: 1.1674735863432129
Energy: 1.093789385676611
Energy: 1.096392871972029
Energy: 1.2305751603570343
Energy: 1.096392871972029
Energy: 1.2305751603575388
Energy: 1.096392871972029
Energy: 1.2305751603575388
Energy: 1.264195688168793
Energy: 1.1431289668071343
Energy: 1.264195688168288
Energy: 1.1431289668071343
Energy: 1.264195688168793
Energy: 1.143128966807639
Energy: 1.1182171842284458
Energy: 1.1115648170174297
Energy: 1.1182171842294553
Energy: 1.111564817016925
Energy: 1.1182171842284458
Energy: 1.1115648170174297
Energy: 1.1027194255319417
Energy: 1.266211397578203
Energy: 1.1027194255314368
Energy: 1.2662113975776983
Energy: 1.1027194255319417
Energy: 1.266211397578203
Energy: 1.1627795816371365
Energy: 1.1895550320499255
Energy: 1.1627795816371365
Energy: 1.1895550320499255
Energy: 1.1627795816366318
Energy: 1.1895550320504302
Energy: 1.2581831700380965
Energy: 1.266408193598186
Energy: 1.2581831700380965
Energy: 1.251762168816296
Energy: 1.2581831700380965
Energy: 1.251762168816296
Energy: 1.2188438754929831
Energy: 1.2302699144875409
Energy: 1.2188438754924784
Energy: 1.2302699144885503
Energy: 1.2188438754960111
Energy: 1.2302699144885503
Energy: 1.1074560996761922
Energy: 1.2383043919076717
Energy: 1.1074560996761922
Energy: 1.2383043919081764
Energy: 1.1074560996761922
Energy: 1.2383043919076717
Energy: 1.322525336240149
Energy: 1.2672177082476994
Energy: 1.322525336240149
Energy: 1.267217708248204
Energy: 1.322525336240149
Energy: 1.2672177082476994
Energy: 1.2109377074625223
Energy: 1.2047975289913329
Energy: 1.2109377074625223
Energy: 1.2047975289913329
Energy: 1.2109377074625223
Energy: 1.2047975289913329
Energy: 1.2102970781697617
Energy: 1.1966479661645484
Energy: 1.2102970781697617
Energy: 1.1966479661645484
Energy: 1.2102970781702664
Energy: 1.1966479661645484
Energy: 1.1648277673755247
Energy: 1.192863740030521
Energy: 1.1648277673755247
Energy: 1.192863740030521
Energy: 1.16482776737502
Energy: 1.192863740030521
Energy: 1.1429733900502808
Energy: 1.1935413334268363
Energy: 1.1429733900502808
Energy: 1.1935413334268363
Energy: 1.1429733900502808
Energy: 1.1935413334268363
Energy: 1.2867034993091113
Energy: 1.1217198920253886
Energy: 1.2867034993086066
Energy: 1.1217198920253886
Energy: 1.2867034993091113
Energy: 1.1217198920253886
Energy: 1.1062189542848009
Energy: 1.1322750037812421
Energy: 1.1062189542842962
Energy: 1.1322750037812421
Energy: 1.1062189542842962
Energy: 1.1322750037812421

minimum gb energy = 1.0561706396094945 eV
minimum distance =  2.32778634764333 Angstroms
sigma value = 41


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

Energy: 1.3923421591383511
Energy: 1.1844813344867298
Energy: 1.3923421591396663
Energy: 1.1844813344853518
Energy: 1.3923421591383511
Energy: 1.1844813344867298
Energy: 1.2104553098112771
Energy: 1.3079759158471993
Energy: 1.2104553098112771
Energy: 1.307975915845821
Energy: 1.2104553098112771
Energy: 1.307975915845821
Energy: 1.5495243658116793
Energy: 1.3093089507692035
Energy: 1.4580525933000026
Energy: 1.3093089507692035
Energy: 1.4580525932986248
Energy: 1.3093089507692035
Energy: 1.3592377535922773
Energy: 1.413557453412352
Energy: 1.3592377535922773
Energy: 1.413557453412352
Energy: 1.3592377535922773
Energy: 1.413557453412352
Energy: 1.318411033066786
Energy: 1.3072773080060103
Energy: 1.318411033066786
Energy: 1.3072773080060103
Energy: 1.318411033066786
Energy: 1.3072773080073885
Energy: 1.4291077164783534
Energy: 1.3169489575896294
Energy: 1.4291077164783534
Energy: 1.3169489575896294
Energy: 1.4291077164783534
Energy: 1.3169489575896294
Energy: 1.353271493617854
Energy: 1.3652530764448099
Energy: 1.353271493617854
Energy: 1.3652530764448099
Energy: 1.353271493617854
Energy: 1.3652530764448099
Energy: 1.3021496891235957
Energy: 1.3382264818969014
Energy: 1.3021496891235957
Energy: 1.3382264818955234
Energy: 1.3021496891235957
Energy: 1.3382264818969014
Energy: 1.2265927654743103
Energy: 1.2203759545159494
Energy: 1.2265927654743103
Energy: 1.2203759545159494
Energy: 1.2265927654743103
Energy: 1.2203759545159494
Energy: 1.3784213798978349
Energy: 1.2265709242261669
Energy: 1.3784213798978349
Energy: 1.2265709242261669
Energy: 1.3784213798978349
Energy: 1.2265709242261669
Energy: 1.2157431021483551
Energy: 1.3094408812159861
Energy: 1.2157431021483551
Energy: 1.3094408812159861
Energy: 1.2157431021483551
Energy: 1.3094408812159861
Energy: 1.2942465754746333
Energy: 1.308486307104319
Energy: 1.2942465754746333
Energy: 1.308486307104319
Energy: 1.2942465754732553
Energy: 1.308486307104319
Energy: 1.3804393795563041
Energy: 1.3438502823559275
Energy: 1.3804393795563041
Energy: 1.3438502823559275
Energy: 1.3804393795563041
Energy: 1.3438502823559275
Energy: 1.4325627821689568
Energy: 1.310078006955605
Energy: 1.4325627821689568
Energy: 1.3100780069569202
Energy: 1.4325627821689568
Energy: 1.3100780069569202

minimum gb energy = 1.1844813344853518 eV
minimum distance =  2.26346767561929 Angstroms
sigma value = 11


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

Energy: 1.4375930578533846
Energy: 1.4551571315875336
Energy: 1.4375930578533846
Energy: 1.4551571315875336
Energy: 1.4375930578539902
Energy: 1.4551571315875336
Energy: 1.4098247822589864
Energy: 1.4130576670277968
Energy: 1.4098247822589864
Energy: 1.4130576670283743
Energy: 1.4098247822589864
Energy: 1.4130576670283743
Energy: 1.4514002062264262
Energy: 1.3640211066012546
Energy: 1.4514002062276095
Energy: 1.3640211066018602
Energy: 1.389823649830039
Energy: 1.3640211066018602
Energy: 1.4051843311052394
Energy: 1.3045083425533062
Energy: 1.4051843311046341
Energy: 1.3045083425527007
Energy: 1.4051843311052394
Energy: 1.3045083425527007
Energy: 1.3977091847154424
Energy: 1.3804749912603749
Energy: 1.3977091847160474
Energy: 1.3804749912603749
Energy: 1.3977091847154424
Energy: 1.3804749912603749
Energy: 1.344595173752893
Energy: 1.404216677554875
Energy: 1.344595173752893
Energy: 1.4042166775554803
Energy: 1.344595173752893
Energy: 1.404216677554875
Energy: 1.3918172587153865
Energy: 1.350564965557601
Energy: 1.3918172587153865
Energy: 1.350564965557601
Energy: 1.3918172587153865
Energy: 1.350564965557601
Energy: 1.4253991343787766
Energy: 1.3625305196554631
Energy: 1.425399134379382
Energy: 1.3625305196554631
Energy: 1.425399134379382
Energy: 1.3625305196554631
Energy: 1.379930797937785
Energy: 1.371390967205609
Energy: 1.3799307979383904
Energy: 1.371390967205004
Energy: 1.3799307979383904
Energy: 1.371390967205609
Energy: 1.373490045204776
Energy: 1.4005530462439046
Energy: 1.373490045204776
Energy: 1.4005530462439046
Energy: 1.373490045204776
Energy: 1.4005530462439046
Energy: 1.3359840270678447
Energy: 1.4517650804175821
Energy: 1.3359840270678447
Energy: 1.4517650804175821
Energy: 1.3359840270678447
Energy: 1.4517650804175821
Energy: 1.3823106256262119
Energy: 1.4280051745959645
Energy: 1.3823106256256064
Energy: 1.4280051745959645
Energy: 1.3823106256262119
Energy: 1.4280051745959645
Energy: 1.418749091611126
Energy: 1.357869719319934
Energy: 1.418749091611126
Energy: 1.3578697193205393
Energy: 1.4187490916105208
Energy: 1.3578697193205393
Energy: 1.34073910469297
Energy: 1.4141990491368897
Energy: 1.3407391046935755
Energy: 1.4141990491362841
Energy: 1.3407391046935755
Energy: 1.4141990491368897
Energy: 1.316024888608803
Energy: 1.3262971256842913
Energy: 1.316024888608803
Energy: 1.3262971256842913
Energy: 1.316024888608803
Energy: 1.3262971256842913
Energy: 1.3907067511142577
Energy: 1.3561755474798844
Energy: 1.390706751114863
Energy: 1.3561755474798844
Energy: 1.3907067511142577
Energy: 1.3561755474798844
Energy: 1.3421064476913722
Energy: 1.4297210609042796
Energy: 1.342106447692583
Energy: 1.429721060904885
Energy: 1.342106447693188
Energy: 1.4297210609042796
Energy: 1.4907476276265266
Energy: 1.4491641203929728
Energy: 1.4907476276265266
Energy: 1.4491641203935783
Energy: 1.4907476276265266
Energy: 1.4491641203935783
Energy: 1.3415303773237581
Energy: 1.3232515839296812
Energy: 1.3415303773237581
Energy: 1.3232515839296812
Energy: 1.3415303773237581
Energy: 1.3232515839296812
Energy: 1.343750296816626
Energy: 1.3866372006298449
Energy: 1.3437502968160207
Energy: 1.3866372006298449
Energy: 1.3437502968172312
Energy: 1.3866372006298449
Energy: 1.2708807459745657
Energy: 1.315116037376096
Energy: 1.2708807459745657
Energy: 1.315116037376096
Energy: 1.2708807459745657
Energy: 1.315116037376096
Energy: 1.443409788668598
Energy: 1.4698383595511455
Energy: 1.443409788668598
Energy: 1.4698383595511455
Energy: 1.443409788668598
Energy: 1.4698383595511455
Energy: 1.3942586751489252
Energy: 1.3648467239510096
Energy: 1.3942586751489252
Energy: 1.3648467239510096
Energy: 1.3942586751489252
Energy: 1.3648467239510096
Energy: 1.4099489933659823
Energy: 1.4131967778482768
Energy: 1.4099489933659823
Energy: 1.4131967778476713
Energy: 1.4099489933659823
Energy: 1.4131967778482768
Energy: 1.3710709206892249
Energy: 1.3550888399694268
Energy: 1.3710709206892249
Energy: 1.355088839968216
Energy: 1.3710709206892249
Energy: 1.355088839968216
Energy: 1.2727160168908038
Energy: 1.3997317865756587
Energy: 1.2727160168908038
Energy: 1.3997317865756587
Energy: 1.2727160168908038
Energy: 1.3997317865756587
Energy: 1.35317310108431
Energy: 1.4055306367689346
Energy: 1.35317310108431
Energy: 1.4055306367689346
Energy: 1.35317310108431
Energy: 1.4055306367689346
Energy: 1.4225795704910897
Energy: 1.3956861514166978
Energy: 1.4225795704910897
Energy: 1.3956861514154872
Energy: 1.4225795704910897
Energy: 1.3956861514154872
Energy: 1.343911459464563
Energy: 1.4115678347328318
Energy: 1.343911459464563
Energy: 1.4115678347328318
Energy: 1.343911459464563
Energy: 1.4115678347334373
Energy: 1.3108687482411197
Energy: 1.2468392522398184
Energy: 1.3108687482411197
Energy: 1.2468392522398184
Energy: 1.310868748241725
Energy: 1.2468392522398184
Energy: 1.373317349174792
Energy: 1.4353135103013595
Energy: 1.3733173491741868
Energy: 1.435313510301965
Energy: 1.373317349174792
Energy: 1.435313510301965

minimum gb energy = 1.2468392522398184 eV
minimum distance =  2.23320419154517 Angstroms
sigma value = 57


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

Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.3515488250786283
Energy: 1.30387668768655
Energy: 1.3515488250786283
Energy: 1.3038766876854728
Energy: 1.3515488250786283
Energy: 1.3038766876843955
Energy: 1.3968137524574262
Energy: 1.302177653419783
Energy: 1.3968137524574262
Energy: 1.302177653419783
Energy: 1.3968137524574262
Energy: 1.3021776534208602
Energy: 1.212462712692963
Energy: 1.2862488701288353
Energy: 1.212462712692963
Energy: 1.2862488701288353
Energy: 1.212462712692963
Energy: 1.286248870127758
Energy: 1.3968093761894596
Energy: 1.3021801977837613
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.351323508571884
Energy: 1.2093425403037472
Energy: 1.351323508571884
Energy: 1.2093425403037472
Energy: 1.351323508571884
Energy: 1.2093425403037472
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.3515488250786283
Energy: 1.303876687683318
Energy: 1.3515488250786283
Energy: 1.3038766876843955
Energy: 1.3515488250786283
Energy: 1.3038766876843955
Energy: 1.3968137524574262
Energy: 1.302177653419783
Energy: 1.3968137524574262
Energy: 1.3021776534208602
Energy: 1.3968137524574262
Energy: 1.302177653419783
Energy: 1.212462712692963
Energy: 1.286248870127758
Energy: 1.212462712692963
Energy: 1.2862488701288353
Energy: 1.2124627126918859
Energy: 1.286248870127758
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.351323508571884
Energy: 1.2093425403037472
Energy: 1.351323508571884
Energy: 1.2093425403037472
Energy: 1.351323508571884
Energy: 1.2093425403037472
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.2323868051983262
Energy: 1.127612720677805
Energy: 1.3515488250786283
Energy: 1.3038766876854728
Energy: 1.3515488250786283
Energy: 1.3038766876887042
Energy: 1.3515488250786283
Energy: 1.3038766876843955
Energy: 1.3968137524563489
Energy: 1.302177653419783
Energy: 1.3968137524574262
Energy: 1.3021776534208602
Energy: 1.3968137524574262
Energy: 1.302177653419783
Energy: 1.2124627126918859
Energy: 1.2862488701288353
Energy: 1.2124627126918859
Energy: 1.2862488701288353
Energy: 1.212462712692963
Energy: 1.2862488701288353
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.3968093761894596
Energy: 1.302180197782684
Energy: 1.3968093761894596
Energy: 1.302180197782684

minimum gb energy = 1.127612720677805 eV
minimum distance =  2.33743247265389 Angstroms
sigma value = 9


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

Energy: 1.348212642390976
Energy: 1.4159706569095978
Energy: 1.3482126423918557
Energy: 1.4159706569095978
Energy: 1.3482126423918557
Energy: 1.4159706569087183
Energy: 1.398141576327073
Energy: 1.3977943627358296
Energy: 1.398141576327073
Energy: 1.3977943627358296
Energy: 1.398141576327073
Energy: 1.3977943627358296
Energy: 1.48502357540297
Energy: 1.2940756155212936
Energy: 1.4850235754020902
Energy: 1.2940756155212936
Energy: 1.4850235754020902
Energy: 1.2940756155212936
Energy: 1.3568978377842151
Energy: 1.47837174726575
Energy: 1.3568978377842151
Energy: 1.47837174726575
Energy: 1.3568978377833356
Energy: 1.47837174726575
Energy: 1.3086680469891585
Energy: 1.3963165261125596
Energy: 1.3086680469891585
Energy: 1.396316526113439
Energy: 1.3086680469891585
Energy: 1.396316526113439
Energy: 1.528146372721304
Energy: 1.3517015675669968
Energy: 1.528146372721304
Energy: 1.3517015675678363
Energy: 1.5281463727221838
Energy: 1.3517015675669968
Energy: 1.2857482352502194
Energy: 1.3019193419134196
Energy: 1.2857482352502194
Energy: 1.3019193419125403
Energy: 1.2857482352502194
Energy: 1.3019193419125403
Energy: 1.539844483024873
Energy: 1.324015591662437
Energy: 1.539844483024873
Energy: 1.324015591662437
Energy: 1.539844483024873
Energy: 1.324015591662437
Energy: 1.6014651750299205
Energy: 1.3976354930556953
Energy: 1.6014651750299205
Energy: 1.3976354930548158
Energy: 1.6014651750299205
Energy: 1.3976354930548158
Energy: 1.3172592921021544
Energy: 1.3431666678489425
Energy: 1.3172592921021544
Energy: 1.3431666678489425
Energy: 1.3172592921021544
Energy: 1.3431666678489425
Energy: 1.2746156503154127
Energy: 1.2892087762755469
Energy: 1.2746156503154127
Energy: 1.2892087762755469
Energy: 1.2746156503154127
Energy: 1.2892087762755469
Energy: 1.3478460625829805
Energy: 1.333027343599313
Energy: 1.34784606258386
Energy: 1.333027343599313
Energy: 1.34784606258386
Energy: 1.3330273436001925
Energy: 1.3191828366004932
Energy: 1.5688719223394376
Energy: 1.319182836602252
Energy: 1.568871922338558
Energy: 1.319182836602252
Energy: 1.568871922338558
Energy: 1.3119742790652758
Energy: 1.3464682863194413
Energy: 1.3119742790652758
Energy: 1.3464682863194413
Energy: 1.3119742790652758
Energy: 1.3464682863194413
Energy: 1.3919638185518943
Energy: 1.3746853615800052
Energy: 1.3919638185518943
Energy: 1.374685361580885
Energy: 1.3919638185518943
Energy: 1.3746853615800052
Energy: 1.3447484399005574
Energy: 1.3691412101217633
Energy: 1.3447484399005574
Energy: 1.3691412101217633
Energy: 1.3447484399005574
Energy: 1.3691412101217633
Energy: 1.4172639656555193
Energy: 1.369000501096597
Energy: 1.4172639656555193
Energy: 1.369000501096597
Energy: 1.4172639656555193
Energy: 1.369000501096597
Energy: 1.4703328817341608
Energy: 1.3721368554081574
Energy: 1.4703328817341608
Energy: 1.3721368554081574
Energy: 1.4703328817341608
Energy: 1.3721368554072781
Energy: 1.2818325887217008
Energy: 1.3479033295676395
Energy: 1.2818325887217008
Energy: 1.3479033295676395
Energy: 1.2818325887217008
Energy: 1.3479033295676395
Energy: 1.4039526705732315
Energy: 1.334656527853603
Energy: 1.4039526705732315
Energy: 1.3346565278562414
Energy: 1.4039526705732315
Energy: 1.3346565278544824
Energy: 1.34863220458476
Energy: 1.3309512989797587
Energy: 1.34863220458476
Energy: 1.3309512989797587
Energy: 1.34863220458476
Energy: 1.3309512989806382

minimum gb energy = 1.2746156503154127 eV
minimum distance =  2.28015048570454 Angstroms
sigma value = 27


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

Energy: 1.3445338486731397
Energy: 1.3487008819445376
Energy: 1.3445338486731397
Energy: 1.3487008819445376
Energy: 1.3445338486731397
Energy: 1.3487008819445376
Energy: 1.3004096330821018
Energy: 1.304104168724377
Energy: 1.3004096330821018
Energy: 1.304104168724377
Energy: 1.3004096330828434
Energy: 1.304104168724377
Energy: 1.2440340370153813
Energy: 1.2609534941281133
Energy: 1.2440340370146399
Energy: 1.2609534941281133
Energy: 1.2440340370153813
Energy: 1.2609534941281133
Energy: 1.2668486014429186
Energy: 1.7150669952786266
Energy: 1.2668486014429186
Energy: 1.7150669952786266
Energy: 1.2668486014429186
Energy: 1.7150669952786266
Energy: 1.237824991985116
Energy: 1.2113717709737144
Energy: 1.237824991985116
Energy: 1.2113717709737144
Energy: 1.237824991984375
Energy: 1.2113717709744556
Energy: 1.2035362594895946
Energy: 1.2665980987061485
Energy: 1.2035362594895946
Energy: 1.2665980987061485
Energy: 1.2035362594895946
Energy: 1.2665980987061485
Energy: 1.3121670390557996
Energy: 1.2804950179737564
Energy: 1.3121670390557996
Energy: 1.2804950179737564
Energy: 1.3121670390557996
Energy: 1.2804950179737564
Energy: 1.304755958138958
Energy: 1.243876327840768
Energy: 1.304755958138958
Energy: 1.243876327840768
Energy: 1.304755958138958
Energy: 1.2438763278415093
Energy: 1.2680210497825133
Energy: 1.2665541938168188
Energy: 1.2680210497825133
Energy: 1.2665541938175604
Energy: 1.2680210497825133
Energy: 1.2665541938168188
Energy: 1.2673141652914124
Energy: 1.2620381002320336
Energy: 1.2673141652914124
Energy: 1.2620381002312924
Energy: 1.2673141652914124
Energy: 1.2620381002312924
Energy: 1.2669662919134226
Energy: 1.340349432996318
Energy: 1.2669662919126814
Energy: 1.340349432996318
Energy: 1.2669662919134226
Energy: 1.3403494329955763
Energy: 1.2779410936334923
Energy: 1.3120277809660217
Energy: 1.2779410936334923
Energy: 1.3120277809660217
Energy: 1.2779410936334923
Energy: 1.3120277809667633
Energy: 1.3080656747748367
Energy: 1.3038144061980417
Energy: 1.3080656747748367
Energy: 1.3038144061980417
Energy: 1.3080656747748367
Energy: 1.303814406198783
Energy: 1.266894253201177
Energy: 1.2682506759309058
Energy: 1.2668942532004357
Energy: 1.2682506759309058
Energy: 1.266894253201177
Energy: 1.2682506759309058
Energy: 1.2033206232289728
Energy: 1.2666408288075648
Energy: 1.203320623229714
Energy: 1.2666408288075648
Energy: 1.2033206232289728
Energy: 1.2666408288068234
Energy: 1.3029286550099242
Energy: 1.2111955814999964
Energy: 1.3029286550106656
Energy: 1.2111955814999964
Energy: 1.3029286550106656
Energy: 1.2111955814999964
Energy: 1.3102843145048668
Energy: 1.5048163610337737
Energy: 1.3102843145048668
Energy: 1.5048148577574325
Energy: 1.3102843145056082
Energy: 1.5048159771320864
Energy: 1.3016757081425463
Energy: 1.2753061037747204
Energy: 1.3016757081418049
Energy: 1.2753061037747204
Energy: 1.3016757081418049
Energy: 1.2753061037747204
Energy: 1.195190774329311
Energy: 1.2362722592502338
Energy: 1.195190774329311
Energy: 1.2362722592502338
Energy: 1.195190774329311
Energy: 1.2362722592502338
Energy: 1.3445338486731397
Energy: 1.3487008819445376
Energy: 1.3445338486738814
Energy: 1.3487008819445376
Energy: 1.3445338486731397
Energy: 1.3487008819445376
Energy: 1.3004096330835846
Energy: 1.304104168724377
Energy: 1.3004096330835846
Energy: 1.304104168724377
Energy: 1.3004096330835846
Energy: 1.304104168724377
Energy: 1.2440340370161225
Energy: 1.2609534941281133
Energy: 1.2440340370146399
Energy: 1.2609534941281133
Energy: 1.2440340370153813
Energy: 1.2609534941281133
Energy: 1.2668486014429186
Energy: 1.7150669952786266
Energy: 1.266848601442177
Energy: 1.7150669952786266
Energy: 1.2668486014429186
Energy: 1.7150669952786266
Energy: 1.237824991985116
Energy: 1.2113717709737144
Energy: 1.237824991984375
Energy: 1.2113717709737144
Energy: 1.237824991985116
Energy: 1.2113717709737144
Energy: 1.2035362594895946
Energy: 1.2665980987061485
Energy: 1.2035362594895946
Energy: 1.2665980987061485
Energy: 1.2035362594888532
Energy: 1.2665980987061485

minimum gb energy = 1.195190774329311 eV
minimum distance =  2.30951155589955 Angstroms
sigma value = 19


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

Energy: 1.3095386726668587
Energy: 1.4234502127649262
Energy: 1.3095386726668587
Energy: 1.4234502127649262
Energy: 1.3095386726668587
Energy: 1.4234502127649262
Energy: 1.4357955512793934
Energy: 1.3474463855142704
Energy: 1.4357955512787535
Energy: 1.3474463855142704
Energy: 1.4357955512781135
Energy: 1.3474463855142704
Energy: 1.3709533735540855
Energy: 1.2642991435314739
Energy: 1.3709533735547255
Energy: 1.264299143530834
Energy: 1.3709533735547255
Energy: 1.2642991435314739
Energy: 1.2550252568067077
Energy: 1.4225750954954406
Energy: 1.2550252568067077
Energy: 1.4225750954941607
Energy: 1.2550252568067077
Energy: 1.4225750954935208
Energy: 1.360678487560392
Energy: 1.3763964896616578
Energy: 1.360678487560392
Energy: 1.3763964896616578
Energy: 1.360678487559752
Energy: 1.3763964896616578
Energy: 1.3497080810603062
Energy: 1.2633741402326903
Energy: 1.3497080810603062
Energy: 1.2633741402333305
Energy: 1.3497080810603062
Energy: 1.2633741402333305
Energy: 1.2648350952883995
Energy: 1.5948355655938062
Energy: 1.2648350952877594
Energy: 1.5948355655893558
Energy: 1.2648350952877594
Energy: 1.5948355655752768
Energy: 1.2881726610370483
Energy: 1.5272203470352603
Energy: 1.2881726610376882
Energy: 1.5272203470352603
Energy: 1.2881726610376882
Energy: 1.5272203470352603
Energy: 1.3578107679324483
Energy: 1.2333510919677066
Energy: 1.3578107679324483
Energy: 1.2333510919670667
Energy: 1.3578107679324483
Energy: 1.2333510919677066
Energy: 1.381887120868331
Energy: 1.3700907970952063
Energy: 1.3818871208676908
Energy: 1.3700907970952063
Energy: 1.381887120868331
Energy: 1.3700907970952063
Energy: 1.244432778420957
Energy: 1.46155230654725
Energy: 1.2444327784203169
Energy: 1.46155230654725
Energy: 1.2444327784203169
Energy: 1.46155230654725
Energy: 1.4578496134724679
Energy: 1.2619229132406429
Energy: 1.4578496134763075
Energy: 1.2619229132406429
Energy: 1.4578496134737478
Energy: 1.2619229132412828
Energy: 1.5024210776687175
Energy: 1.2736863772040938
Energy: 1.5024210776693574
Energy: 1.2736863772040938
Energy: 1.5024210776693574
Energy: 1.2736863772034537
Energy: 1.2619085936723242
Energy: 1.3357473762226257
Energy: 1.2619085936723242
Energy: 1.3357473762226257
Energy: 1.2619085936716843
Energy: 1.3357473762226257
Energy: 1.3851043606390712
Energy: 1.2347243579210603
Energy: 1.385104360637791
Energy: 1.2347243579204201
Energy: 1.3851043606345914
Energy: 1.2347243579210603
Energy: 1.4802703898998038
Energy: 1.2334010242384719
Energy: 1.4802703898998038
Energy: 1.2334010242384719
Energy: 1.4802703898998038
Energy: 1.2334010242384719
Energy: 1.2715551818911133
Energy: 1.3397469173976
Energy: 1.2715551818911133
Energy: 1.33974691739824
Energy: 1.2715551818911133
Energy: 1.33974691739888
Energy: 1.3456792843060257
Energy: 1.5345505962514443
Energy: 1.3456792843060257
Energy: 1.5345505962514443
Energy: 1.3456792843060257
Energy: 1.5345505962514443
Energy: 1.394120368798267
Energy: 1.2619997841131376
Energy: 1.394120368798267
Energy: 1.2619997841131376
Energy: 1.394120368798267
Energy: 1.2619997841131376
Energy: 1.270301456217315
Energy: 1.45575394589523
Energy: 1.270301456217315
Energy: 1.45575394589523
Energy: 1.270301456217315
Energy: 1.45575394589523
Energy: 1.2690644701708922
Energy: 1.5025252021304278
Energy: 1.269064470171532
Energy: 1.502525202131068
Energy: 1.2690644701708922
Energy: 1.502525202131068
Energy: 1.4538209493469287
Energy: 1.263901478801605
Energy: 1.4538209493469287
Energy: 1.263901478801605
Energy: 1.4538209493462886
Energy: 1.263901478801605
Energy: 1.4236710018561247
Energy: 1.3402357218326568
Energy: 1.4236710018561247
Energy: 1.340235721831377
Energy: 1.4236710018561247
Energy: 1.3402357218326568
Energy: 1.2968095259284838
Energy: 1.460190112780496
Energy: 1.2968095259284838
Energy: 1.460190112779856
Energy: 1.2968095259284838
Energy: 1.460190112780496
Energy: 1.4354482805668831
Energy: 1.2640380192619856
Energy: 1.4354482805675233
Energy: 1.2640380192619856
Energy: 1.4354482805694428
Energy: 1.2640380192619856
Energy: 1.5050313855668505
Energy: 1.279636305482202
Energy: 1.5050313855674904
Energy: 1.279636305482202
Energy: 1.5050313855668505
Energy: 1.279636305482842
Energy: 1.2373026447164104
Energy: 1.3084804750842534
Energy: 1.2373026447164104
Energy: 1.3084804750836136
Energy: 1.2373026447170503
Energy: 1.3084804750842534
Energy: 1.3957926139435068
Energy: 1.2879758478269467
Energy: 1.3957926139435068
Energy: 1.2879758478269467
Energy: 1.3957926139441468
Energy: 1.2879758478269467
Energy: 1.3861700524474392
Energy: 1.2622246345411134
Energy: 1.386170052446159
Energy: 1.2622246345411134
Energy: 1.386170052446159
Energy: 1.2622246345411134

minimum gb energy = 1.2333510919670667 eV
minimum distance =  2.27275166633292 Angstroms
sigma value = 101


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

Energy: 1.2383399579658427
Energy: 1.3706728623296522
Energy: 1.2383399579658427
Energy: 1.3706728623296522
Energy: 1.2383399579658427
Energy: 1.3706728623296522
Energy: 1.6258682988777236
Energy: 1.2513534503920225
Energy: 1.6258682988777236
Energy: 1.2513534503920225
Energy: 1.6258682988777236
Energy: 1.2513534503920225
Energy: 1.3553606226275385
Energy: 1.217534949664017
Energy: 1.355360622626976
Energy: 1.2175349496651422
Energy: 1.3553606226275385
Energy: 1.2175349496651422
Energy: 1.1778186930734877
Energy: 1.6515230948577626
Energy: 1.1778186930734877
Energy: 1.4932698169206158
Energy: 1.177818693072925
Energy: 1.4932698169223033
Energy: 1.2001887722543716
Energy: 1.3266525447999382
Energy: 1.200188772254934
Energy: 1.3266525447999382
Energy: 1.2001887722543716
Energy: 1.3266525447993758
Energy: 1.3451986092161388
Energy: 1.197401688518225
Energy: 1.3451986092155763
Energy: 1.197401688518225
Energy: 1.3451986092161388
Energy: 1.1974016885187877
Energy: 1.2131765777224177
Energy: 1.609726526213206
Energy: 1.213176577721855
Energy: 1.6097265262137685
Energy: 1.2131765777224177
Energy: 1.6097265262137685
Energy: 1.1963982410732579
Energy: 1.6551875755046603
Energy: 1.1963982410732579
Energy: 1.4115051144614534
Energy: 1.1963982410732579
Energy: 1.4115051144608908
Energy: 1.3452608616843496
Energy: 1.1989291693839097
Energy: 1.3452608616843496
Energy: 1.198929169383347
Energy: 1.3452608616843496
Energy: 1.1989291693839097
Energy: 1.2661071032232543
Energy: 1.3697609587449469
Energy: 1.2661071032232543
Energy: 1.28270095887428
Energy: 1.2661071032232543
Energy: 1.28270095887428
Energy: 1.1766209342750777
Energy: 1.4160959288945039
Energy: 1.1766209342756402
Energy: 1.4160959288945039
Energy: 1.1766209342750777
Energy: 1.4160959288945039
Energy: 1.6158974326055253
Energy: 1.2505661955864993
Energy: 1.6158974326055253
Energy: 1.2131051729310134
Energy: 1.6158974326049629
Energy: 1.213105172930451
Energy: 1.3080574757037238
Energy: 1.217540205563524
Energy: 1.3080574757042864
Energy: 1.217540205563524
Energy: 1.3080574757037238
Energy: 1.217540205563524
Energy: 1.2383724381244818
Energy: 1.425605364712955
Energy: 1.2383724381244818
Energy: 1.425605364712955
Energy: 1.2383724381244818
Energy: 1.4256053647123925
Energy: 1.327370732440356
Energy: 1.2981090159205069
Energy: 1.327370732440356
Energy: 1.2981090159205069
Energy: 1.327370732440356
Energy: 1.2981090159205069
Energy: 1.4937977631244885
Energy: 1.2204118945124884
Energy: 1.4937977631244885
Energy: 1.2204118945124884
Energy: 1.4937977631244885
Energy: 1.2204118945124884
Energy: 1.1765762667340816
Energy: 1.6121922355072964
Energy: 1.1765762667340816
Energy: 1.612192235507859
Energy: 1.176576266733519
Energy: 1.6121922355072964
Energy: 1.1769302382351337
Energy: 1.4807031669867767
Energy: 1.1769302382351337
Energy: 1.4807031669856516
Energy: 1.1769302382345712
Energy: 1.480703166986214
Energy: 1.344876430077284
Energy: 1.1975010983292529
Energy: 1.344876430077284
Energy: 1.1975010983286904
Energy: 1.344876430077284
Energy: 1.1975010983292529
Energy: 1.2892940676811844
Energy: 1.4796772718657223
Energy: 1.2892940676817468
Energy: 1.4796772718657223
Energy: 1.2892940676811844
Energy: 1.4796772718657223
Energy: 1.1963379314756635
Energy: 1.4998399256076447
Energy: 1.196337931475101
Energy: 1.4998399256076447
Energy: 1.196337931475101
Energy: 1.4998399256076447
Energy: 1.5884378874210607
Energy: 1.1972878022290285
Energy: 1.588437887420498
Energy: 1.197287802228466
Energy: 1.588437887420498
Energy: 1.1972878022290285
Energy: 1.2980498345271259
Energy: 1.1974246354206284
Energy: 1.2980498345265634
Energy: 1.1974246354206284
Energy: 1.2980498345271259
Energy: 1.1974246354206284
Energy: 1.177419926006007
Energy: 1.3205725899040972
Energy: 1.177419926006007
Energy: 1.3205725899040972
Energy: 1.177419926006007
Energy: 1.3205725899046596
Energy: 1.6507011551645407
Energy: 1.227799378868648
Energy: 1.6507011551651034
Energy: 1.227799378868648
Energy: 1.6507011551651034
Energy: 1.227799378868648
Energy: 1.4549305738810012
Energy: 1.219859483353718
Energy: 1.4549305738810012
Energy: 1.219859483353718
Energy: 1.4549305738810012
Energy: 1.219859483353718
Energy: 1.2382514940734541
Energy: 1.5209200017640776
Energy: 1.2382514940734541
Energy: 1.5209200017635152
Energy: 1.2382514940728917
Energy: 1.5209200017652027
Energy: 1.3300916574387098
Energy: 1.3579170592377072
Energy: 1.330091657439272
Energy: 1.3579170592377072
Energy: 1.3300916574387098
Energy: 1.3579170592377072
Energy: 1.3204895496032931
Energy: 1.2173446171399758
Energy: 1.3204895496032931
Energy: 1.2173446171399758
Energy: 1.3204895496027302
Energy: 1.2173446171399758
Energy: 1.1777457434996752
Energy: 1.5907387820169443
Energy: 1.1777457434991128
Energy: 1.5907387820163819
Energy: 1.1777457434991128
Energy: 1.5907387820169443
Energy: 1.1765638734048922
Energy: 1.2500520973931275
Energy: 1.1765638734054547
Energy: 1.2500520973931275
Energy: 1.1765638734054547
Energy: 1.2500520973931275
Energy: 1.4106893584136824
Energy: 1.1971604393496593
Energy: 1.4106893584125573
Energy: 1.1971604393496593
Energy: 1.410689358409182
Energy: 1.1971604393496593
Energy: 1.5625859417777124
Energy: 1.1973774628274432
Energy: 1.5625859416849435
Energy: 1.1973774628280056
Energy: 1.5625859417720869
Energy: 1.1973774628274432

minimum gb energy = 1.1765638734048922 eV
minimum distance =  2.29326063685384 Angstroms
sigma value = 33


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

Energy: 0.020521932734295062
Energy: 1.129264266700703
Energy: 0.020521932734295062
Energy: 1.129264266700703
Energy: 0.020521932734295062
Energy: 1.129264266700703
Energy: 0.021257524455360492
Energy: 1.8142222641899117
Energy: 0.021257524455827896
Energy: 1.8142222641912622
Energy: 0.021257524455360492
Energy: 1.8142222641903272
Energy: 1.1302307374850733
Energy: 0.4612406222740975
Energy: 1.1302307375129093
Energy: 0.46124062227316276
Energy: 1.1302307375412133
Energy: 0.46124062227363016
Energy: 0.021257524455360492
Energy: 1.8142222641907946
Energy: 0.021257524455360492
Energy: 1.8142222641912622
Energy: 0.021257524455360492
Energy: 1.8142222641917294

minimum gb energy = 0.020521932734295062 eV
minimum distance =  2.44519001787552 Angstroms
sigma value = 1