Model name: model_name=EAM_Dynamo_AcklandBaconCalder_1997_Fe__MO_142799717516_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8664999604225163
cohesive_energy=4.316339488656242
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013266278487370142
Energy: 0.013676488436972974
Energy: 0.5342178317118099
Energy: 0.013676488436474205
Energy: 0.013266278487370142
Energy: 0.013676488435975435
Energy: 0.013676488436972974
Energy: 2.7959565858830984
Energy: 0.013676488435975435
Energy: 2.7959565858835975
Energy: 0.013676488436474205
Energy: 2.7959565858835975
Energy: 0.5342178317118099
Energy: 0.013676488435975435
Energy: 0.013266278487370142
Energy: 0.013676488436474205
Energy: 0.5342178317113112
Energy: 0.013676488436972974
Energy: 0.013676488436972974
Energy: 2.7959565858840683
Energy: 0.013676488436474205
Energy: 2.7959565858826276
Energy: 0.013676488436474205
Energy: 2.7959565858835975
Energy: 0.013266278487370142
Energy: 0.013676488435975435
Energy: 0.5342178317118099
Energy: 0.013676488435975435
Energy: 0.013266278487841204
Energy: 0.013676488436972974
Energy: 0.013676488436474205
Energy: 2.7959565858835975
Energy: 0.013676488436474205
Energy: 2.7959565858835975
Energy: 0.013676488436474205
Energy: 2.7959565858835975

minimum gb energy = 0.013266278487370142 eV
minimum distance =  2.46142589097014 Angstroms
sigma value = 1


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

Energy: 1.5069638541605819
Energy: 1.6153568330795016
Energy: 1.4461582402640447
Energy: 1.6153568330795016
Energy: 1.5069638541605819
Energy: 1.6153568330795016
Energy: 1.4780030848784897
Energy: 1.5797623916003907
Energy: 1.4769555861719772
Energy: 1.5797623916015915
Energy: 1.4780030848784897
Energy: 1.5797623916015915
Energy: 1.3721301414641354
Energy: 1.5798709495682748
Energy: 1.5131509740597486
Energy: 1.579870949567074
Energy: 1.3721301414641354
Energy: 1.579870949567074
Energy: 1.631153002728493
Energy: 1.5622616171416583
Energy: 1.355497218148406
Energy: 1.5622616171416583
Energy: 1.631153002728493
Energy: 1.5622616171416583
Energy: 1.5563376588918543
Energy: 1.616515422903117
Energy: 1.5069498973744344
Energy: 1.616515422903117
Energy: 1.5563376588918543
Energy: 1.616515422903117
Energy: 1.5142635964350788
Energy: 1.5799031931077285
Energy: 1.379388381739972
Energy: 1.5799031931077285
Energy: 1.514263596433878
Energy: 1.5799031931077285
Energy: 1.5132522677525555
Energy: 1.5792864223257252
Energy: 1.3722933446673802
Energy: 1.5792864223245244
Energy: 1.5132522677525555
Energy: 1.5792864223245244
Energy: 1.5860721469777885
Energy: 1.6159516907620812
Energy: 1.3558863616001873
Energy: 1.6159516907620812
Energy: 1.5860721469777885
Energy: 1.6159516907620812
Energy: 1.6297963588788054
Energy: 1.5664379829217174
Energy: 1.3548550115389133
Energy: 1.566437982920517
Energy: 1.6297963588788054
Energy: 1.566437982920517
Energy: 1.5156901843811574
Energy: 1.5791982329147891
Energy: 1.3800798429106398
Energy: 1.5791982329147891
Energy: 1.5156901843811574
Energy: 1.5791982329135883
Energy: 1.4436717234077343
Energy: 1.5689377782760106
Energy: 1.4769090008284333
Energy: 1.5689377782760106
Energy: 1.4436717234089351
Energy: 1.5689377782760106
Energy: 1.3569388824895288
Energy: 1.6160197741775104
Energy: 1.357002450735979
Energy: 1.6160197741775104
Energy: 1.3569388824895288
Energy: 1.6160197741775104
Energy: 1.477029380806662
Energy: 1.568937778277211
Energy: 1.4687862017492959
Energy: 1.568937778277211
Energy: 1.4770293808054613
Energy: 1.568937778277211
Energy: 1.3802918705182703
Energy: 1.5785044998530369
Energy: 1.515742111143346
Energy: 1.5785044998530369
Energy: 1.3802918705170697
Energy: 1.5785044998530369
Energy: 1.3546939052173714
Energy: 1.5663996117745893
Energy: 1.6298950174178939
Energy: 1.566399611773389
Energy: 1.354693905216171
Energy: 1.5663996117745893
Energy: 1.3559789088392957
Energy: 1.6159678411582312
Energy: 1.586017086984915
Energy: 1.6159678411570308
Energy: 1.3559789088404965
Energy: 1.6159678411570308
Energy: 1.3723252964933532
Energy: 1.5792438795551815
Energy: 1.513148527827745
Energy: 1.5792438795563826
Energy: 1.3723252964957542
Energy: 1.5792438795563826
Energy: 1.3794113850077805
Energy: 1.5798839628226764
Energy: 1.513887329304036
Energy: 1.5798839628226764
Energy: 1.379411385008981
Energy: 1.5798839628226764
Energy: 1.4453079256928938
Energy: 1.6161910780928614
Energy: 1.556316869781061
Energy: 1.6161910780928614
Energy: 1.4453079256928938
Energy: 1.6161910780928614
Energy: 1.3555155377986423
Energy: 1.5618062645161324
Energy: 1.6310929615434553
Energy: 1.5618062645161324
Energy: 1.3555155377974417
Energy: 1.5618062645161324
Energy: 1.5131539613035372
Energy: 1.5798531524331072
Energy: 1.3721210941033075
Energy: 1.5798531524331072
Energy: 1.5131539613035372
Energy: 1.5798531524331072
Energy: 1.4772051902472276
Energy: 1.5799859237467226
Energy: 1.4779959808207475
Energy: 1.5799859237467226
Energy: 1.4772051902472276
Energy: 1.5799859237467226
Energy: 1.4992571928028091
Energy: 1.6153568330795016
Energy: 1.5069638541605819
Energy: 1.6153568330807022
Energy: 1.4992569806393892
Energy: 1.6153568330807022

minimum gb energy = 1.354693905216171 eV
minimum distance =  2.28322662868083 Angstroms
sigma value = 33


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

Energy: 2.0988324822581284
Energy: 1.7121048660048048
Energy: 1.4686394251185015
Energy: 1.7121048660041218
Energy: 2.0988324822581284
Energy: 1.7121048660041218
Energy: 1.579269285005631
Energy: 1.6763727907123005
Energy: 1.640235336576679
Energy: 1.6763727907116175
Energy: 1.579269285005631
Energy: 1.6763727907116175
Energy: 1.4386142178116477
Energy: 1.7099227355334092
Energy: 1.6038650489896105
Energy: 1.7099227355334092
Energy: 1.4386142178116477
Energy: 1.7099227355327262
Energy: 1.5377750335355502
Energy: 1.663894286185511
Energy: 1.6239079897281237
Energy: 1.6638942861848278
Energy: 1.5377750335355502
Energy: 1.6638942861848278
Energy: 1.5384771762589888
Energy: 1.6824303642010783
Energy: 1.6629848511316678
Energy: 1.6824303642017613
Energy: 1.5384771762589888
Energy: 1.6824303642024443
Energy: 1.5190575305248994
Energy: 1.687101998403782
Energy: 1.4556657203456405
Energy: 1.687101998403782
Energy: 1.5190575305242164
Energy: 1.6871019984044648
Energy: 1.5187961520753392
Energy: 1.681584614038289
Energy: 1.5635433896416424
Energy: 1.681584614037606
Energy: 1.5187961520753392
Energy: 1.681584614037606
Energy: 1.4745904995544956
Energy: 1.6864186031425576
Energy: 1.6535628590760352
Energy: 1.6864186031425576
Energy: 1.4745904995538128
Energy: 1.6864186031425576
Energy: 1.502001846500795
Energy: 1.6456485725193561
Energy: 1.615173895164531
Energy: 1.6456485725214047
Energy: 1.502001846500795
Energy: 1.6456485725214047
Energy: 1.5246062536179923
Energy: 1.7101000751407684
Energy: 1.5382451269944946
Energy: 1.7101000751400854
Energy: 1.5246062536173097
Energy: 1.7101000751400854
Energy: 1.4919220416830132
Energy: 1.7671165830013118
Energy: 1.708408697720074
Energy: 1.7671165830040436
Energy: 1.4919220416830132
Energy: 1.7671165830040436
Energy: 1.7361488922321366
Energy: 1.692862856428208
Energy: 1.5650210030732559
Energy: 1.6928628564323054
Energy: 1.7361488922321366
Energy: 1.6928628564323054
Energy: 1.6686350434778794
Energy: 1.6557685937403641
Energy: 1.5037500047354777
Energy: 1.655768593739681
Energy: 1.6686350434778794
Energy: 1.655768593739681
Energy: 1.5490176346373827
Energy: 1.7099826196918928
Energy: 1.7456348910937995
Energy: 1.7099826196918928
Energy: 1.5490176346373827
Energy: 1.7099826196925758
Energy: 1.604381714930792
Energy: 1.6926451545245316
Energy: 1.6335542781534944
Energy: 1.6926451545245316
Energy: 1.604381714929426
Energy: 1.6926451545245316
Energy: 1.604391203799792
Energy: 1.6928399240365646
Energy: 1.531758580765487
Energy: 1.6928399240365646
Energy: 1.604391203799792
Energy: 1.6928399240358816
Energy: 1.62319376935976
Energy: 1.683228010186464
Energy: 1.5380940102427323
Energy: 1.6832280101871469
Energy: 1.62319376935976
Energy: 1.6832280101871469
Energy: 1.6231386751832213
Energy: 1.6732428800507153
Energy: 1.6684846376338143
Energy: 1.673242880052081
Energy: 1.6231386751825387
Energy: 1.673242880052081
Energy: 1.4559647360391508
Energy: 1.686647964002445
Energy: 1.6537125413630398
Energy: 1.686647964003128
Energy: 1.4559647360398336
Energy: 1.686647964003128
Energy: 1.4791441655138888
Energy: 1.6482617836356401
Energy: 1.6149700852790516
Energy: 1.648261783637006
Energy: 1.4791441655138888
Energy: 1.648261783637689
Energy: 1.7251871966816512
Energy: 1.735377717638862
Energy: 1.4842799280258185
Energy: 1.7353777176374965
Energy: 1.7251871966823342
Energy: 1.7353777176374965
Energy: 1.500150931373947
Energy: 1.6729104606938188
Energy: 1.7232658367802927
Energy: 1.67291046069177
Energy: 1.500150931373947
Energy: 1.6729104606910872
Energy: 1.5377202672149437
Energy: 1.6826091671257797
Energy: 1.5752401854069866
Energy: 1.682609167125097
Energy: 1.5377202672149437
Energy: 1.682609167125097
Energy: 1.7130035014163165
Energy: 1.6757655824753959
Energy: 1.5273221099537542
Energy: 1.6757655824753959
Energy: 1.7130035014163165
Energy: 1.6757655824753959
Energy: 1.5652627734906885
Energy: 1.696546878691275
Energy: 1.604623034589208
Energy: 1.6965468786899092
Energy: 1.5652627734906885
Energy: 1.6965468786905922
Energy: 1.6259462036961652
Energy: 1.7166736086747805
Energy: 1.4907171446014964
Energy: 1.7166736086747805
Energy: 1.6259462036982137
Energy: 1.7166736086747805
Energy: 1.5233930455922589
Energy: 1.7068523311896675
Energy: 1.461705179803405
Energy: 1.7068523311910333
Energy: 1.5233930455915758
Energy: 1.7068523311910333
Energy: 1.5654350408581037
Energy: 1.69688625038414
Energy: 1.7362756980974567
Energy: 1.6968862503834574
Energy: 1.5654350408574205
Energy: 1.6968862503834574
Energy: 1.7545549597826084
Energy: 1.6754866037962513
Energy: 1.5273736863899292
Energy: 1.6754866037962513
Energy: 1.7545549597826084
Energy: 1.675486603796934
Energy: 1.5377195674743818
Energy: 1.6827387625970376
Energy: 1.6113840889693862
Energy: 1.6827387625963548
Energy: 1.5377195674743818
Energy: 1.6827387625963548
Energy: 1.4921751518778315
Energy: 1.6729104606938188
Energy: 1.7028302041336656
Energy: 1.6729104606924527
Energy: 1.4921751518778315
Energy: 1.6729104606924527
Energy: 1.7251040192735083
Energy: 1.735389456166418
Energy: 1.4572086568359013
Energy: 1.735389456167784
Energy: 1.7251040192735083
Energy: 1.735389456167784
Energy: 1.479585471776111
Energy: 1.6464159343852538
Energy: 1.6300302711200998
Energy: 1.646415934384571
Energy: 1.479585471776111
Energy: 1.646415934384571
Energy: 1.4559516265355852
Energy: 1.68151354306008
Energy: 1.519495153859716
Energy: 1.68151354306008
Energy: 1.4559516265369508
Energy: 1.68151354306008
Energy: 1.6228129787392591
Energy: 1.6731427066826245
Energy: 1.7262247331436182
Energy: 1.6731427066833073
Energy: 1.6228129787385759
Energy: 1.6731427066833073
Energy: 1.622865846903668
Energy: 1.6829244695478662
Energy: 1.5378879154372793
Energy: 1.6829244695478662
Energy: 1.6228658469043507
Energy: 1.6829244695478662
Energy: 1.6046559641822689
Energy: 1.6923505868444093
Energy: 1.4882416198621162
Energy: 1.692350586843726
Energy: 1.6046559641829514
Energy: 1.692350586843726
Energy: 1.6039243465816
Energy: 1.6942160383194431
Energy: 1.6990776318589083
Energy: 1.69421603831876
Energy: 1.6039243465809172
Energy: 1.69421603831876
Energy: 1.5541359316914376
Energy: 1.7098480994673524
Energy: 1.745233299709473
Energy: 1.7098480994666696
Energy: 1.5541359316914376
Energy: 1.7098480994659868
Energy: 1.6333939918982363
Energy: 1.655723285937897
Energy: 1.5040339466443082
Energy: 1.655723285937897
Energy: 1.6333939918989193
Energy: 1.65572328593858
Energy: 1.7361936253827683
Energy: 1.6928169966947275
Energy: 1.4878871451060767
Energy: 1.6928169966960933
Energy: 1.7361936253827683
Energy: 1.6928169966967763

minimum gb energy = 1.4386142178116477 eV
minimum distance =  2.27265273162572 Angstroms
sigma value = 51


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

Energy: 1.7516765353907446
Energy: 1.7558141599457258
Energy: 1.616380743979139
Energy: 1.7558141599457258
Energy: 1.7516765353907446
Energy: 1.7558141599457258
Energy: 1.451523693496072
Energy: 1.788122119189962
Energy: 1.8481039510680284
Energy: 1.7881221191946728
Energy: 1.4515236934976543
Energy: 1.7881221191883796
Energy: 1.4506311835756138
Energy: 1.7559083906181516
Energy: 1.738080861052305
Energy: 1.7559083906165693
Energy: 1.4506311835756138
Energy: 1.7559083906165693
Energy: 1.4669432790085817
Energy: 1.6971477330096405
Energy: 1.8471914930137918
Energy: 1.697147733008058
Energy: 1.4669432790085817
Energy: 1.697147733008058
Energy: 1.4507420675466207
Energy: 1.6980159262892183
Energy: 1.846790361980542
Energy: 1.6980159262892183
Energy: 1.4507420675466207
Energy: 1.6980159262892183
Energy: 1.7517779595240448
Energy: 1.6967204117833155
Energy: 1.9062251798996008
Energy: 1.6967204117848975
Energy: 1.7517779595240448
Energy: 1.6967204117848975
Energy: 1.7518484720541945
Energy: 1.6975542373782406
Energy: 1.9391539320214515
Energy: 1.6975542373782406
Energy: 1.7518484720541945
Energy: 1.6975542373782406
Energy: 1.4677466935514198
Energy: 1.696833215608223
Energy: 1.4198711261576145
Energy: 1.696833215608223
Energy: 1.4677466935498376
Energy: 1.6968332156098054
Energy: 1.8417194074097314
Energy: 1.70920127158125
Energy: 1.4552717257360894
Energy: 1.7092012715828322
Energy: 1.841719407408149
Energy: 1.7092012715828322
Energy: 1.4502386719344238
Energy: 1.7561771819674223
Energy: 1.420044773494742
Energy: 1.7561771819642578
Energy: 1.4502386719344238
Energy: 1.7561771819642578
Energy: 1.8416162495183375
Energy: 1.6978434084262541
Energy: 1.9386175201927962
Energy: 1.6978434084262541
Energy: 1.8416162495183375
Energy: 1.6978434084278362
Energy: 1.751573234187917
Energy: 1.756214734224048
Energy: 1.9060828615835457
Energy: 1.756214734224048
Energy: 1.751573234187917
Energy: 1.756214734224048
Energy: 1.6363707562168515
Energy: 1.6977864243645149
Energy: 1.8468459849565928
Energy: 1.697786424366097
Energy: 1.6363707562183976
Energy: 1.6977864243645149
Energy: 1.4500795648766214
Energy: 1.7560348755620987
Energy: 1.8465332437956112
Energy: 1.7560348755605164
Energy: 1.4500795648782037
Energy: 1.7560348755605164
Energy: 1.450317809420587
Energy: 1.7569050164472362
Energy: 1.8466948360849607
Energy: 1.7569050164440716
Energy: 1.450317809420587
Energy: 1.7569050164440716
Energy: 1.4506357487702595
Energy: 1.709959358140305
Energy: 1.8464325248355675
Energy: 1.709959358140305
Energy: 1.450635748771842
Energy: 1.709959358140305
Energy: 1.7517317022180408
Energy: 1.756240324909467
Energy: 1.90396560366687
Energy: 1.756240324909467
Energy: 1.7517317022180408
Energy: 1.756240324909467
Energy: 1.7540241797368359
Energy: 1.6995518456423104
Energy: 1.9954737967107685
Energy: 1.6995518456423104
Energy: 1.7540241797415828
Energy: 1.6995518456423104

minimum gb energy = 1.4198711261576145 eV
minimum distance =  2.25107254375139 Angstroms
sigma value = 19


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

Energy: 1.8910768861404335
Energy: 1.8819290803734925
Energy: 1.5859679035484655
Energy: 1.8819290803734925
Energy: 1.891076886139495
Energy: 1.8819290803734925
Energy: 1.5476277727886294
Energy: 1.8461101061708436
Energy: 1.6921027455755797
Energy: 1.8461101061708436
Energy: 1.5476277727886294
Energy: 1.8461101061708436
Energy: 1.495254001796373
Energy: 1.8514227133327397
Energy: 1.6821010819026812
Energy: 1.851422713331801
Energy: 1.495254001796373
Energy: 1.8514227133327397
Energy: 1.533461266356919
Energy: 1.8007264540461072
Energy: 1.8564892385922336
Energy: 1.800726454047046
Energy: 1.533461266356919
Energy: 1.800726454047046
Energy: 1.534425113650487
Energy: 1.8818203756962286
Energy: 1.936287346676483
Energy: 1.8818203756962286
Energy: 1.534425113650487
Energy: 1.8818203756962286
Energy: 1.9362571364011956
Energy: 1.881811320751777
Energy: 1.5343973402130084
Energy: 1.881811320751777
Energy: 1.9362571364011956
Energy: 1.8818113207527156
Energy: 1.8564950357365129
Energy: 1.80073724105505
Energy: 1.5334635804059544
Energy: 1.80073724105505
Energy: 1.8564950357365129
Energy: 1.80073724105505
Energy: 1.6820160049935156
Energy: 1.8513673376975404
Energy: 1.4952372255167463
Energy: 1.8513673376975404
Energy: 1.6820160049935156
Energy: 1.8513673376975404
Energy: 1.6920834123345816
Energy: 1.8460809310051247
Energy: 1.5744891793151479
Energy: 1.8460809310051247
Energy: 1.6920834123355202
Energy: 1.8460809310051247
Energy: 1.6340076082942308
Energy: 1.8819290803734925
Energy: 1.891076886139495
Energy: 1.8819290803734925
Energy: 1.6340076082932922
Energy: 1.8819290803734925
Energy: 1.6921027455755797
Energy: 1.8461101061708436
Energy: 1.5135677856762422
Energy: 1.8461101061699052
Energy: 1.6921027455755797
Energy: 1.8461101061699052
Energy: 1.6821010819026812
Energy: 1.8514227133327397
Energy: 1.495254001796373
Energy: 1.8514227133327397
Energy: 1.6821010819017426
Energy: 1.8514227133327397
Energy: 1.8564892385922336
Energy: 1.800726454047046
Energy: 1.533461266356919
Energy: 1.800726454047046
Energy: 1.8564892385922336
Energy: 1.800726454047046
Energy: 1.936287346676483
Energy: 1.8818203756962286
Energy: 1.5344251136514255
Energy: 1.8818203756962286
Energy: 1.936287346676483
Energy: 1.8818203756962286
Energy: 1.5343973402130084
Energy: 1.881811320751777
Energy: 1.7846811527388529
Energy: 1.881811320751777
Energy: 1.5343973402130084
Energy: 1.881811320751777
Energy: 1.608546409204859
Energy: 1.80073724105505
Energy: 1.8564950357355745
Energy: 1.80073724105505
Energy: 1.608546409204859
Energy: 1.80073724105505
Energy: 1.4952372255167463
Energy: 1.8513673376975404
Energy: 1.6820160049935156
Energy: 1.8513673376975404
Energy: 1.4952372255167463
Energy: 1.8513673376975404
Energy: 1.5744891793151479
Energy: 1.8460809310051247
Energy: 1.6920834123345816
Energy: 1.8460809310051247
Energy: 1.5744891793151479
Energy: 1.8460809310051247
Energy: 1.8910768861404335
Energy: 1.8819290803734925
Energy: 1.6340076082923536
Energy: 1.8819290803734925
Energy: 1.891076886139495
Energy: 1.8819290803734925
Energy: 1.5135677856771808
Energy: 1.8461101061708436
Energy: 1.6921027455755797
Energy: 1.8461101061708436
Energy: 1.5135677856771808
Energy: 1.8461101061708436
Energy: 1.495254001796373
Energy: 1.8514227133327397
Energy: 1.6821010819017426
Energy: 1.8514227133327397
Energy: 1.495254001796373
Energy: 1.8514227133327397
Energy: 1.533461266356919
Energy: 1.800726454047046
Energy: 1.8564892385922336
Energy: 1.800726454047046
Energy: 1.533461266356919
Energy: 1.8007264540461072
Energy: 1.534425113650487
Energy: 1.8818203756962286
Energy: 1.936287346676483
Energy: 1.8818203756962286
Energy: 1.5344251136514255
Energy: 1.8818203756962286
Energy: 1.7846811527388529
Energy: 1.881811320751777
Energy: 1.5343973402130084
Energy: 1.881811320751777
Energy: 1.7846811527388529
Energy: 1.881811320751777
Energy: 1.8564950357365129
Energy: 1.80073724105505
Energy: 1.608546409204859
Energy: 1.80073724105505
Energy: 1.8564950357365129
Energy: 1.80073724105505
Energy: 1.6820160049935156
Energy: 1.8513673376975404
Energy: 1.4952372255167463
Energy: 1.8513673376975404
Energy: 1.6820160049935156
Energy: 1.8513673376975404
Energy: 1.6920834123345816
Energy: 1.8460809310051247
Energy: 1.5744891793151479
Energy: 1.8460809310051247
Energy: 1.6920834123345816
Energy: 1.8460809310051247
Energy: 1.6340076082932922
Energy: 1.8819290803734925
Energy: 1.891076886139495
Energy: 1.8819290803734925
Energy: 1.6340076082923536
Energy: 1.8819290803734925
Energy: 1.6921027455755797
Energy: 1.8461101061708436
Energy: 1.5135677856762422
Energy: 1.8461101061708436
Energy: 1.6921027455755797
Energy: 1.8461101061708436
Energy: 1.6821010819017426
Energy: 1.8514227133327397
Energy: 1.495254001796373
Energy: 1.8514227133327397
Energy: 1.6821010819017426
Energy: 1.851422713331801

minimum gb energy = 1.4952372255167463 eV
minimum distance =  2.23626893461637 Angstroms
sigma value = 27


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

Energy: 1.4140869856479605
Energy: 1.764361115362571
Energy: 1.7611284679522445
Energy: 1.764361115362571
Energy: 1.4140869856475164
Energy: 1.7643611153623358
Energy: 1.4163778546213952
Energy: 1.6452172717280258
Energy: 1.4826962445210086
Energy: 1.6452172717275555
Energy: 1.4163778546213952
Energy: 1.6452172717277906
Energy: 1.4561531017749942
Energy: 1.7060790992515058
Energy: 1.4558631287910087
Energy: 1.7060790992827513
Energy: 1.4561531017749942
Energy: 1.7060790992420747
Energy: 1.4108279001261248
Energy: 1.7607587765591333
Energy: 1.4549994491806375
Energy: 1.7607587765591333
Energy: 1.4108279001261248
Energy: 1.7607587765591333
Energy: 1.4853033951105798
Energy: 1.7639750354435724
Energy: 1.4557475213670699
Energy: 1.7639750354433372
Energy: 1.485303395110815
Energy: 1.7639750354433372
Energy: 1.4550390975081773
Energy: 1.7162102462292548
Energy: 1.4829611536870462
Energy: 1.7162102462294895
Energy: 1.4550390975086214
Energy: 1.7162102462292548
Energy: 1.456389765341933
Energy: 1.4555855024551079
Energy: 1.4553909129056806
Energy: 1.4555855024548987
Energy: 1.456389765341933
Energy: 1.4555855024539581
Energy: 1.411051857957617
Energy: 1.7594218793203915
Energy: 1.4852035984725558
Energy: 1.7594218793199212
Energy: 1.411051857957617
Energy: 1.7594218793196863
Energy: 1.4552043464617417
Energy: 1.646475229110971
Energy: 1.4824654567619984
Energy: 1.646475229097412
Energy: 1.4552043464617417
Energy: 1.646475229125679
Energy: 1.4550458354235765
Energy: 1.9337377785463519
Energy: 1.4550541705623883
Energy: 1.9337377785449932
Energy: 1.4550458354233413
Energy: 1.933737778546143
Energy: 1.4711439175483971
Energy: 1.6462018894102788
Energy: 1.4552053178221724
Energy: 1.6462018894109844
Energy: 1.4711439175488674
Energy: 1.6462018894100439
Energy: 1.4852133023053602
Energy: 1.7595138428557513
Energy: 1.411044477228405
Energy: 1.7595138428559864
Energy: 1.4852133023055953
Energy: 1.7595138428557513

minimum gb energy = 1.4108279001261248 eV
minimum distance =  2.25938516692738 Angstroms
sigma value = 9


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

Energy: 1.889139011088566
Energy: 1.9419216257515486
Energy: 1.5521810527191213
Energy: 1.9419216257521945
Energy: 1.889139011088566
Energy: 1.9419216257521945
Energy: 1.690922335231981
Energy: 1.8857741909270267
Energy: 1.5714609098821186
Energy: 1.9068256656118217
Energy: 1.6909223352313352
Energy: 1.8857741909276726
Energy: 1.552208197043966
Energy: 1.9741990150839337
Energy: 1.5713771185102838
Energy: 1.9741990150826418
Energy: 1.5522081970433201
Energy: 1.9741990150826418
Energy: 1.5297665390677158
Energy: 1.9621054111434642
Energy: 1.4843967655109178
Energy: 1.9621054111428182
Energy: 1.5297665390677158
Energy: 1.9621054111434642
Energy: 1.5275687188100684
Energy: 1.9614278393771631
Energy: 1.5011668763395534
Energy: 1.9614278393771631
Energy: 1.5275687188107145
Energy: 1.9614278393771631
Energy: 1.500850737590949
Energy: 1.9184794893995059
Energy: 1.5525914634547102
Energy: 1.8503959405736954
Energy: 1.5008507375915947
Energy: 1.9184794893995059
Energy: 1.789871942782065
Energy: 1.9237626914740233
Energy: 1.5535029433525067
Energy: 1.9237626914740233
Energy: 1.789871942782711
Energy: 1.9237626914740233
Energy: 1.7129982334775393
Energy: 1.920191409656723
Energy: 1.6041060534807974
Energy: 1.920191409657369
Energy: 1.7129982334781855
Energy: 1.920191409657369
Energy: 1.6960659741421724
Energy: 1.8258009900578165
Energy: 1.5723816950222935
Energy: 1.8258009900578165
Energy: 1.6960659741415263
Energy: 1.8258009900578165
Energy: 1.7021274981831827
Energy: 1.9316393850282543
Energy: 1.5265592107652264
Energy: 1.9316393850282543
Energy: 1.7021274981831827
Energy: 1.9316393850282543
Energy: 1.6933216701180422
Energy: 1.9140474194111199
Energy: 1.5723228918558312
Energy: 1.9140474194111199
Energy: 1.6933216701180422
Energy: 1.914047419410474
Energy: 1.5732501124471387
Energy: 1.9292957536111375
Energy: 1.5523708300805108
Energy: 1.9292957536111375
Energy: 1.5732501124471387
Energy: 1.9292957536111375
Energy: 1.4985960822398594
Energy: 1.8166967522946755
Energy: 1.483590805374555
Energy: 1.8166967522953215
Energy: 1.4985960822398594
Energy: 1.8166967522953215
Energy: 1.7679759185538277
Energy: 1.9596057581606567
Energy: 1.4833555195614532
Energy: 1.959605758160011
Energy: 1.7679759185525359
Energy: 1.959605758160011
Energy: 1.5709747785776549
Energy: 1.961867991475316
Energy: 1.6082938835370937
Energy: 1.961867991475962
Energy: 1.5709747785776549
Energy: 1.961867991476608
Energy: 1.6375998766822466
Energy: 1.9183464849384257
Energy: 1.5522838632421754
Energy: 1.9183464849384257
Energy: 1.6375998766816007
Energy: 1.9183464849390717
Energy: 1.7059355790676212
Energy: 1.9331506588972684
Energy: 1.526945456689636
Energy: 1.9331506588979144
Energy: 1.7059355790669755
Energy: 1.9331506588979144
Energy: 1.5584348388569018
Energy: 1.8140774592032243
Energy: 1.5718684735373607
Energy: 1.8140774592038704
Energy: 1.558434838858194
Energy: 1.8140774592038704
Energy: 1.7164072433151363
Energy: 1.959077371678835
Energy: 1.4986711542991713
Energy: 1.959077371678835
Energy: 1.7164072433144901
Energy: 1.959077371678835
Energy: 1.4987495159379665
Energy: 1.8002995315653365
Energy: 1.4986143225102635
Energy: 1.774934848964513
Energy: 1.4987495159379665
Energy: 1.7751528698827297
Energy: 1.4987977793168714
Energy: 1.9589584028962672
Energy: 1.7168005184183084
Energy: 1.958958402896913
Energy: 1.4987977793175171
Energy: 1.9589584028975588
Energy: 1.571947501398182
Energy: 1.8137906348553128
Energy: 1.5584562223355325
Energy: 1.8137906348553128
Energy: 1.5719475013975361
Energy: 1.8137906348553128
Energy: 1.5269462840132386
Energy: 1.9331969202700032
Energy: 1.706234548825913
Energy: 1.933196920271295
Energy: 1.526946284012593
Energy: 1.9331969202706494
Energy: 1.5520592615462563
Energy: 1.9186128278984724
Energy: 1.6377860390206216
Energy: 1.9186128278978265
Energy: 1.5520592615456104
Energy: 1.9186128278978265
Energy: 1.6082767193368963
Energy: 1.961868843212293
Energy: 1.570873572365898
Energy: 1.9618688432116471
Energy: 1.6082767193368963
Energy: 1.961868843212293
Energy: 1.4836158899279486
Energy: 1.9595481691071428
Energy: 1.7678791031554422
Energy: 1.9595481691064969
Energy: 1.4836158899279486
Energy: 1.9595481691071428
Energy: 1.4836466944975355
Energy: 1.8167327000157691
Energy: 1.498596567588686
Energy: 1.8167327000157691
Energy: 1.4836466944975355
Energy: 1.8167327000157691
Energy: 1.5523514608247497
Energy: 1.9293500042474083
Energy: 1.5732700912655513
Energy: 1.9293500042480543
Energy: 1.5523514608247497
Energy: 1.9293500042474083
Energy: 1.5725800585568563
Energy: 1.9139996735527869
Energy: 1.760349562481735
Energy: 1.9139996735521412
Energy: 1.5725800585562104
Energy: 1.9139996735521412
Energy: 1.5264978215629061
Energy: 1.9316147658570144
Energy: 1.70212260401009
Energy: 1.9316147658583065
Energy: 1.5264978215629061
Energy: 1.9316147658583065
Energy: 1.5722249353489937
Energy: 1.8258009900565244
Energy: 1.6960614709178532
Energy: 1.8258009900565244
Energy: 1.5722249353496398
Energy: 1.8258009900565244
Energy: 1.6041783047435023
Energy: 1.9202644613102224
Energy: 1.7129872583036707
Energy: 1.9202644613095765
Energy: 1.6041783047435023
Energy: 1.9202644613095765
Energy: 1.5534815696654225
Energy: 1.9238092092045143
Energy: 1.7898920391142121
Energy: 1.9238092092045143
Energy: 1.5534815696654225
Energy: 1.9238092092045143
Energy: 1.5526999242831314
Energy: 1.873557483706122
Energy: 1.5008557578406558
Energy: 1.873557483706122
Energy: 1.5526999242831314
Energy: 1.8157943739875093
Energy: 1.4844688072016894
Energy: 1.9614171137150338
Energy: 1.527571039408732
Energy: 1.9614171137156795
Energy: 1.4844688072016894
Energy: 1.9614171137150338
Energy: 1.4844141676072755
Energy: 1.962127760884644
Energy: 1.529545888597501
Energy: 1.962127760884644
Energy: 1.4844141676072755
Energy: 1.962127760884644
Energy: 1.5713056472242584
Energy: 1.9742795686879668
Energy: 1.552208592848155
Energy: 1.9742795686879668
Energy: 1.5713056472249043
Energy: 1.9742795686879668
Energy: 1.571604454168662
Energy: 1.907060250616334
Energy: 1.6908903550016146
Energy: 1.8863786378984477
Energy: 1.5716044541693082
Energy: 1.9242189859726213
Energy: 1.6997697968049417
Energy: 1.9419216257528404
Energy: 1.889139011089212
Energy: 1.9419216257521945
Energy: 1.6997697968042955
Energy: 1.9419216257528404
Energy: 1.571460909881473
Energy: 1.8857741909270267
Energy: 1.6909223352313352
Energy: 1.8857741909270267
Energy: 1.571460909881473
Energy: 1.9242189859713297
Energy: 1.5713771185102838
Energy: 1.9741990150826418
Energy: 1.5522081970433201
Energy: 1.9741990150832878
Energy: 1.5713771185109298
Energy: 1.9741990150832878
Energy: 1.4843967655096257
Energy: 1.9621054111434642
Energy: 1.529766539068362
Energy: 1.9621054111428182
Energy: 1.4843967655102719
Energy: 1.9621054111428182
Energy: 1.4844850397491551
Energy: 1.961427839377809
Energy: 1.5275687188120062
Energy: 1.961427839377809
Energy: 1.4844850397491551
Energy: 1.961427839377809

minimum gb energy = 1.4833555195614532 eV
minimum distance =  2.22935575525017 Angstroms
sigma value = 57


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

Energy: 1.5838632916325737
Energy: 1.8723451513278313
Energy: 1.4892571286823313
Energy: 1.8723451513278313
Energy: 1.5838632916325737
Energy: 1.8723451513293017
Energy: 1.364022467706914
Energy: 1.8457261486323282
Energy: 1.397990686979986
Energy: 1.8457261486337986
Energy: 1.3640224677054436
Energy: 1.8457261486323282
Energy: 1.3516726886399295
Energy: 1.8213395002395156
Energy: 1.4874774986197328
Energy: 1.8213395002395156
Energy: 1.3516726886399295
Energy: 1.8213395002395156
Energy: 1.3987118766776578
Energy: 1.8235180880351223
Energy: 1.474444345888044
Energy: 1.8235180880351223
Energy: 1.3987118766776578
Energy: 1.8235180880351223
Energy: 1.3990751311577982
Energy: 1.873005823534608
Energy: 1.3978739248040695
Energy: 1.873005823534608
Energy: 1.3990751311577982
Energy: 1.873005823534608
Energy: 1.3983146663772723
Energy: 1.8215744183782994
Energy: 1.3500283622777096
Energy: 1.8215744183782994
Energy: 1.3983146663772723
Energy: 1.8215744183782994
Energy: 1.3984820199690744
Energy: 1.821625631124238
Energy: 1.3501168348557568
Energy: 1.821625631124238
Energy: 1.3984820199690744
Energy: 1.821625631124238
Energy: 1.3990690753743305
Energy: 1.8728024005115351
Energy: 1.3984459021964601
Energy: 1.8728024005115351
Energy: 1.3990690753743305
Energy: 1.8728024005115351
Energy: 1.398715554006721
Energy: 1.8234180986069715
Energy: 1.4740901118379313
Energy: 1.8234180986084418
Energy: 1.398715554006721
Energy: 1.8234180986084418
Energy: 1.3516953346514686
Energy: 1.8213340650703695
Energy: 1.4874905520131503
Energy: 1.8213340650703695
Energy: 1.3516953346514686
Energy: 1.82133406507184
Energy: 1.3640920231636668
Energy: 1.8457261486337986
Energy: 1.3985822028648958
Energy: 1.8457261486337986
Energy: 1.3640920231636668
Energy: 1.8457261486323282
Energy: 1.5838632916325737
Energy: 1.8723451513278313
Energy: 1.605591339904603
Energy: 1.8723451513293017
Energy: 1.5838632916325737
Energy: 1.8723451513293017
Energy: 1.3640224677054436
Energy: 1.8457261486323282
Energy: 1.397990686979986
Energy: 1.8457261486323282
Energy: 1.3640224677054436
Energy: 1.8457261486323282
Energy: 1.3516726886399295
Energy: 1.8213395002395156
Energy: 1.4874774986197328
Energy: 1.8213395002395156
Energy: 1.3516726886399295
Energy: 1.8213395002409858
Energy: 1.3987118766776578
Energy: 1.8235180880351223
Energy: 1.398333561674966
Energy: 1.8235180880351223
Energy: 1.3987118766776578
Energy: 1.8235180880351223
Energy: 1.3990751311577982
Energy: 1.873005823534608
Energy: 1.3978739248040695
Energy: 1.8730058235360787
Energy: 1.3990751311577982
Energy: 1.873005823534608
Energy: 1.3983146663787427
Energy: 1.8215744183782994
Energy: 1.3500283622762392
Energy: 1.8215744183782994
Energy: 1.3983146663787427
Energy: 1.8215744183782994
Energy: 1.3984820199676038
Energy: 1.8216256311227674
Energy: 1.3501168348542865
Energy: 1.821625631124238
Energy: 1.3984820199676038
Energy: 1.821625631124238
Energy: 1.3990690753743305
Energy: 1.8728024005115351
Energy: 1.3984459021979305
Energy: 1.8728024005130055
Energy: 1.3990690753743305
Energy: 1.8728024005130055

minimum gb energy = 1.3500283622762392 eV
minimum distance =  2.21263439732139 Angstroms
sigma value = 11


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

Energy: 1.3768581388285859
Energy: 1.805758000269001
Energy: 1.4365654585758434
Energy: 1.805758000269001
Energy: 1.3768581388285859
Energy: 1.805758000269001
Energy: 1.7241314469637374
Energy: 1.3445006384767195
Energy: 1.246431988911992
Energy: 1.3445006384745652
Energy: 1.7241314469637374
Energy: 1.3445006384756422
Energy: 1.3825236107500227
Energy: 1.6769570968525465
Energy: 1.3830459809946178
Energy: 1.6769570968536236
Energy: 1.3825236107500227
Energy: 1.6769570968536236
Energy: 1.4959610228323887
Energy: 1.2802579971904058
Energy: 1.2463684535733697
Energy: 1.2802579971904058
Energy: 1.4959610228313116
Energy: 1.2802579971904058
Energy: 1.247053510574395
Energy: 1.8007426157573119
Energy: 1.2755858412256396
Energy: 1.8007426157573119
Energy: 1.247053510574395
Energy: 1.8007426157573119
Energy: 1.276948498542972
Energy: 1.7575130334701354
Energy: 1.246507872545758
Energy: 1.7575130334701354
Energy: 1.276948498542972
Energy: 1.7575130334701354
Energy: 1.275696405324889
Energy: 1.2491252663238417
Energy: 1.2465905595494116
Energy: 1.249125265854414
Energy: 1.2756964053238118
Energy: 1.2491252658673393
Energy: 1.756997176252
Energy: 1.782920245396086
Energy: 1.2534000408861055
Energy: 1.782920245396086
Energy: 1.7569971762509229
Energy: 1.782920245396086
Energy: 1.75663875425857
Energy: 1.7991393965172353
Energy: 1.7194425609825987
Energy: 1.7991393965183125
Energy: 1.756638754259647
Energy: 1.7991393965183125
Energy: 1.277183304162672
Energy: 1.677728587210126
Energy: 1.2463854730400923
Energy: 1.677728587209049
Energy: 1.277183304162672
Energy: 1.677728587209049
Energy: 1.2757290950798608
Energy: 1.7582061253739787
Energy: 1.2465000601758043
Energy: 1.7582061253739787
Energy: 1.2757290950798608
Energy: 1.7582061253739787
Energy: 1.2484837929872832
Energy: 1.7968691746178476
Energy: 1.2467332034041811
Energy: 1.796869174618925
Energy: 1.2484837929872832
Energy: 1.796869174618925
Energy: 1.7463612421726402
Energy: 1.279367484386073
Energy: 1.2755860732695552
Energy: 1.279367484386073
Energy: 1.7463612421737171
Energy: 1.279367484386073
Energy: 1.3796324572827359
Energy: 1.6766105507170495
Energy: 1.275394820654838
Energy: 1.6766105507181268
Energy: 1.3796324572827359
Energy: 1.6766105507181268
Energy: 1.7198861839469668
Energy: 1.3483736983069419
Energy: 1.2462870606888443
Energy: 1.348373698308019
Energy: 1.719886183948044
Energy: 1.3483736983069419
Energy: 1.376431244887928
Energy: 1.7881590391651576
Energy: 1.519271937983162
Energy: 1.7881590391651576
Energy: 1.376431244887928
Energy: 1.7881590391651576
Energy: 1.7334928871547561
Energy: 1.6940252303736487
Energy: 1.2753733755281516
Energy: 1.6940252303725716
Energy: 1.7334928871526019
Energy: 1.6940252303725716
Energy: 1.3798251210344081
Energy: 1.6766426774183745
Energy: 1.3041257287930315
Energy: 1.6766426774183745
Energy: 1.3798251210354853
Energy: 1.6766426774183745
Energy: 1.495239733882432
Energy: 1.2762425029528097
Energy: 1.246180050132415
Energy: 1.2762425029517326
Energy: 1.495239733882432
Energy: 1.2762425029528097
Energy: 1.248379191525896
Energy: 1.7980281235433169
Energy: 1.283701817674682
Energy: 1.7980281235433169
Energy: 1.248379191526973
Energy: 1.7980281235433169
Energy: 1.3436259856096695
Energy: 1.7539626458576445
Energy: 1.2462273075993602
Energy: 1.7539626458565674
Energy: 1.3436259856096695
Energy: 1.7539626458565674
Energy: 1.2772468078190373
Energy: 1.2510034644477612
Energy: 1.2547407603260705
Energy: 1.2510034644499155
Energy: 1.2772468078201145
Energy: 1.2510034644477612
Energy: 1.7591197603042468
Energy: 1.7829192414153412
Energy: 1.2530799783241953
Energy: 1.7829192414153412
Energy: 1.7591197603053237
Energy: 1.7829192414153412
Energy: 1.2486317255194703
Energy: 1.79867096598479
Energy: 1.7197804243514978
Energy: 1.798670965985867
Energy: 1.2486317255194703
Energy: 1.79867096598479
Energy: 1.2813869376671652
Energy: 1.249725126247074
Energy: 1.2464427789785282
Energy: 1.249725126245997
Energy: 1.2813869376671652
Energy: 1.249725126247074
Energy: 1.277598880879432
Energy: 1.7196723955967061
Energy: 1.2546734334941883
Energy: 1.7196723955956292
Energy: 1.277598880879432
Energy: 1.7196723955967061

minimum gb energy = 1.246180050132415 eV
minimum distance =  2.19622755921958 Angstroms
sigma value = 41


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

Energy: 1.6937947882347368
Energy: 1.636013444136164
Energy: 1.177544768001338
Energy: 1.636013444136164
Energy: 1.6937947882338877
Energy: 1.636013444136164
Energy: 1.9478645444034992
Energy: 1.2567553469454913
Energy: 1.139207106814758
Energy: 1.2567553469454913
Energy: 1.9478645444034992
Energy: 1.2567553469454913
Energy: 1.2235194529124003
Energy: 1.6108313605233697
Energy: 1.1773837921194776
Energy: 1.6108313605242186
Energy: 1.2235194529124003
Energy: 1.6108313605242186
Energy: 1.7483042002259677
Energy: 1.1770686756038944
Energy: 1.1391053576868961
Energy: 1.1770686756038944
Energy: 1.7483042002268165
Energy: 1.1770686756047435
Energy: 1.2359748169932643
Energy: 1.5008946468606046
Energy: 1.176178873030661
Energy: 1.5008946468597557
Energy: 1.2359748169941132
Energy: 1.5008946468597557
Energy: 1.5479205352760639
Energy: 1.5859886205735654
Energy: 1.1390583777732528
Energy: 1.5859886205735654
Energy: 1.547920535275215
Energy: 1.5859886205735654
Energy: 1.1396309869416397
Energy: 1.612505801894681
Energy: 1.1393100852790146
Energy: 1.6125058018955298
Energy: 1.1396309869416397
Energy: 1.6125058018955298
Energy: 1.5889310120468954
Energy: 1.5943697070700495
Energy: 1.1382511718938453
Energy: 1.5943697070700495
Energy: 1.5889310120468954
Energy: 1.5943697070700495
Energy: 1.1767432400900482
Energy: 1.1396234862864518
Energy: 1.5152647116000646
Energy: 1.1396234862881498
Energy: 1.1767432400900482
Energy: 1.1396234862881498
Energy: 1.5636781690959423
Energy: 1.60330104265245
Energy: 1.5173718071762456
Energy: 1.603301042653299
Energy: 1.563678169096791
Energy: 1.60330104265245
Energy: 1.5617026802998413
Energy: 1.6148674494248294
Energy: 1.517518700069306
Energy: 1.6148674494256783
Energy: 1.5617026802998413
Energy: 1.6148674494256783
Energy: 1.1792743322841939
Energy: 1.5945230670601975
Energy: 1.1383982241332582
Energy: 1.635341729529409
Energy: 1.1792743322841939
Energy: 1.5945230670601975
Energy: 1.1764484645313944
Energy: 1.6037567844017866
Energy: 1.5154054707250282
Energy: 1.6037567844017866
Energy: 1.1764484645313944
Energy: 1.6037567844026357
Energy: 1.1422491437197804
Energy: 1.6028909235342879
Energy: 1.1391668005694595
Energy: 1.6028909235342879
Energy: 1.1422491437206292
Energy: 1.6028909235342879
Energy: 1.5479351523692375
Energy: 1.408682166987184
Energy: 1.1390391141448255
Energy: 1.408682166987184
Energy: 1.5479351523692375
Energy: 1.408682166987184
Energy: 1.1396380291301356
Energy: 1.5945461268783432
Energy: 1.13929419101017
Energy: 1.633069924712383
Energy: 1.1396380291301356
Energy: 1.5945461268783432
Energy: 1.5154277151453408
Energy: 1.6024981830843956
Energy: 1.1898416821225846
Energy: 1.6024981830852447
Energy: 1.5154277151453408
Energy: 1.6024981830852447
Energy: 1.1378882896116016
Energy: 1.602233839895598
Energy: 1.177104632685321
Energy: 1.602233839895598
Energy: 1.1378882896124503
Energy: 1.602233839895598
Energy: 1.9474566629041277
Energy: 1.2531205594415713
Energy: 1.1389641479199955
Energy: 1.2531205594407224
Energy: 1.9474566629041277
Energy: 1.2531205594398735
Energy: 1.5185995749313124
Energy: 1.60160056368103
Energy: 1.5612639062473013
Energy: 1.622095107035151
Energy: 1.5185995749321612
Energy: 1.60160056368103
Energy: 1.938300250356243
Energy: 1.2525376239806068
Energy: 1.1774948288165974
Energy: 1.2525376239814558
Energy: 1.938300250356243
Energy: 1.2525376239806068
Energy: 1.137877892565636
Energy: 1.5959473620143585
Energy: 1.2108894258319955
Energy: 1.5959473620152074
Energy: 1.137877892564787
Energy: 1.5959473620152074
Energy: 1.7817370690568661
Energy: 1.1764500127309796
Energy: 1.139226847519994
Energy: 1.1764500127301307
Energy: 1.7817370690568661
Energy: 1.1764500127309796
Energy: 1.1393529733940213
Energy: 1.5858102263381149
Energy: 1.3662705971424443
Energy: 1.1739412091320744
Energy: 1.1393529733931724
Energy: 1.5858102263381149
Energy: 1.362803484746093
Energy: 1.5850497920550686
Energy: 1.139121068315497
Energy: 1.5850497920550686
Energy: 1.3628034847452442
Energy: 1.5850497920542195
Energy: 1.1422126090699343
Energy: 1.17651608627879
Energy: 1.3316083874789242
Energy: 1.17651608627879
Energy: 1.1422126090699343
Energy: 1.1928482118345947
Energy: 1.6197686584548714
Energy: 1.5945634217642373
Energy: 1.1387045921864087
Energy: 1.5945634217633882
Energy: 1.6197686584548714
Energy: 1.5945634217633882
Energy: 1.1795174476936283
Energy: 1.5997801057443433
Energy: 1.5154691417690531
Energy: 1.4349446238310426
Energy: 1.1795174476936283
Energy: 1.5997801057443433
Energy: 1.5611224752890642
Energy: 1.6018120898662231
Energy: 1.517287627940589
Energy: 1.6018120898662231
Energy: 1.5611224752882153
Energy: 1.6018120898662231
Energy: 1.1425291372603648
Energy: 1.1927168565396356
Energy: 1.518033798091129
Energy: 1.1766387672428409
Energy: 1.1425291372603648
Energy: 1.1927168565379378
Energy: 1.1764716075107915
Energy: 1.5946925552459694
Energy: 1.1386767783405132
Energy: 1.5946925552459694
Energy: 1.1764716075107915
Energy: 1.5946925552459694
Energy: 1.1796994870995479
Energy: 1.6068116934496668
Energy: 1.5152431998610298
Energy: 1.6068116934496668
Energy: 1.1796994870995479
Energy: 1.6068116934496668
Energy: 1.1393381584300402
Energy: 1.5951394524838691
Energy: 1.1392128381366764
Energy: 1.5951394524838691
Energy: 1.139338158429191
Energy: 1.5951394524838691

minimum gb energy = 1.137877892564787 eV
minimum distance =  2.22982285180484 Angstroms
sigma value = 33


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

Energy: 1.3919807305879865
Energy: 1.3745159977200379
Energy: 1.165487186992574
Energy: 1.3745159977176549
Energy: 1.3919807305873908
Energy: 1.3745159977188464
Energy: 2.034790940167289
Energy: 1.0600074692819739
Energy: 1.014745232752269
Energy: 1.0600074692819739
Energy: 2.034790940167289
Energy: 1.0600074692819739
Energy: 1.3785410939263696
Energy: 1.400264987979255
Energy: 1.149713703897961
Energy: 1.400264987979255
Energy: 1.378541093925774
Energy: 1.400264987979255
Energy: 1.7147328571059117
Energy: 1.0293903484798312
Energy: 1.015088975979742
Energy: 1.0293903484798312
Energy: 1.7147328571065077
Energy: 1.029390348480427
Energy: 1.0602372074577888
Energy: 1.3863059542952265
Energy: 1.028801395736733
Energy: 1.3863059542946308
Energy: 1.0602372074583846
Energy: 1.3863059542946308
Energy: 1.5618944004238455
Energy: 1.3233812237024465
Energy: 1.0151892143061214
Energy: 1.3233812237012548
Energy: 1.561894400424441
Energy: 1.3233812237024465
Energy: 1.0558456955191702
Energy: 1.3561218955367451
Energy: 1.0092916766321878
Energy: 1.3561218955361491
Energy: 1.0558456955191702
Energy: 1.3561218955361491
Energy: 1.4223506952993827
Energy: 1.3201267109823267
Energy: 1.0119389185084215
Energy: 1.3201267109811352
Energy: 1.422350695298191
Energy: 1.3201267109811352
Energy: 1.0019215768735354
Energy: 1.377670827073175
Energy: 1.2024196605839736
Energy: 1.377670827073175
Energy: 1.00192157687294
Energy: 1.377670827073175
Energy: 1.28351179342723
Energy: 1.3715215230039786
Energy: 1.2643117871538745
Energy: 1.3715215230039786
Energy: 1.28351179342723
Energy: 1.3715215230039786
Energy: 1.0064170154738141
Energy: 1.3564387153280442
Energy: 1.2636193655770334
Energy: 1.3564387153280442
Energy: 1.0064170154732184
Energy: 1.3564387153268525
Energy: 1.619484283504977
Energy: 1.384567710031902
Energy: 1.2731939166668256
Energy: 1.3845677100324978
Energy: 1.6194842835055727
Energy: 1.3845677100324978
Energy: 1.2753923722072413
Energy: 1.3783715956045839
Energy: 1.5494775949962087
Energy: 1.3783715956045839
Energy: 1.2753923722078373
Energy: 1.3783715956045839
Energy: 1.2956332335674596
Energy: 1.3938256500949904
Energy: 1.5510189264328713
Energy: 1.3938256500949904
Energy: 1.2956332335668637
Energy: 1.3938256500949904
Energy: 1.2918117566329
Energy: 1.365093010130738
Energy: 1.5513094556557694
Energy: 1.3650930101301422
Energy: 1.2918117566334957
Energy: 1.3650930101301422
Energy: 1.2788998014154584
Energy: 1.384226592916539
Energy: 1.2730402700003853
Energy: 1.384226592917135
Energy: 1.2788998014154584
Energy: 1.384226592916539
Energy: 1.2753258113548576
Energy: 1.3787197655490533
Energy: 1.5493978056985933
Energy: 1.3787197655484575
Energy: 1.2753258113542616
Energy: 1.3787197655484575
Energy: 1.0088507643082496
Energy: 1.3912992135301134
Energy: 1.2640573002946611
Energy: 1.3912992135295175
Energy: 1.0088507643082496
Energy: 1.3912992135307092
Energy: 1.2818872242849997
Energy: 1.3746318731683835
Energy: 1.2637894597329753
Energy: 1.374631873167192
Energy: 1.281887224284404
Energy: 1.374631873167192
Energy: 1.0049033668566738
Energy: 1.3844536276584651
Energy: 1.011964027158073
Energy: 1.3844536276584651
Energy: 1.0049033668578655
Energy: 1.3844536276590609
Energy: 1.2664928593207292
Energy: 1.3616033869826547
Energy: 1.2665365269919167
Energy: 1.3616033869832507
Energy: 1.2664928593207292
Energy: 1.3616033869832507
Energy: 1.003666712676547
Energy: 1.3905639123853186
Energy: 1.0148243898194058
Energy: 1.3905639123847229
Energy: 1.003666712676547
Energy: 1.3905639123847229
Energy: 1.5600837175087783
Energy: 1.3711535555900576
Energy: 1.0084525549262735
Energy: 1.3711535555900576
Energy: 1.5600837175087783
Energy: 1.3711535555906533
Energy: 1.0102467549524576
Energy: 1.3845329826838426
Energy: 1.0145528006276354
Energy: 1.3845329826832466
Energy: 1.0102467549512661
Energy: 1.3845329826832466
Energy: 1.549711182984672
Energy: 1.360313595434342
Energy: 1.212081774232493
Energy: 1.360313595434938
Energy: 1.549711182984672
Energy: 1.360313595434342
Energy: 1.2728680654950786
Energy: 1.3860204896777146
Energy: 1.0320785609653715
Energy: 1.3860204896777146
Energy: 1.2728680654950786
Energy: 1.3860204896783104
Energy: 1.8664821954111506
Energy: 1.0295312035186583
Energy: 1.0085871860132967
Energy: 1.02953120351985
Energy: 1.866482195412342
Energy: 1.0295312035186583
Energy: 1.2943036716273884
Energy: 1.3916300408981637
Energy: 1.2932945244734586
Energy: 1.3916300408981637
Energy: 1.29430367162858
Energy: 1.3916300408981637
Energy: 1.7119494139291556
Energy: 1.3524205071963158
Energy: 1.2788669023005508
Energy: 1.3524205071963158
Energy: 1.7119494139291556
Energy: 1.3524205071963158
Energy: 1.2729282475520187
Energy: 1.3857900463310164
Energy: 1.3147499214177143
Energy: 1.3857900463316122
Energy: 1.2729282475502315
Energy: 1.3857900463316122
Energy: 1.7276947912878557
Energy: 1.031413361482582
Energy: 1.0086340240720462
Energy: 1.031413361482582
Energy: 1.7276947912884517
Energy: 1.031413361482582
Energy: 1.0102191784228869
Energy: 1.374387617683902
Energy: 1.1546419314724736
Energy: 1.374387617683902
Energy: 1.010219178419908
Energy: 1.374387617683902
Energy: 1.418177863461014
Energy: 1.3429713468555178
Energy: 1.0046438643152154
Energy: 1.3429713468543263
Energy: 1.418177863460418
Energy: 1.3429713468543263
Energy: 1.0033327503508098
Energy: 1.3241631667424174
Energy: 1.4381318350273185
Energy: 1.3241631667418219
Energy: 1.0033327503490226
Energy: 1.3241631667424174
Energy: 1.4385587006452876
Energy: 1.324242280444175
Energy: 1.003611618945059
Energy: 1.324242280444175
Energy: 1.438558700645883
Energy: 1.324242280444175
Energy: 1.0046864814971985
Energy: 1.343189074398533
Energy: 1.417932241086699
Energy: 1.343189074398533
Energy: 1.004686481497794
Energy: 1.3431890743991286
Energy: 1.1545302290148303
Energy: 1.3743551081507865
Energy: 1.0102593691512614
Energy: 1.3743551081513825
Energy: 1.1545302290154262
Energy: 1.3743551081519785
Energy: 1.0086100994552716
Energy: 1.0313589154101699
Energy: 1.7279586795143143
Energy: 1.031358915409574
Energy: 1.0086100994552716
Energy: 1.031358915409574
Energy: 1.3147499214165228
Energy: 1.3857664008325892
Energy: 1.2729330905440948
Energy: 1.385766400833185
Energy: 1.3147499214165228
Energy: 1.3857664008337807
Energy: 1.1398349904176406
Energy: 1.3526319763463601
Energy: 1.7119746815936119
Energy: 1.3526319763451684
Energy: 1.1398349904200236
Energy: 1.3526319763457642
Energy: 1.294058361063472
Energy: 1.3916235349450832
Energy: 1.2942039618464964
Energy: 1.3916235349444872
Energy: 1.294058361063472
Energy: 1.3916235349450832
Energy: 1.0086417174270004
Energy: 1.0295312213109693
Energy: 1.8664827819072276
Energy: 1.029531221311565
Energy: 1.0086417174270004
Energy: 1.029531221311565
Energy: 1.032131077202731
Energy: 1.3860405193441634
Energy: 1.2727477650490082
Energy: 1.3860405193441634
Energy: 1.032131077203327
Energy: 1.3860405193435676
Energy: 1.1403750180580658
Energy: 1.3605465269854886
Energy: 1.5496851426128098
Energy: 1.360546526984893
Energy: 1.14037501805747
Energy: 1.360546526984893
Energy: 1.0145403676185138
Energy: 1.384490915453367
Energy: 1.0100829753880896
Energy: 1.3844909154521754
Energy: 1.0145403676185138
Energy: 1.3844909154521754
Energy: 1.0085394467293396
Energy: 1.3711535555906533
Energy: 1.5602834834229267
Energy: 1.3711535555912493
Energy: 1.0085394467293396
Energy: 1.3711535555912493
Energy: 1.015069174177771
Energy: 1.390899992415937
Energy: 1.0036497159836493
Energy: 1.3908999924171286
Energy: 1.015069174177771
Energy: 1.3908999924171286

minimum gb energy = 1.00192157687294 eV
minimum distance =  2.28864091972696 Angstroms
sigma value = 67


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

Energy: 0.3269911863413397
Energy: 0.32782956697441434
Energy: 1.9198123831088905
Energy: 0.32782956697441434
Energy: 0.3269911863417017
Energy: 0.3278295669748216
Energy: 0.30932509280571896
Energy: 0.8577444297945522
Energy: 0.6704177484734067
Energy: 0.857744429793783
Energy: 0.30932509280490444
Energy: 0.8577444297933756
Energy: 0.3269911863409325
Energy: 0.3278295669740071
Energy: 1.823686339682024
Energy: 0.3278295669740071
Energy: 0.3269911863417017
Energy: 0.3278295669740071
Energy: 0.30932509280372794
Energy: 0.857744429794145
Energy: 0.6704170435539498
Energy: 0.8577444297929685
Energy: 0.3093250928029134
Energy: 0.8577444297933756
Energy: 0.3269911863417017
Energy: 0.32782956697441434
Energy: 1.8236863396828382
Energy: 0.32782956697441434
Energy: 0.3269911863417017
Energy: 0.32782956697441434
Energy: 0.3093250928060809
Energy: 0.8577444297945522
Energy: 0.6704170031110187
Energy: 0.857744429793783
Energy: 0.30932509280372794
Energy: 0.8577444297933756
Energy: 0.3269911863413397
Energy: 0.3278295669740071
Energy: 1.8236863396836527
Energy: 0.3278295669740071
Energy: 0.3269911863413397
Energy: 0.3278295669740071

minimum gb energy = 0.3093250928029134 eV
minimum distance =  2.45400471738247 Angstroms
sigma value = 3


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

Energy: 1.6571947456490157
Energy: 1.3226086660590899
Energy: 1.178012046342938
Energy: 1.3226086660601735
Energy: 1.6571947456490157
Energy: 1.3226086660601735
Energy: 2.038361383764827
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Energy: 1.6760418002533208
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Energy: 1.1902633784429952
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Energy: 1.0554467756637085
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Energy: 1.5932300008443645
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Energy: 0.9954655017938608
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Energy: 1.2815625989491564
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Energy: 1.6225421267276972
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Energy: 1.6225421267276972
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Energy: 1.2839458426636001
Energy: 1.0462095112491316
Energy: 1.283945842664142
Energy: 1.3248591451941836
Energy: 1.283945842664684
Energy: 1.5939100427554296
Energy: 1.288298675651088
Energy: 1.0587497876973901
Energy: 1.2882986756537975
Energy: 1.5939100427559716
Energy: 1.2882986756537975
Energy: 1.3102433189931322
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Energy: 1.3156132593769958
Energy: 1.2667702204176652
Energy: 1.3102433189925902
Energy: 1.2667702204182072
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Energy: 1.2638090844312921
Energy: 1.0763368091265084
Energy: 1.2638090844302083
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Energy: 1.270712809563565
Energy: 1.3065336184414027
Energy: 1.2707128095608555
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Energy: 1.2707128095608555
Energy: 1.3046099095846293
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Energy: 1.3056649601659138
Energy: 1.2908227087926798
Energy: 1.3046099095846293
Energy: 1.290822708792138
Energy: 1.0514619215250391
Energy: 1.0626762779955947
Energy: 1.5950708748946647
Energy: 1.062676277999388
Energy: 1.051461921525581
Energy: 1.0626762780004715
Energy: 1.0514752773872806
Energy: 1.2753550267676466
Energy: 1.3204492130260428
Energy: 1.2753550267703557
Energy: 1.0514752773867386
Energy: 1.275355026769814
Energy: 1.0016215458057494
Energy: 1.0767255048703774
Energy: 1.536731921187841
Energy: 1.0767255048692936
Energy: 1.0016215458062914
Energy: 1.0767255048698356
Energy: 1.0593728471199797
Energy: 1.2960687931530679
Energy: 1.5954667007577839
Energy: 1.2960687931541517
Energy: 1.0593728471205215
Energy: 1.2960687931536097
Energy: 0.9907333274431407
Energy: 1.0070870821910078
Energy: 1.8202183133432572
Energy: 1.0070870821899243
Energy: 0.9907333274425987
Energy: 1.0070870821893825
Energy: 1.0023336572414756
Energy: 1.3045704926247803
Energy: 1.5399651463591943
Energy: 1.3045704926247803
Energy: 1.0023336572414756
Energy: 1.3045704926247803
Energy: 1.0045739833281284
Energy: 1.0077571621713244
Energy: 1.6735313632763231
Energy: 1.00775716217295
Energy: 1.0045739833286702
Energy: 1.00775716217295
Energy: 1.0690739308245718
Energy: 1.2959833452807914
Energy: 1.5956238041057518
Energy: 1.295983345282417
Energy: 1.0690739308245718
Energy: 1.295983345282417
Energy: 0.994581478966884
Energy: 0.9971881153013379
Energy: 1.7428788771742225
Energy: 0.9971881153024216
Energy: 0.9945814789679676
Energy: 0.9971881153018797
Energy: 1.0558675957872101
Energy: 1.2751180367558466
Energy: 1.320788848268078
Energy: 1.2751180367558466
Energy: 1.055867595787752
Energy: 1.2751180367563884
Energy: 1.0632829437771558
Energy: 1.062226305683293
Energy: 1.45660201374451
Energy: 1.062226305683835
Energy: 1.0632829437760718
Energy: 1.0622263056849188
Energy: 1.3278228473963363
Energy: 1.2674768750444318
Energy: 1.3055279576806953
Energy: 1.2674768750417222
Energy: 1.3278228473957945
Energy: 1.2674768750417222

minimum gb energy = 0.9871044109943407 eV
minimum distance =  2.29240828439817 Angstroms
sigma value = 81


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

Energy: 1.5823784058746428
Energy: 1.5045297313302437
Energy: 1.5352005721204158
Energy: 1.5045297313302437
Energy: 1.5823784058753867
Energy: 1.5045297313295003
Energy: 1.8672628894674577
Energy: 1.1611192198136615
Energy: 1.1097187067984997
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Energy: 1.8672628894682015
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Energy: 1.5098965358356942
Energy: 1.4856814026239145
Energy: 1.3110973359276683
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Energy: 1.5098965358356942
Energy: 1.4856814026246579
Energy: 1.454142339299175
Energy: 1.1243794297236953
Energy: 1.109858562833562
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Energy: 1.4541423392984314
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Energy: 1.1314792907934534
Energy: 1.1029915169386333
Energy: 1.2157169333885227
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Energy: 1.1314792907934534
Energy: 1.1029915169378897
Energy: 1.2984979060682116
Energy: 1.110333735895417
Energy: 1.1081569022233062
Energy: 1.110333735895417
Energy: 1.2984979060682116
Energy: 1.1103337358946732
Energy: 1.1200459500486988
Energy: 1.1127178337471806
Energy: 1.2953997533108665
Energy: 1.112717833746437
Energy: 1.1200459500486988
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Energy: 1.1034248519221712
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Energy: 1.486762709795075
Energy: 1.5504447892515112
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Energy: 1.1260984569184687
Energy: 1.486762709795075
Energy: 1.1027498178968829
Energy: 1.4640717856298593
Energy: 1.5775613899870569
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Energy: 1.1027498178968829
Energy: 1.4640717856298593
Energy: 1.1216537984796928
Energy: 1.468134010298921
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Energy: 1.468134010298921
Energy: 1.1217419311067118
Energy: 1.476026915898645
Energy: 1.455136046268708
Energy: 1.476026915898645
Energy: 1.1217419311067118
Energy: 1.476026915898645
Energy: 1.1036998943372196
Energy: 1.4870375873141861
Energy: 1.1224116807943094
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Energy: 1.103699894336476
Energy: 1.4870375873141861
Energy: 1.1031269291036883
Energy: 1.4268950580621393
Energy: 1.3847556929799099
Energy: 1.4268950580621393
Energy: 1.1031269291036883
Energy: 1.4268950580621393
Energy: 1.4566376854096028
Energy: 1.4675552467483126
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Energy: 1.4566376854096028
Energy: 1.4675552467483126
Energy: 1.4564019790003069
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Energy: 1.4798456987016035
Energy: 1.4564019790010505
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Energy: 1.4681803952282335
Energy: 1.487300354282128
Energy: 1.1097337046984654
Energy: 1.4873003542813843
Energy: 1.4681803952282335
Energy: 1.4873003542813843
Energy: 1.468379102981926
Energy: 1.467992873311403
Energy: 1.3846352150737107
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Energy: 1.4683791029826696
Energy: 1.467992873311403
Energy: 1.8586052561645905
Energy: 1.4676395779273619
Energy: 1.1159265362310946
Energy: 1.4676395779273619
Energy: 1.8586052561645905
Energy: 1.4676395779273619
Energy: 1.8585682571782032
Energy: 1.4676625368514304
Energy: 1.1158646879337908
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Energy: 1.467662536852174
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Energy: 1.4679499355232026
Energy: 1.2915402238773168
Energy: 1.4679499355232026
Energy: 1.4684098582668406
Energy: 1.4679499355232026
Energy: 1.4681644160190348
Energy: 1.4871702418123265
Energy: 1.1094943558577721
Energy: 1.4871702418123265
Energy: 1.4681644160190348
Energy: 1.4871702418130701
Energy: 1.4564392538587498
Energy: 1.479851938326373
Energy: 1.106558250200184
Energy: 1.4798519383256292
Energy: 1.4564392538587498
Energy: 1.479851938326373
Energy: 1.456617432177307
Energy: 1.4675610635526366
Energy: 1.1081599024423254
Energy: 1.4675610635526366
Energy: 1.456617432177307
Energy: 1.4675610635526366
Energy: 1.1029847949119056
Energy: 1.4268905320482237
Energy: 1.2880146524651988
Energy: 1.4268905320482237
Energy: 1.1029847949119056
Energy: 1.4268905320482237
Energy: 1.1037018920746469
Energy: 1.4868109609954918
Energy: 1.1226105467772856
Energy: 1.4868109609954918
Energy: 1.1037018920746469
Energy: 1.4868109609954918
Energy: 1.121765649718662
Energy: 1.476026915898645
Energy: 1.455271822891136
Energy: 1.476026915898645
Energy: 1.121765649718662
Energy: 1.4760269158979011
Energy: 1.121654813687249
Energy: 1.4681358600717402
Energy: 1.4657374265885348
Energy: 1.4681358600717402
Energy: 1.121654813687249
Energy: 1.4681358600717402
Energy: 1.1029207907802052
Energy: 1.464436398563897
Energy: 1.6568758998065003
Energy: 1.464436398563897
Energy: 1.1029207907802052
Energy: 1.464436398563897
Energy: 1.1260646309023838
Energy: 1.4866269596155401
Energy: 1.5502566354222371
Energy: 1.4866269596155401
Energy: 1.1260646309031277
Energy: 1.4866269596155401
Energy: 1.1216258307926052
Energy: 1.1156132009140278
Energy: 1.674932976752391
Energy: 1.1156132009147717
Energy: 1.1216258307926052
Energy: 1.1156132009140278
Energy: 1.1482609714661218
Energy: 1.4681176938483667
Energy: 1.4656415203244508
Energy: 1.4681176938483667
Energy: 1.1482609714661218
Energy: 1.4681176938483667
Energy: 1.102800204790429
Energy: 1.1034556514941503
Energy: 1.5018254519599736
Energy: 1.1034556514934066
Energy: 1.1028002047896852
Energy: 1.1034556514941503
Energy: 1.1067534918486612
Energy: 1.103295816576363
Energy: 1.1220190102935672
Energy: 1.103295816576363
Energy: 1.1067534918486612
Energy: 1.103295816576363
Energy: 1.1200531879147744
Energy: 1.1126259024272132
Energy: 1.2954039052115984
Energy: 1.1126259024287004
Energy: 1.1200531879140305
Energy: 1.112625902427957

minimum gb energy = 1.1027498178968829 eV
minimum distance =  2.27361055457512 Angstroms
sigma value = 43


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

Energy: 1.7555602059209747
Energy: 1.6352595524077846
Energy: 1.3721333365358215
Energy: 1.6352595524077846
Energy: 1.7555602059209747
Energy: 1.6352595524077846
Energy: 1.6338098617058519
Energy: 1.2560066355326338
Energy: 1.1770071110434006
Energy: 1.256006635533547
Energy: 1.6338098617049384
Energy: 1.2560066355326338
Energy: 1.2261552890132474
Energy: 1.1771516731609584
Energy: 1.2003268440924892
Energy: 1.1771516731609584
Energy: 1.2261552890123337
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Energy: 1.656382487951803
Energy: 1.2072187304177224
Energy: 1.1772433268241322
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Energy: 1.656382487951803
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Energy: 1.1954859805578602
Energy: 1.1979774373515866
Energy: 1.316241582396016
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Energy: 1.1954859805578602
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Energy: 1.193037473354324
Energy: 1.193989358506567
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Energy: 1.4341775054959691
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Energy: 1.1775305914478085
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Energy: 1.2151854994284441
Energy: 1.1775668531773242
Energy: 1.255283061447285
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Energy: 1.2037307381706674
Energy: 1.20449592645985
Energy: 1.8068012735702785
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Energy: 1.2037307381706674
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Energy: 1.7179859658572054
Energy: 1.614584213777161
Energy: 1.211488192520904
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Energy: 1.177889694198261
Energy: 1.622776367158659
Energy: 1.4063807279696223
Energy: 1.6227763671577662
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Energy: 1.6227763671577662
Energy: 1.2038640303173855
Energy: 1.1773466778667208
Energy: 1.209901836650106
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Energy: 1.203864030316472
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Energy: 1.2038272472098122
Energy: 1.200088624626445
Energy: 1.664030894655516
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Energy: 1.2038272472088984
Energy: 1.2000886246273583
Energy: 1.1792148254672026
Energy: 1.6150614707434714
Energy: 1.1835541978039728
Energy: 1.6150614707434714
Energy: 1.179214825468116
Energy: 1.615061470742558
Energy: 1.1781846459735488
Energy: 1.5881781481716755
Energy: 1.19242964656012
Energy: 1.5881781481707617
Energy: 1.1781846459735488
Energy: 1.5881781481707617
Energy: 1.6356737015202665
Energy: 1.179521104936723
Energy: 1.1779204935537928
Energy: 1.1795211049376364
Energy: 1.6356737015202665
Energy: 1.1795211049376364
Energy: 1.6337730848266343
Energy: 1.1772045011782408
Energy: 1.5486741019503225
Energy: 1.1772045011782408
Energy: 1.6337730848266343
Energy: 1.1772045011782408
Energy: 1.7208213293192927
Energy: 1.6151549916590324
Energy: 1.1998778848077432
Energy: 1.615154991658119
Energy: 1.7208213293192927
Energy: 1.615154991658119
Energy: 1.7211953788493728
Energy: 1.615630168717824
Energy: 1.2023003736216447
Energy: 1.615630168717824
Energy: 1.7211953788493728
Energy: 1.615630168717824
Energy: 1.6355178283198126
Energy: 1.6310612292522637
Energy: 1.177240702710719
Energy: 1.6310612292513502
Energy: 1.6355178283198126
Energy: 1.6310612292522637
Energy: 1.6337604129372456
Energy: 1.6574935434324989
Energy: 1.1768436094447623
Energy: 1.6574935434324989
Energy: 1.6337604129372456
Energy: 1.6574935434324989
Energy: 1.179262235536204
Energy: 1.588513957916176
Energy: 1.1931512672325297
Energy: 1.588513957916176
Energy: 1.179262235536204
Energy: 1.588513957916176
Energy: 1.1786618206545822
Energy: 1.6150177621930077
Energy: 1.1809896603329808
Energy: 1.6150177621930077
Energy: 1.178661820655496
Energy: 1.6150177621930077
Energy: 1.2044105324972612
Energy: 1.6239472280353582
Energy: 1.177579705495281
Energy: 1.6239472280353582
Energy: 1.2044105324972612
Energy: 1.6239472280353582
Energy: 1.2036469564542143
Energy: 1.6571914792195606
Energy: 1.2136114019506363
Energy: 1.6571914792195606
Energy: 1.2036469564542143
Energy: 1.6571914792186473
Energy: 1.1786410674313965
Energy: 1.6227429484132538
Energy: 1.634079214146421
Energy: 1.6227429484132538
Energy: 1.1786410674313965
Energy: 1.6227429484141673
Energy: 1.1990732019198402
Energy: 1.615262009033315
Energy: 1.6645946490890846
Energy: 1.6152620090324015
Energy: 1.1990732019198402
Energy: 1.615262009033315
Energy: 1.2046683014538784
Energy: 1.6042224651619972
Energy: 1.4659838213718985
Energy: 1.6042224651619972
Energy: 1.2046683014538784
Energy: 1.6042224651619972
Energy: 1.255723223421881
Energy: 1.1771763746315953
Energy: 1.2130242661582211
Energy: 1.1771763746306816
Energy: 1.2557232234209676
Energy: 1.1771763746306816
Energy: 1.1784961343822833
Energy: 1.1793312932920417
Energy: 1.4064864637920462
Energy: 1.1793312932920417
Energy: 1.1784961343813696
Energy: 1.1793312932920417
Energy: 1.1966492325171596
Energy: 1.5882581964087588
Energy: 1.1810004829838614
Energy: 1.5882581964096723
Energy: 1.1966492325171596
Energy: 1.5882581964087588

minimum gb energy = 1.1768436094447623 eV
minimum distance =  2.28041840024918 Angstroms
sigma value = 57


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

Energy: 1.352446167030827
Energy: 1.2774751780002374
Energy: 1.5850628566289626
Energy: 1.2774751780026028
Energy: 1.352446167030827
Energy: 1.2774751780002374
Energy: 1.627988300300948
Energy: 1.4082449276945843
Energy: 1.281537055920733
Energy: 1.4082449276945843
Energy: 1.6279883002997653
Energy: 1.4082449276945843
Energy: 1.2924624915386618
Energy: 1.839876499980882
Energy: 1.521225943930309
Energy: 1.839876499980882
Energy: 1.2924624915386618
Energy: 1.839876499980882
Energy: 1.3144441847693382
Energy: 1.3037753117734352
Energy: 1.2807557172859363
Energy: 1.3037753117734352
Energy: 1.3144441847693382
Energy: 1.3037753117734352
Energy: 1.2770688410523736
Energy: 1.3200594887400598
Energy: 1.4745542449970306
Energy: 1.3200594887400598
Energy: 1.2770688410523736
Energy: 1.3200594887400598
Energy: 1.318197045719533
Energy: 1.8131585730834012
Energy: 1.2820288950533196
Energy: 1.8131585730834012
Energy: 1.318197045719533
Energy: 1.8131585730834012
Energy: 1.3016093057072236
Energy: 1.582864110526834
Energy: 1.6276369727829767
Energy: 1.582864110526834
Energy: 1.3016093057072236
Energy: 1.582864110526834
Energy: 1.3182590387659967
Energy: 1.7963679056235673
Energy: 1.3447604700584916
Energy: 1.7963679056235673
Energy: 1.3182590387659967
Energy: 1.7963679056235673
Energy: 1.2776119885511832
Energy: 1.3984988464598032
Energy: 1.4737520963453552
Energy: 1.3984988464598032
Energy: 1.2776119885511832
Energy: 1.3984988464598032
Energy: 1.3057001197655393
Energy: 1.813132590154694
Energy: 1.2821349035548515
Energy: 1.813132590154694
Energy: 1.3057001197655393
Energy: 1.813132590154694
Energy: 1.3015954610335152
Energy: 1.301832460718451
Energy: 1.3019558303018122
Energy: 1.3018324607172682
Energy: 1.3015954610335152
Energy: 1.3018324607172682
Energy: 1.276820965830593
Energy: 1.2774788860405637
Energy: 1.281311049970645
Energy: 1.2774788860393809
Energy: 1.2768209658317757
Energy: 1.2774788860393809
Energy: 1.2778511121724365
Energy: 1.8127454520299382
Energy: 1.398484920649284
Energy: 1.8127454520299382
Energy: 1.2778511121724365
Energy: 1.8127454520299382
Energy: 1.6044560417997162
Energy: 1.5815037295283516
Energy: 1.3071036088172405
Energy: 1.5815037295283516
Energy: 1.6044560417997162
Energy: 1.5815037295283516
Energy: 1.925519109579193
Energy: 1.7960438399013128
Energy: 1.319018647384819
Energy: 1.7960438399013128
Energy: 1.925519109579193
Energy: 1.7960438399013128
Energy: 1.277135682915042
Energy: 1.8484870258687127
Energy: 1.282812565114658
Energy: 1.8484870258675297
Energy: 1.277135682915042
Energy: 1.8484870258675297
Energy: 1.2786426133788023
Energy: 1.5608380970979947
Energy: 1.3017592577630563
Energy: 1.5608380970979947
Energy: 1.2786426133776194
Energy: 1.5608380970979947
Energy: 1.3061059099457821
Energy: 1.6182172151477874
Energy: 1.3047200293659684
Energy: 1.6182172151477874
Energy: 1.3061059099457821
Energy: 1.6182172151489704
Energy: 1.301726144438002
Energy: 1.5608661353076203
Energy: 1.2784907728060586
Energy: 1.5608661353076203
Energy: 1.301726144438002
Energy: 1.5608661353088031
Energy: 1.2826954931399066
Energy: 1.8485536090197656
Energy: 1.2770372139497665
Energy: 1.8485536090197656
Energy: 1.2826954931399066
Energy: 1.8485536090197656
Energy: 1.3192431951941717
Energy: 1.7960621922860072
Energy: 1.9254536018401163
Energy: 1.7960621922860072
Energy: 1.3192431951941717
Energy: 1.7960621922860072
Energy: 1.3069557457197876
Energy: 1.5917810744573162
Energy: 1.6043565773651995
Energy: 1.5917810744573162
Energy: 1.3069557457197876
Energy: 1.5917810744573162
Energy: 1.3441509805446752
Energy: 1.8128027449564519
Energy: 1.2778153777285757
Energy: 1.812802744955269
Energy: 1.3441509805446752
Energy: 1.812802744955269
Energy: 1.2812443875235864
Energy: 1.2772976774546905
Energy: 1.282252519994127
Energy: 1.2772976774546905
Energy: 1.2812443875235864
Energy: 1.2772976774546905

minimum gb energy = 1.276820965830593 eV
minimum distance =  2.30652829025804 Angstroms
sigma value = 17


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

Energy: 1.4082417327580603
Energy: 1.4075771265074823
Energy: 2.096220296935919
Energy: 1.4075771265074823
Energy: 1.4082417327580603
Energy: 1.4075771265074823
Energy: 1.4159855182496455
Energy: 1.4250569261223989
Energy: 1.4268819656872485
Energy: 1.4250569261223989
Energy: 1.4159855182496455
Energy: 1.4250569261223989
Energy: 1.4324054724432547
Energy: 1.4318511742860065
Energy: 1.4248576999220477
Energy: 1.4318511742860065
Energy: 1.4324054724432547
Energy: 1.4318511742860065
Energy: 1.4345467794888471
Energy: 1.425016989211232
Energy: 1.4262084183130865
Energy: 1.425016989211232
Energy: 1.4345467794871745
Energy: 1.425016989211232
Energy: 1.4236690558296412
Energy: 1.4242336965060312
Energy: 1.4240466783159753
Energy: 1.4242336965060312
Energy: 1.4236690558296412
Energy: 1.4242336965060312
Energy: 1.4255392125430444
Energy: 1.40636693255143
Energy: 1.4075768737703234
Energy: 1.40636693255143
Energy: 1.425539212544717
Energy: 1.40636693255143
Energy: 1.4337206793766897
Energy: 1.6239538454011562
Energy: 1.4568470623868703
Energy: 1.6239538454011562
Energy: 1.4337206793766897
Energy: 1.6239538454011562
Energy: 1.4242012556282115
Energy: 1.5565112219260113
Energy: 1.4262952730754186
Energy: 1.5565112219260113
Energy: 1.4242012556282115
Energy: 1.5565112219260113
Energy: 1.423665545028877
Energy: 1.4242181693253477
Energy: 1.5701305039204712
Energy: 1.4242181693253477
Energy: 1.4236655450305498
Energy: 1.4242181693253477
Energy: 1.4048936936459933
Energy: 1.393120340703661
Energy: 1.4266764003148824
Energy: 1.393120340703661
Energy: 1.404893693647666
Energy: 1.393120340703661
Energy: 1.4066517850942055
Energy: 1.4243911733518426
Energy: 1.4343787577893679
Energy: 1.4243911733518426
Energy: 1.4066517850942055
Energy: 1.4243911733518426
Energy: 1.4244034520695887
Energy: 1.426234663458655
Energy: 1.4355900981416532
Energy: 1.426234663460328
Energy: 1.4244034520695887
Energy: 1.426234663458655
Energy: 1.4236794718719266
Energy: 1.5576018883128786
Energy: 1.4243626670197203
Energy: 1.5576018883112057
Energy: 1.4236794718719266
Energy: 1.5576018883128786
Energy: 1.427291282769668
Energy: 1.42474267166564
Energy: 1.4272535190891271
Energy: 1.42474267166564
Energy: 1.427291282769668
Energy: 1.42474267166564
Energy: 1.4243404392912271
Energy: 1.5662332124477505
Energy: 1.404932543543942
Energy: 1.5662332124477505
Energy: 1.4243404392895544
Energy: 1.5662332124477505
Energy: 1.4350073638548289
Energy: 1.4246076174875855
Energy: 1.4048278021973823
Energy: 1.4246076174875855
Energy: 1.4350073638548289
Energy: 1.4246076174875855
Energy: 1.4239251561600763
Energy: 1.4262622060311572
Energy: 1.4240862009875304
Energy: 1.4262622060311572
Energy: 1.4239251561617488
Energy: 1.4262622060311572

minimum gb energy = 1.393120340703661 eV
minimum distance =  2.29090551489238 Angstroms
sigma value = 17


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

Energy: 2.004488124943717
Energy: 2.023395060506468
Energy: 2.0801757091536577
Energy: 2.0233950605071143
Energy: 2.004488124943717
Energy: 2.023395060505822
Energy: 1.733529176643652
Energy: 1.4515073672829204
Energy: 1.4308203283419425
Energy: 1.4515073672835663
Energy: 1.7335291766430063
Energy: 1.4515073672835663
Energy: 1.428601645758417
Energy: 1.5171415300468172
Energy: 1.7219607866267441
Energy: 1.517141530047463
Energy: 1.428601645758417
Energy: 1.517141530047463
Energy: 1.4931684979208537
Energy: 1.431369043899575
Energy: 1.5209444723197325
Energy: 1.4313690439021585
Energy: 1.4931684979202078
Energy: 1.431369043898929
Energy: 1.4312532859481246
Energy: 1.4963934608228924
Energy: 1.775951180460972
Energy: 1.4963934608228924
Energy: 1.4312532859487705
Energy: 1.4963934608228924
Energy: 1.54149321761893
Energy: 1.430743700811853
Energy: 1.5432826253385437
Energy: 1.430743700811207
Energy: 1.5414932176176381
Energy: 1.430743700811207
Energy: 1.4321116250980555
Energy: 1.5444610969630699
Energy: 1.7449107971451379
Energy: 1.544461096962424
Energy: 1.4321116250974093
Energy: 1.544461096962424
Energy: 1.7224228975350673
Energy: 1.432093819881442
Energy: 1.4299020296715401
Energy: 1.432093819881442
Energy: 1.7224228975357132
Energy: 1.432093819881442
Energy: 1.5449354255018148
Energy: 1.432503999777263
Energy: 1.4621945696253005
Energy: 1.432503999777263
Energy: 1.544935425501169
Energy: 1.432503999777263
Energy: 1.802983597793545
Energy: 1.5071765451277948
Energy: 1.4328545706217968
Energy: 1.516386415916243
Energy: 1.8029835977928987
Energy: 1.4964620360550438
Energy: 1.5217081851672094
Energy: 1.5822545568713953
Energy: 1.518297837808934
Energy: 1.5822545568707493
Energy: 1.5217081851659178
Energy: 1.5822545568713953
Energy: 1.4527309837875526
Energy: 1.458616267689944
Energy: 1.4374713456593178
Energy: 1.458616267689944
Energy: 1.4527309837875526
Energy: 1.4586162676905898
Energy: 1.4333138785704402
Energy: 1.4276224223685894
Energy: 1.9872837302027782
Energy: 1.4276224223692353
Energy: 1.4333138785704402
Energy: 1.4276224223692353
Energy: 1.4555149281793713
Energy: 1.7790883398934063
Energy: 1.9529335672329025
Energy: 1.7790883398914685
Energy: 1.4555149281780793
Energy: 1.7790883398921147
Energy: 1.461816216529818
Energy: 1.9959787849599708
Energy: 1.5182788640545553
Energy: 1.9959787849606168
Energy: 1.461816216529818
Energy: 1.9959787849599708
Energy: 1.521168668636811
Energy: 1.5775012675143945
Energy: 1.437525333621236
Energy: 1.6223543761242563
Energy: 1.521168668636811
Energy: 1.5775012675150404
Energy: 1.5263935742386887
Energy: 1.736328319259597
Energy: 1.4614085275192006
Energy: 1.736328319259597
Energy: 1.5263935742393349
Energy: 1.7363283192589511
Energy: 1.945157391095767
Energy: 1.7881955018419184
Energy: 1.4583637677844794
Energy: 1.7881955018425646
Energy: 1.945157391095767
Energy: 1.7881955018419184
Energy: 1.942046933173608
Energy: 1.8274728618263039
Energy: 1.430027388886607
Energy: 1.8274728618269498
Energy: 1.942046933174254
Energy: 1.8274728618263039
Energy: 1.431414742724061
Energy: 1.8006455884131207
Energy: 1.4313783814170513
Energy: 1.9142082403796583
Energy: 1.431414742724061
Energy: 1.8006455884124748
Energy: 1.4296147190263333
Energy: 1.8275665241247934
Energy: 1.942077017747895
Energy: 1.8275665241254393
Energy: 1.4296147190263333
Energy: 1.8275665241254393
Energy: 1.4583742777046806
Energy: 1.7882570329945733
Energy: 1.9453734145810935
Energy: 1.7882570329932812
Energy: 1.4583742777046806
Energy: 1.7882570329932812
Energy: 1.4614415938399001
Energy: 1.7364511781713943
Energy: 1.5266988257582057
Energy: 1.7364511781720402
Energy: 1.4614415938392542
Energy: 1.7364511781720402
Energy: 1.437573454098078
Energy: 1.5404272591995267
Energy: 1.5211663581925743
Energy: 1.5618657122783797
Energy: 1.437573454098078
Energy: 1.5404272591995267
Energy: 1.518256718457136
Energy: 1.9959707469994346
Energy: 1.461372891314095
Energy: 1.9959707469994346
Energy: 1.518256718457136
Energy: 1.9959707469994346
Energy: 1.9529914747181552
Energy: 1.7791428463592762
Energy: 1.4555234369301797
Energy: 1.7791428463586303
Energy: 1.952991474718801
Energy: 1.7791428463586303
Energy: 1.9876291168238154
Energy: 1.4275974983788962
Energy: 1.4333638057540607
Energy: 1.4275974983788962
Energy: 1.9876291168244613
Energy: 1.4275974983776043
Energy: 1.4374824481332997
Energy: 1.4586637895921386
Energy: 1.4526312108675978
Energy: 1.4586637895914927
Energy: 1.4374824481332997
Energy: 1.4586637895908467
Energy: 1.5183511231007645
Energy: 1.5822761387564064
Energy: 1.521793869315423
Energy: 1.5822761387551145
Energy: 1.5183511231001188
Energy: 1.5822761387557605
Energy: 1.4329048171281644
Energy: 1.5071410643319845
Energy: 1.8037015158726477
Energy: 1.4964620360563357
Energy: 1.4329048171281644
Energy: 1.5126200400687284
Energy: 1.4620431829391072
Energy: 1.432463575878229
Energy: 1.544933927486847
Energy: 1.432463575879521
Energy: 1.4620431829391072
Energy: 1.4324635758756452
Energy: 1.4299021169324297
Energy: 1.4322560690657729
Energy: 1.7224326127521745
Energy: 1.4322560690657729
Energy: 1.4299021169324297
Energy: 1.4322560690657729
Energy: 1.7451717589626206
Energy: 1.5446107309327117
Energy: 1.432147952068399
Energy: 1.5446107309320658
Energy: 1.7451717589632665
Energy: 1.5446107309320658
Energy: 1.5433722353835038
Energy: 1.4309381721665118
Energy: 1.5415361018581453
Energy: 1.4309381721671577
Energy: 1.5433722353835038
Energy: 1.4309381721671577
Energy: 1.7526493506452292
Energy: 1.4963934608196627
Energy: 1.4312596227758863
Energy: 1.4963934608196627
Energy: 1.7526493506452292
Energy: 1.4963934608196627
Energy: 1.5210448474526814
Energy: 1.4313374279169837
Energy: 1.4928710331836852
Energy: 1.4313374279182758
Energy: 1.5210448474526814
Energy: 1.4313374279182758
Energy: 1.7220603288672167
Energy: 1.5167519686967308
Energy: 1.4285901874323244
Energy: 1.5167519686960849
Energy: 1.7220603288672167
Energy: 1.5167519686960849
Energy: 1.4308441322351892
Energy: 1.4515205147181702
Energy: 1.733499851012752
Energy: 1.451520514718816
Energy: 1.4308441322358354
Energy: 1.451520514718816
Energy: 1.8978951536556874
Energy: 2.0233950605071143
Energy: 2.0044881249430704
Energy: 2.02339506050776
Energy: 1.8978951536569793
Energy: 2.023395060506468
Energy: 1.4308203283412966
Energy: 1.4515073672835663
Energy: 1.7335291766430063
Energy: 1.4515073672835663
Energy: 1.4308203283412966
Energy: 1.4515073672835663
Energy: 1.7219607866254523
Energy: 1.5171415300487547
Energy: 1.428601645759063
Energy: 1.517141530048109
Energy: 1.7219607866254523
Energy: 1.517141530048109
Energy: 1.5209444723210246
Energy: 1.4313690439021585
Energy: 1.4931684979227915
Energy: 1.4313690439002211
Energy: 1.5209444723210246
Energy: 1.4313690439021585
Energy: 1.775951180460972
Energy: 1.4963934608222467
Energy: 1.431253285947479
Energy: 1.4963934608216005
Energy: 1.775951180460972
Energy: 1.4963934608216005

minimum gb energy = 1.4275974983776043 eV
minimum distance =  2.25809915460609 Angstroms
sigma value = 57


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

Energy: 1.578222949546517
Energy: 2.126084037726183
Energy: 1.8962500327106955
Energy: 2.126084037726183
Energy: 1.5782229495454652
Energy: 2.126084037726183
Energy: 1.5404336218714125
Energy: 1.4373568962138839
Energy: 1.4375120654923654
Energy: 1.4373568962117804
Energy: 1.5404336218714125
Energy: 1.4373568962128322
Energy: 1.4187306020720254
Energy: 1.5632940045950692
Energy: 1.7266841456593343
Energy: 1.563294004592966
Energy: 1.4187306020720254
Energy: 1.563294004592966
Energy: 1.6088117648194773
Energy: 1.549155346408319
Energy: 1.5501992002757272
Energy: 1.5491553464135779
Energy: 1.608811764820529
Energy: 1.549155346412526
Energy: 1.422261879155269
Energy: 1.5027940039988639
Energy: 1.6051392706243341
Energy: 1.5027940039988639
Energy: 1.422261879155269
Energy: 1.5027940039988639
Energy: 1.5542902181434506
Energy: 1.549143657209223
Energy: 1.550041121254514
Energy: 1.549143657209223
Energy: 1.5542902181445024
Energy: 1.5491436572081714
Energy: 1.4222484828208108
Energy: 1.5715012482558524
Energy: 1.436924875958661
Energy: 1.5715012482548008
Energy: 1.4222484828208108
Energy: 1.5715012482548008
Energy: 1.858922681206544
Energy: 1.4902463636031453
Energy: 1.4375797438679345
Energy: 1.4902463636020937
Energy: 1.8589226812054922
Energy: 1.4902463636020937
Energy: 1.5811785753910617
Energy: 1.8811854293861412
Energy: 1.454330981214815
Energy: 1.881185429387193
Energy: 1.5811785753910617
Energy: 1.881185429387193
Energy: 1.5218431323675339
Energy: 1.4396962648775302
Energy: 1.44418156276992
Energy: 1.439696264878582
Energy: 1.521843132366482
Energy: 1.439696264878582
Energy: 1.4225048100579447
Energy: 1.8107864717052573
Energy: 1.5510424268678138
Energy: 1.8107864717042057
Energy: 1.4225048100579447
Energy: 1.8107864717052573
Energy: 1.5145582406455493
Energy: 1.551379951518989
Energy: 1.554456272149262
Energy: 1.5513799515200408
Energy: 1.5145582406444975
Energy: 1.5513799515200408
Energy: 1.4279841976009229
Energy: 1.5640876965487858
Energy: 1.5427611027050527
Energy: 1.5640876965435269
Energy: 1.4279841976009229
Energy: 1.5640876965445787
Energy: 1.553781074623115
Energy: 1.6115601048208523
Energy: 1.554813950374897
Energy: 1.6115601048219041
Energy: 1.5537810746220633
Energy: 1.6115601048219041
Energy: 1.4269236301793247
Energy: 1.57235454804287
Energy: 1.457292637984053
Energy: 1.5723545480439216
Energy: 1.426923630178273
Energy: 1.5723545480439216
Energy: 1.8651364037656757
Energy: 1.885775010805985
Energy: 1.4435480967258008
Energy: 1.885775010805985
Energy: 1.8651364037635725
Energy: 1.885775010805985
Energy: 1.588795445541739
Energy: 1.8801169757778844
Energy: 1.4493024171207989
Energy: 1.8801169757810396
Energy: 1.588795445541739
Energy: 1.880116975779988
Energy: 1.5857693184502286
Energy: 1.5685151682354692
Energy: 1.4448207274626201
Energy: 1.5685151682344176
Energy: 1.5857693184502286
Energy: 1.5685151682344176
Energy: 1.427458077820326
Energy: 1.810914090436259
Energy: 1.5510713208217233
Energy: 1.8109140904404661
Energy: 1.427458077820326
Energy: 1.8109140904404661
Energy: 1.5749863622675524
Energy: 1.5652630157277514
Energy: 1.5604451768249021
Energy: 1.565263015721441
Energy: 1.5749863622665006
Energy: 1.5652630157203893
Energy: 1.4417175294172946
Energy: 1.5621277527415314
Energy: 1.5509127158468488
Energy: 1.562127752743635
Energy: 1.4417175294172946
Energy: 1.562127752743635
Energy: 1.4186536723592529
Energy: 1.8109392938430926
Energy: 1.5597892116741208
Energy: 1.810939293842041
Energy: 1.4186536723592529
Energy: 1.810939293842041
Energy: 1.4187384738821738
Energy: 1.5741280002144147
Energy: 1.4493580170384222
Energy: 1.5741280002133629
Energy: 1.4187384738821738
Energy: 1.5741280002133629
Energy: 1.593838121749313
Energy: 1.8811393920768265
Energy: 1.4549524952843502
Energy: 1.8811393920747232
Energy: 1.5938381217482613
Energy: 1.8811393920747232
Energy: 1.578790671972395
Energy: 1.8815312632613006
Energy: 1.4492405448507837
Energy: 1.881531263260249
Energy: 1.578790671972395
Energy: 1.881531263260249
Energy: 1.4183161204919332
Energy: 1.5731454001655305
Energy: 1.4491786194226044
Energy: 1.573145400166582
Energy: 1.4183161204908816
Energy: 1.573145400166582
Energy: 1.4185660006489271
Energy: 1.8100800587032504
Energy: 1.5577476930095673
Energy: 1.8100800587021986
Energy: 1.4185660006489271
Energy: 1.8100800587021986

minimum gb energy = 1.4183161204908816 eV
minimum distance =  2.27400575157527 Angstroms
sigma value = 43


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

Energy: 1.640390443765127
Energy: 2.066796662994193
Energy: 1.6216007728399342
Energy: 2.066796662994193
Energy: 1.640390443765127
Energy: 2.066796662994193
Energy: 1.5435232393767175
Energy: 1.5067432437917039
Energy: 1.4803722925696563
Energy: 1.5067432437917039
Energy: 1.5435232393767175
Energy: 1.5067432437917039
Energy: 1.4798202935319356
Energy: 1.6203103997697454
Energy: 1.5907980486650852
Energy: 1.6203103997697454
Energy: 1.4798202935319356
Energy: 1.6203103997705117
Energy: 1.6895577916030562
Energy: 2.0449565140226253
Energy: 1.5955772804491577
Energy: 2.0449565140226253
Energy: 1.6895577916030562
Energy: 2.0449565140226253
Energy: 1.4791985244584906
Energy: 1.5734175062998044
Energy: 1.610656460286734
Energy: 1.5734175062998044
Energy: 1.4791985244584906
Energy: 1.5734175062998044
Energy: 1.5823068259433966
Energy: 1.5885254142515521
Energy: 1.4902520147378495
Energy: 1.5885254142507856
Energy: 1.5823068259426303
Energy: 1.5885254142507856
Energy: 1.4907564989315838
Energy: 1.5891987278481874
Energy: 1.5068926255003607
Energy: 1.5891987278489539
Energy: 1.4907564989315838
Energy: 1.5891987278489539
Energy: 1.6244391955468778
Energy: 1.573707953177902
Energy: 1.4797916323613407
Energy: 1.573707953177902
Energy: 1.6244391955468778
Energy: 1.573707953177902
Energy: 1.5975116187900027
Energy: 2.0458626561705975
Energy: 1.6222910721528632
Energy: 2.045862656171364
Energy: 1.5975116187900027
Energy: 2.0458626561698314
Energy: 1.7462954483428248
Energy: 1.6224383819150765
Energy: 1.4834766757223579
Energy: 1.6224383819150765
Energy: 1.7462954483489554
Energy: 1.6224383819150765
Energy: 1.482002877834005
Energy: 1.5441311917358427
Energy: 1.8697253947071464
Energy: 1.5441311917358427
Energy: 1.4820028778332388
Energy: 1.5441311917358427
Energy: 1.5074062950089901
Energy: 1.8977643710007603
Energy: 1.6456310657338564
Energy: 1.8977643710007603
Energy: 1.5074062950082239
Energy: 1.8977643710015266
Energy: 1.4797717244123172
Energy: 1.5093489471606572
Energy: 1.6228043841834556
Energy: 1.5093489471614234
Energy: 1.4797717244123172
Energy: 1.5093489471614234
Energy: 1.595230022087085
Energy: 1.7752737264540248
Energy: 1.4834798825122166
Energy: 1.7752737264540248
Energy: 1.595230022087085
Energy: 1.7752737264540248
Energy: 1.5945570309637183
Energy: 1.8888336266364707
Energy: 1.5041783464207483
Energy: 1.8888336266372368
Energy: 1.5945570309629518
Energy: 1.8888336266372368
Energy: 1.5816391427273155
Energy: 1.6198139421626163
Energy: 1.4780823044256997
Energy: 1.6198139421633826
Energy: 1.5816391427273155
Energy: 1.6198139421633826
Energy: 1.4887707658680238
Energy: 1.4903033435215696
Energy: 1.5814981205518213
Energy: 1.4903033435215696
Energy: 1.4887707658680238
Energy: 1.4903033435215696
Energy: 1.5098332844388762
Energy: 1.5906272367374983
Energy: 1.4885687492765125
Energy: 1.5906272367367322
Energy: 1.5098332844388762
Energy: 1.5906272367374983
Energy: 1.504067994062137
Energy: 1.5083128755512862
Energy: 1.5916642801140701
Energy: 1.50831287555052
Energy: 1.5040679940629034
Energy: 1.5083128755512862
Energy: 1.4795643076200993
Energy: 1.8606381073774607
Energy: 1.5946303060820326
Energy: 1.8606381073774607
Energy: 1.4795643076200993
Energy: 1.8606381073774607
Energy: 1.479473193270575
Energy: 1.6233390510355867
Energy: 1.507333229206674
Energy: 1.6233390510355867
Energy: 1.4794731932713414
Energy: 1.6233390510355867
Energy: 2.1348231341699777
Energy: 1.480782672925909
Energy: 1.4796087325220824
Energy: 1.4807826729266755
Energy: 2.1348231341699777
Energy: 1.480782672925909
Energy: 2.133467278564411
Energy: 1.4767268229529469
Energy: 1.506787567647341
Energy: 1.4767268229491153
Energy: 2.133467278564411
Energy: 1.4767268229475827
Energy: 1.4793830962394583
Energy: 1.624966934012753
Energy: 1.5062303834268547
Energy: 1.6249669340119868
Energy: 1.4793830962394583
Energy: 1.6249669340119868
Energy: 1.4797149418189546
Energy: 1.624210688554663
Energy: 1.5950334101382113
Energy: 1.6242106885554293
Energy: 1.4797149418189546
Energy: 1.624210688554663
Energy: 1.5040710925211072
Energy: 1.6608160437380346
Energy: 1.5948060468013086
Energy: 1.6608160437380346
Energy: 1.5040710925211072
Energy: 1.660816043738801
Energy: 1.5059056323336057
Energy: 1.6209634695018142
Energy: 1.5892365633901089
Energy: 1.6209634695025803
Energy: 1.5059056323336057
Energy: 1.6209634695018142
Energy: 1.5891415611665134
Energy: 1.609089226827358
Energy: 1.5893148814256695
Energy: 1.6090892268265917
Energy: 1.58914156116728
Energy: 1.609089226827358
Energy: 1.5892312485108369
Energy: 1.6207414653701415
Energy: 1.48538308388932
Energy: 1.6207414653693755
Energy: 1.5892312485108369
Energy: 1.6207414653693755
Energy: 1.5950622259740848
Energy: 1.6638990527035817
Energy: 1.5041621466267179
Energy: 1.6638990527035817
Energy: 1.5950622259740848
Energy: 1.6638990527035817
Energy: 1.5949936064453816
Energy: 1.6239939522845896
Energy: 1.4796563720307838
Energy: 1.6239939522838234
Energy: 1.5949936064453816
Energy: 1.6239939522838234
Energy: 1.506154232967841
Energy: 1.6249317428894976
Energy: 1.4794668483675117
Energy: 1.6249317428894976
Energy: 1.5061542329685724
Energy: 1.6249317428902637
Energy: 1.507261076660688
Energy: 1.4767735965492368
Energy: 1.881511235592922
Energy: 1.4767735965507691
Energy: 1.507261076660688
Energy: 1.4767735965500028
Energy: 1.4796817533435462
Energy: 1.4802392823303119
Energy: 2.134814359159952
Energy: 1.4802392823318447
Energy: 1.4796817533435462
Energy: 1.4802392823303119
Energy: 1.507296532197916
Energy: 1.6234175887930322
Energy: 1.4794099045397962
Energy: 1.6234175887930322
Energy: 1.507296532197916
Energy: 1.6234175887930322
Energy: 1.5947766307890798
Energy: 1.860418515422566
Energy: 1.47928611964515
Energy: 1.860418515422566
Energy: 1.5947766307890798
Energy: 1.860418515422566

minimum gb energy = 1.4767268229475827 eV
minimum distance =  2.23065113628776 Angstroms
sigma value = 81


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

Energy: 1.5404915651865556
Energy: 1.542265195417922
Energy: 1.7176584029429556
Energy: 1.542265195417922
Energy: 1.5404915651868116
Energy: 1.542265195417922
Energy: 1.5407348449060074
Energy: 1.5412943422238734
Energy: 1.5405162437170223
Energy: 1.5412943422238734
Energy: 1.5407348444683646
Energy: 1.5412943422232976
Energy: 1.5405045730534295
Energy: 1.5415549837182785
Energy: 1.513483658133326
Energy: 1.5415549837179905
Energy: 1.5405045730534295
Energy: 1.5415549837177025
Energy: 1.7205527924073651
Energy: 1.542265195417922
Energy: 1.5404915651868116
Energy: 1.542265195417666
Energy: 1.7205527924073651
Energy: 1.542265195417922
Energy: 1.5405162437172784
Energy: 1.5412943422241614
Energy: 1.5407348451731107
Energy: 1.5412943422230094
Energy: 1.5405162437170223
Energy: 1.5412943422235854
Energy: 1.5407944156725837
Energy: 1.5415549837179905
Energy: 1.5405045730531415
Energy: 1.5415549837179905
Energy: 1.5407944156728715
Energy: 1.5415549837179905
Energy: 1.5404915651865556
Energy: 1.542265195417922
Energy: 1.7205527924065331
Energy: 1.542265195417922
Energy: 1.5404915651868116
Energy: 1.54226519541821
Energy: 1.5407348456574677
Energy: 1.5412943422238734
Energy: 1.5405162437172784
Energy: 1.5412943422238734
Energy: 1.5407348457990182
Energy: 1.5412943422235854
Energy: 1.5405045730534295
Energy: 1.5415549837179905
Energy: 1.5407944156725837
Energy: 1.5415549837179905
Energy: 1.5405045730531415
Energy: 1.5415549837182785
Energy: 1.7205527924079411
Energy: 1.542265195417922
Energy: 1.5404915651868116
Energy: 1.542265195417666
Energy: 1.7205527924073651
Energy: 1.5422651954173783

minimum gb energy = 1.513483658133326 eV
minimum distance =  2.29847787473541 Angstroms
sigma value = 3


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

Energy: 1.9725033841967559
Energy: 1.9671405551256436
Energy: 1.48116974179005
Energy: 1.9671405551273287
Energy: 1.9725033841967559
Energy: 1.9671405551264862
Energy: 1.9251468707225672
Energy: 1.508862768817558
Energy: 1.4450862664019348
Energy: 1.5088627688150302
Energy: 1.9251468707234096
Energy: 1.508862768815873
Energy: 1.4798206816697017
Energy: 1.4806779660318976
Energy: 1.8455048406073595
Energy: 1.4806779660302123
Energy: 1.479820681668859
Energy: 1.4806779660293699
Energy: 1.8368274844795227
Energy: 1.9614755403748496
Energy: 1.4979508835784667
Energy: 1.9614755403748496
Energy: 1.8368274844778376
Energy: 1.9614755403748496
Energy: 1.4795242890384557
Energy: 1.4772358703647326
Energy: 1.7039861496608144
Energy: 1.4772358703647326
Energy: 1.4795242890376132
Energy: 1.477235870365575
Energy: 1.7101854215938517
Energy: 1.5661801597446325
Energy: 1.4482946694776533
Energy: 1.5661801597454752
Energy: 1.7101854215938517
Energy: 1.5661801597454752
Energy: 1.4796953359186662
Energy: 1.4774791364447486
Energy: 1.5151426139033304
Energy: 1.4774791364430635
Energy: 1.4796953359186662
Energy: 1.4774791364430635
Energy: 1.4806713312593218
Energy: 1.9612320905075113
Energy: 1.503113767724793
Energy: 1.9612320905075113
Energy: 1.4806713312593218
Energy: 1.9612320905075113
Energy: 1.4813800787388094
Energy: 1.8359771101064641
Energy: 1.9578753478284285
Energy: 1.8359771101073068
Energy: 1.4813800787396518
Energy: 1.8359771101073068
Energy: 1.4818499060468455
Energy: 1.5097353499510475
Energy: 1.4462852597425093
Energy: 1.5097353499510475
Energy: 1.4818499060468455
Energy: 1.50973534995189
Energy: 1.9549184956201007
Energy: 1.5753107462320524
Energy: 1.5124305873704644
Energy: 1.5753107462312097
Energy: 1.9549184956201007
Energy: 1.5753107462312097
Energy: 1.9549523329885312
Energy: 1.5621382829239716
Energy: 1.4457203062256503
Energy: 1.5621382829231287
Energy: 1.954952332989374
Energy: 1.5621382829222863
Energy: 1.4817193494334269
Energy: 1.5992636577932235
Energy: 1.4459852643548607
Energy: 1.5992636577940662
Energy: 1.4817193494334269
Energy: 1.5992636577949089
Energy: 1.4815219642243511
Energy: 1.8109912063446696
Energy: 1.5022617373411578
Energy: 1.8109912063455122
Energy: 1.4815219642235085
Energy: 1.8109912063455122
Energy: 1.4806018928965468
Energy: 1.574110218969805
Energy: 1.5004440374482597
Energy: 1.5741102189723328
Energy: 1.4806018928973894
Energy: 1.5741102189714902
Energy: 1.480934989191074
Energy: 1.509675443654391
Energy: 1.4457722497510672
Energy: 1.5096754436535487
Energy: 1.480934989191074
Energy: 1.5096754436535487
Energy: 1.4812244130046357
Energy: 1.5100922430867756
Energy: 1.4459175721116344
Energy: 1.5100922430893033
Energy: 1.4812244130054786
Energy: 1.510092243090146
Energy: 1.4807538865420053
Energy: 1.5959817047110942
Energy: 1.5004409545949224
Energy: 1.595981704713622
Energy: 1.4807538865420053
Energy: 1.5959817047144644
Energy: 1.4814807931582423
Energy: 1.8109698769212648
Energy: 1.5021796975790216
Energy: 1.8109698769195794
Energy: 1.4814807931582423
Energy: 1.8109698769195794
Energy: 1.4816975017471787
Energy: 1.511423446485113
Energy: 1.4459654664687818
Energy: 1.511423446487641
Energy: 1.4816975017471787
Energy: 1.5114234464884835
Energy: 1.9549253784291383
Energy: 1.764065608877122
Energy: 1.4456665752496174
Energy: 1.764065608877122
Energy: 1.9549253784308234
Energy: 1.764065608877122
Energy: 1.956211163130906
Energy: 1.5744730359614894
Energy: 1.512436350090528
Energy: 1.5744730359589616
Energy: 1.956211163130906
Energy: 1.5744730359598043
Energy: 1.4817752330108875
Energy: 1.5098354869864041
Energy: 1.4465253663525057
Energy: 1.509835486984719
Energy: 1.4817752330108875
Energy: 1.5098354869838766
Energy: 1.4814103462213895
Energy: 1.4797928108653216
Energy: 1.9580671765608264
Energy: 1.479792810866164
Energy: 1.4814103462213895
Energy: 1.479792810866164
Energy: 1.4809840718939375
Energy: 1.5958395273452954
Energy: 1.5043395384404186
Energy: 1.5958395273427677
Energy: 1.4809840718939375
Energy: 1.5958395273436103
Energy: 1.4823754786867163
Energy: 1.8441392451418022
Energy: 1.56609233952784
Energy: 1.8441392451418022
Energy: 1.4823754786867163
Energy: 1.8441392451426448
Energy: 1.48110112437981
Energy: 1.8883698383344432
Energy: 1.448241857697713
Energy: 1.8883698383361283
Energy: 1.48110112437981
Energy: 1.8883698383361283
Energy: 1.4822858692380272
Energy: 1.573181697437748
Energy: 1.9579676567658835
Energy: 1.573181697437748
Energy: 1.4822858692380272
Energy: 1.5731816974385904
Energy: 1.6007613691885174
Energy: 1.810133702114473
Energy: 1.5000477255959135
Energy: 1.8101337021153154
Energy: 1.6007613691885174
Energy: 1.810133702114473
Energy: 1.4800225350374878
Energy: 1.480874367557785
Energy: 1.703267982326125
Energy: 1.4808743675560996
Energy: 1.4800225350374878
Energy: 1.4808743675569422
Energy: 1.925321701778663
Energy: 1.5089949665696702
Energy: 1.446866059921347
Energy: 1.508994966567985
Energy: 1.925321701778663
Energy: 1.508994966567985
Energy: 1.954720970247274
Energy: 1.9669477557240223
Energy: 1.5136723259366234
Energy: 1.9669477557240223
Energy: 1.9547209702481165
Energy: 1.9669477557257076
Energy: 1.9252857590454922
Energy: 1.508670434099358
Energy: 1.4447181896911798
Energy: 1.5086704340968302
Energy: 1.9252857590454922
Energy: 1.5086704340968302

minimum gb energy = 1.4447181896911798 eV
minimum distance =  2.25587603008464 Angstroms
sigma value = 67


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

Energy: 1.4383498171579923
Energy: 2.0426179539423868
Energy: 1.4191647133589862
Energy: 2.042617953943587
Energy: 1.4383498171579923
Energy: 2.042617953941186
Energy: 2.0357332344612793
Energy: 1.413444916808603
Energy: 1.3910143854773604
Energy: 1.4134449168098038
Energy: 2.0357332344624792
Energy: 1.4134449168098038
Energy: 1.3959739215023943
Energy: 1.5154880152860402
Energy: 1.7183234073314795
Energy: 1.5154880152860402
Energy: 1.3959739215023943
Energy: 1.5154880152848396
Energy: 2.086134811128932
Energy: 1.8023430119063555
Energy: 1.3888033336829184
Energy: 1.8023430119063555
Energy: 2.086134811130132
Energy: 1.8023430119063555
Energy: 1.391282720250997
Energy: 2.076186789380462
Energy: 1.7441918197541737
Energy: 2.076186789381663
Energy: 1.391282720250997
Energy: 2.076186789380462
Energy: 1.3924722276169628
Energy: 1.9050148031627594
Energy: 1.392033954608945
Energy: 1.90501480316396
Energy: 1.3924722276169628
Energy: 1.9050148031627594
Energy: 1.3958792066700112
Energy: 1.4131395229113775
Energy: 1.4231300778526585
Energy: 1.4131395229125778
Energy: 1.3958792066700112
Energy: 1.4131395229113775
Energy: 1.415769772032223
Energy: 1.7747095206193377
Energy: 2.0349785574569186
Energy: 1.7747095206193377
Energy: 1.415769772032223
Energy: 1.7747095206205383
Energy: 1.420993833676571
Energy: 1.462946017473486
Energy: 2.041656418184245
Energy: 1.462946017473486
Energy: 1.420993833676571
Energy: 1.462946017473486
Energy: 1.4155427619911745
Energy: 1.4138051791560233
Energy: 1.4207780613777758
Energy: 1.4138051791560233
Energy: 1.415542761989974
Energy: 1.4138051791560233
Energy: 1.3979184428019409
Energy: 1.413361899800053
Energy: 1.4230008301215538
Energy: 1.4133618998012536
Energy: 1.3979184428019409
Energy: 1.413361899800053
Energy: 1.392517543685693
Energy: 1.4677057429195193
Energy: 1.3923693399652588
Energy: 1.4677057429207196
Energy: 1.392517543685693
Energy: 1.4677057429207196
Energy: 1.4230926854140906
Energy: 1.4141698854195985
Energy: 1.3982252231304335
Energy: 1.4141698854171971
Energy: 1.423092685415291
Energy: 1.4141698854232003
Energy: 1.4207918760404485
Energy: 1.41408917783185
Energy: 1.4156026400691424
Energy: 1.41408917783185
Energy: 1.4207918760404485
Energy: 1.41408917783185
Energy: 2.0416401435596168
Energy: 1.4631273925243269
Energy: 1.4210074605155862
Energy: 1.4631273925255277
Energy: 2.0416401435596168
Energy: 1.4631273925243269
Energy: 2.035005119663597
Energy: 1.7746845637805853
Energy: 1.4157056871257023
Energy: 1.7746845637817856
Energy: 2.035005119663597
Energy: 1.7746845637817856
Energy: 1.4231429887989724
Energy: 1.4133780088227104
Energy: 1.4144315669790561
Energy: 1.4133780088227104
Energy: 1.4231429887989724
Energy: 1.4133780088227104
Energy: 1.3920396652917508
Energy: 1.9052122065353125
Energy: 1.3923380011862487
Energy: 1.9052122065353125
Energy: 1.3920396652917508
Energy: 1.9052122065353125
Energy: 1.744165689797149
Energy: 2.0761276412492005
Energy: 1.3912949568544812
Energy: 2.0761276412492005
Energy: 1.74416568979835
Energy: 2.0761276412480005
Energy: 1.3888348607092333
Energy: 1.804297117131329
Energy: 2.0860780706199074
Energy: 1.804297117131329
Energy: 1.3888348607092333
Energy: 1.804297117131329
Energy: 1.7181665348544455
Energy: 1.5154880152848396
Energy: 1.4148816918935032
Energy: 1.5154880152848396
Energy: 1.7181665348556463
Energy: 1.5154880152860402
Energy: 1.3910437159672104
Energy: 1.4134396651153764
Energy: 2.035411110575221
Energy: 1.4134396651153764
Energy: 1.3910437159672104
Energy: 1.4134396651153764
Energy: 1.4595454728740636
Energy: 2.042617953943587
Energy: 1.4383498171591926
Energy: 2.042617953944788
Energy: 1.4595454728740636
Energy: 2.042617953944788

minimum gb energy = 1.3888033336829184 eV
minimum distance =  2.23040063452303 Angstroms
sigma value = 33


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

Energy: 1.7349659438445655
Energy: 1.3429420452316718
Energy: 2.0480197131779017
Energy: 1.342942045229387
Energy: 1.7349659438445655
Energy: 1.342942045229387
Energy: 2.0082612364411467
Energy: 1.7306123750464284
Energy: 1.3102521804096703
Energy: 1.7306123750464284
Energy: 2.008261236440385
Energy: 1.7306123750464284
Energy: 1.3125401505401466
Energy: 1.4078495477740982
Energy: 1.964591127727848
Energy: 1.4078495477740982
Energy: 1.3125401505401466
Energy: 1.40784954777486
Energy: 1.407908430645457
Energy: 1.6966786327877508
Energy: 1.3206321894769033
Energy: 1.6966786327877508
Energy: 1.4079084306462188
Energy: 1.6966786327877508
Energy: 1.687940528859335
Energy: 1.775521625995375
Energy: 1.687407108653224
Energy: 1.775521625995375
Energy: 1.6879405288600966
Energy: 1.7755216259946134
Energy: 1.6868759134512779
Energy: 1.4447652178188644
Energy: 1.3165840068357435
Energy: 1.4447652178188644
Energy: 1.6868759134512779
Energy: 1.5480576413646738
Energy: 1.3133073968916373
Energy: 1.3382868562478252
Energy: 1.342930193294698
Energy: 1.3382868562478252
Energy: 1.3133073968923992
Energy: 1.3382868562478252
Energy: 1.338600405628325
Energy: 1.309364714543099
Energy: 1.6870137751930432
Energy: 1.3093647145438605
Energy: 1.338600405628325
Energy: 1.3093647145423373
Energy: 1.6932703333233057
Energy: 1.5845221703257442
Energy: 1.6895523339649883
Energy: 1.5845221703257442
Energy: 1.6932703333233057
Energy: 1.5845221703257442
Energy: 1.320710622813072
Energy: 1.338963006477561
Energy: 1.3151099700246367
Energy: 1.537322831151285
Energy: 1.320710622813072
Energy: 1.338963006477561
Energy: 1.3138531520765275
Energy: 1.338906066277132
Energy: 1.341199702870454
Energy: 1.3389060662794168
Energy: 1.3138531520772894
Energy: 1.3389060662786552
Energy: 1.3108226601761774
Energy: 1.3933998345447027
Energy: 2.073989408920181
Energy: 1.3933998345447027
Energy: 1.3108226601761774
Energy: 1.3933998345447027
Energy: 1.7197552693864175
Energy: 1.7789618179995175
Energy: 1.7220219782992088
Energy: 1.7789618179995175
Energy: 1.7197552693864175
Energy: 1.7789618179995175
Energy: 1.3106649780059498
Energy: 1.7308832517384314
Energy: 1.3208459207173966
Energy: 1.7308832517384314
Energy: 1.3106649780052229
Energy: 1.7308832517391928
Energy: 1.6878074213278607
Energy: 1.4059898228687246
Energy: 1.3101407654070194
Energy: 1.4059898228687246
Energy: 1.6878074213263374
Energy: 1.4059898228687246
Energy: 1.320389860170696
Energy: 1.6958584789318516
Energy: 2.0398800619115445
Energy: 1.6958584789326132
Energy: 1.3203898601714574
Energy: 1.6958584789318516
Energy: 1.7141045365303196
Energy: 1.7748507855878795
Energy: 1.701000399705919
Energy: 1.7748507855878795
Energy: 1.7141045365303196
Energy: 1.7748507855871178
Energy: 1.3101348819144718
Energy: 1.3390985055622902
Energy: 1.8873555217439746
Energy: 1.3390985055622902
Energy: 1.3101348819144718
Energy: 1.3390985055622902
Energy: 1.6985771416106275
Energy: 1.3394744052011194
Energy: 1.3102144917620437
Energy: 1.3394744052011194
Energy: 1.6985771416113888
Energy: 1.3394744052003578
Energy: 1.6919178961516188
Energy: 1.7745560539123753
Energy: 1.339056077279865
Energy: 1.7745560539131366
Energy: 1.6919178961516188
Energy: 1.7745560539131366
Energy: 2.0400947572983537
Energy: 1.5676673678362545
Energy: 1.3207799690744269
Energy: 1.5676673678362545
Energy: 2.0400947572983537
Energy: 1.5676673678362545
Energy: 1.3105024205678455
Energy: 1.3396753857170403
Energy: 1.6875226684249962
Energy: 1.3396753857162786
Energy: 1.3105024205678455
Energy: 1.3396753857155168
Energy: 1.345500701134701
Energy: 1.3385049683548766
Energy: 1.3110834997723466
Energy: 1.338504968354115
Energy: 1.345500701134701
Energy: 1.3385049683548766
Energy: 1.7185902669587467
Energy: 1.5683286080949992
Energy: 1.309732264773537
Energy: 1.5683286080949992
Energy: 1.7185902669587467
Energy: 1.5683286080949992
Energy: 2.0756523361392047
Energy: 1.3922555148590654
Energy: 1.3146110434154041
Energy: 1.3922555148590654
Energy: 2.0756523361384427
Energy: 1.3922555148590654
Energy: 1.3455395656907558
Energy: 1.8562924603279782
Energy: 1.3114374186707294
Energy: 1.8562924603279782
Energy: 1.3455395656899942
Energy: 1.8562924603279782
Energy: 1.3130793843130666
Energy: 1.3387617235605704
Energy: 1.6875546631124099
Energy: 1.3387617235605704
Energy: 1.3130793843138284
Energy: 1.3387617235598088
Energy: 1.6865298318146087
Energy: 1.5752661600306146
Energy: 1.3204183858084841
Energy: 1.5752661600313764
Energy: 1.686529831813847
Energy: 1.5752661600313764
Energy: 1.6880780327583886
Energy: 1.309666810745373
Energy: 1.3385750964981735
Energy: 1.3096668107499427
Energy: 1.6880780327583886
Energy: 1.3096668107415645
Energy: 1.338890553412596
Energy: 1.3391885952766753
Energy: 1.3104854861395159
Energy: 1.3391885952766753
Energy: 1.3388905534133575
Energy: 1.3391885952766753
Energy: 1.3124324639497131
Energy: 1.550259859560654
Energy: 2.0401420579367753
Energy: 1.5502598595598927
Energy: 1.3124324639497131
Energy: 1.5502598595598927
Energy: 1.6882328144413064
Energy: 2.1289678511290924
Energy: 1.6916643546329064
Energy: 2.1289678511290924
Energy: 1.6882328144413064
Energy: 2.1289678511283308
Energy: 1.320144433234561
Energy: 1.6959479958741772
Energy: 1.758602455556848
Energy: 1.6959479958741772
Energy: 1.3201444332337993
Energy: 1.6959479958734156
Energy: 1.965161203079548
Energy: 1.4067140900713972
Energy: 1.310216391086136
Energy: 1.4067140900713972
Energy: 1.965161203079548
Energy: 1.4067140900713972
Energy: 1.310469486321958
Energy: 1.7304459050400331
Energy: 1.8653075222372197
Energy: 1.7304459050400331
Energy: 1.310469486321958
Energy: 1.7304459050400331
Energy: 1.7199527342923187
Energy: 1.7785972490085293
Energy: 1.7266251384750078
Energy: 1.7785972490085293
Energy: 1.7199527342923187
Energy: 1.7785972490085293
Energy: 1.3105663014034674
Energy: 1.9270959785176363
Energy: 2.07857166211815
Energy: 1.9270959785176363
Energy: 1.3105663014034674
Energy: 1.9270959785176363

minimum gb energy = 1.3093647145423373 eV
minimum distance =  2.20581767163305 Angstroms
sigma value = 41


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

Energy: 1.1023101426841686
Energy: 1.0801694994970075
Energy: 2.178042760198551
Energy: 1.0801694994990867
Energy: 1.1023101426841686
Energy: 1.0801694994990867
Energy: 1.9993407986915337
Energy: 1.0767329130291963
Energy: 1.0768857943553505
Energy: 1.0767329130271166
Energy: 1.9993407986936131
Energy: 1.0767329130291963
Energy: 1.1040142023703574
Energy: 1.3347231700239173
Energy: 1.0809435555280875
Energy: 1.3347231700218376
Energy: 1.1040142023703574
Energy: 1.3347231700218376
Energy: 1.992427252725973
Energy: 1.0767952006654948
Energy: 1.0773828237786778
Energy: 1.0767952006675743
Energy: 1.9924272527218143
Energy: 1.0767952006675743
Energy: 1.1042501201838846
Energy: 1.6684134145057363
Energy: 1.0805347671843946
Energy: 1.6684134145078158
Energy: 1.1042501201838846
Energy: 1.6684134145057363
Energy: 1.1026293322383969
Energy: 1.125085387685463
Energy: 1.0777902896111988
Energy: 1.125085387685463
Energy: 1.1026293322383969
Energy: 1.125085387685463
Energy: 1.9913702594272702
Energy: 1.0794559136798576
Energy: 1.0807017655145725
Energy: 1.079455913681937
Energy: 1.9913702594272702
Energy: 1.079455913681937
Energy: 1.1020070210030062
Energy: 1.0774851237079333
Energy: 1.0785008136783885
Energy: 1.0774851237079333
Energy: 1.1020070210030062
Energy: 1.0774851237079333
Energy: 1.936520911450464
Energy: 1.1264282135368195
Energy: 1.0802430079106633
Energy: 1.1264282135368195
Energy: 1.936520911450464
Energy: 1.1264282135368195
Energy: 1.10216199931598
Energy: 1.6733149948227992
Energy: 1.079577262733035
Energy: 1.6733149948207198
Energy: 1.10216199931598
Energy: 1.6733149948207198
Energy: 1.9462185732463673
Energy: 1.079919629683112
Energy: 1.080067635343495
Energy: 1.0799196296851914
Energy: 1.9462185732463673
Energy: 1.079919629683112
Energy: 1.10242443311893
Energy: 1.3298020240918649
Energy: 1.9322575185233368
Energy: 1.3298020240918649
Energy: 1.10242443311893
Energy: 1.3298020240918649
Energy: 1.9463685403038289
Energy: 1.0797037804378122
Energy: 1.0802095564024252
Energy: 1.0797037804378122
Energy: 1.9463685403038289
Energy: 1.0797037804398915
Energy: 1.1021376470835729
Energy: 1.6710558937179327
Energy: 1.079509190492146
Energy: 1.6710558937179327
Energy: 1.1021376470835729
Energy: 1.671055893715853

minimum gb energy = 1.0767329130271166 eV
minimum distance =  2.25730977117101 Angstroms
sigma value = 11


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

Energy: 1.9279831370231681
Energy: 1.4515304963595403
Energy: 2.0650430462476614
Energy: 1.4515304963595403
Energy: 1.9279831370231681
Energy: 1.4515304963595403
Energy: 1.6815285740221213
Energy: 1.9458686618749335
Energy: 1.449458180291325
Energy: 1.9458686618749335
Energy: 1.6815285740221213
Energy: 1.9458686618749335
Energy: 1.4509201240509406
Energy: 1.5585245089668596
Energy: 1.448730595685992
Energy: 1.5585245089668596
Energy: 1.4509201240518543
Energy: 1.5585245089668596
Energy: 1.4785249630741468
Energy: 1.477502905476636
Energy: 1.4482729269573333
Energy: 1.4775029054775497
Energy: 1.4785249630741468
Energy: 1.477502905476636
Energy: 1.630097283302583
Energy: 1.6257613218666556
Energy: 1.4764241562108116
Energy: 1.6257613218666556
Energy: 1.630097283302583
Energy: 1.625761321867569
Energy: 1.478308127633255
Energy: 1.6400642167477362
Energy: 1.6293726522147396
Energy: 1.6400642167477362
Energy: 1.4783081276323413
Energy: 1.6400642167477362
Energy: 1.4826605782371272
Energy: 1.9538872043598863
Energy: 1.4793101082515816
Energy: 1.9538872043589728
Energy: 1.4826605782371272
Energy: 1.9538872043598863
Energy: 1.4514553438343454
Energy: 1.5073615091517643
Energy: 1.4515778873262037
Energy: 1.5073615091517643
Energy: 1.4514553438343454
Energy: 1.5073615091517643
Energy: 1.6667324935435046
Energy: 1.6077706654328752
Energy: 1.4479821649508913
Energy: 1.6077706654328752
Energy: 1.6667324935435046
Energy: 1.6077706654328752
Energy: 1.4474800282960314
Energy: 1.9816555693856175
Energy: 1.47892344064832
Energy: 1.9816555693856175
Energy: 1.4474800282960314
Energy: 1.9816555693847038
Energy: 1.4695035482984966
Energy: 1.448477463788947
Energy: 1.6477237138141234
Energy: 1.4484774637898605
Energy: 1.4695035482984966
Energy: 1.448477463788947
Energy: 1.4483791247405704
Energy: 1.6361307533068776
Energy: 1.6468650530235924
Energy: 1.636130753305964
Energy: 1.4483791247405704
Energy: 1.6361307533068776
Energy: 1.4490838626034044
Energy: 1.5596653448552646
Energy: 1.6014734852091712
Energy: 1.5596653448543514
Energy: 1.4490838626043179
Energy: 1.5596653448543514
Energy: 1.479553109193475
Energy: 1.607949139443151
Energy: 1.4784958864962812
Energy: 1.607949139443151
Energy: 1.4795531091943885
Energy: 1.607949139443151
Energy: 1.4480695883148258
Energy: 1.774631106377944
Energy: 1.4486805128756841
Energy: 1.774631106377944
Energy: 1.4480695883148258
Energy: 1.774631106377944
Energy: 1.8227384443994685
Energy: 1.9031046756915704
Energy: 1.474851667246332
Energy: 1.9031046756915704
Energy: 1.8227384443985553
Energy: 1.9031046756915704
Energy: 1.479272665360695
Energy: 1.9025284023626936
Energy: 1.4497322087184252
Energy: 1.9025284023626936
Energy: 1.479272665360695
Energy: 1.9025284023626936
Energy: 1.6295681478123971
Energy: 1.7732787248048418
Energy: 1.4478236622277423
Energy: 1.7732787248048418
Energy: 1.6295681478123971
Energy: 1.7732787248039288
Energy: 1.4768703499708904
Energy: 1.4801288322360084
Energy: 1.4775031716018956
Energy: 1.4801288322341815
Energy: 1.4768703499718039
Energy: 1.4801288322360084
Energy: 1.4502562062457582
Energy: 1.5578697819344716
Energy: 1.450130701031178
Energy: 1.5578697819344716
Energy: 1.450256206244845
Energy: 1.5578697819353848
Energy: 1.6463251488512072
Energy: 1.6306731322550854
Energy: 1.449967330153933
Energy: 1.6306731322569123
Energy: 1.6463251488512072
Energy: 1.6306731322550854
Energy: 1.647599024704328
Energy: 1.4479633914602232
Energy: 1.4770064616146117
Energy: 1.4479633914602232
Energy: 1.647599024704328
Energy: 1.4479633914602232
Energy: 1.697667436868142
Energy: 1.946404773081318
Energy: 1.4668688529766674
Energy: 1.9464047730804046
Energy: 1.697667436868142
Energy: 1.9464047730804046
Energy: 1.4486770291567423
Energy: 1.607853916331499
Energy: 1.6671365885585387
Energy: 1.6078539163305858
Energy: 1.4486770291567423
Energy: 1.6078539163305858
Energy: 1.4528272031801925
Energy: 1.5071876375520104
Energy: 1.4504166966792955
Energy: 1.5071876375520104
Energy: 1.4528272031811063
Energy: 1.5071876375520104
Energy: 1.4778634320010535
Energy: 1.7314503803067114
Energy: 1.4808922058864247
Energy: 1.7314503803057977
Energy: 1.4778634320010535
Energy: 1.7314503803057977
Energy: 1.6295851205792362
Energy: 1.6415282197383094
Energy: 1.630121341681612
Energy: 1.6415282197383094
Energy: 1.6295851205792362
Energy: 1.6415282197383094
Energy: 1.4766968322612744
Energy: 1.625889858581387
Energy: 1.4785526710465955
Energy: 1.625889858581387
Energy: 1.4766968322612744
Energy: 1.625889858581387
Energy: 1.4531069838192003
Energy: 1.4774435127421988
Energy: 1.4791288611870985
Energy: 1.4774435127421988
Energy: 1.453106983820114
Energy: 1.4774435127431125
Energy: 1.4501299754844825
Energy: 1.4783690884939875
Energy: 1.4518117278462854
Energy: 1.478369088494901
Energy: 1.4501299754844825
Energy: 1.478369088494901
Energy: 1.4479840880621155
Energy: 1.9457339026507643
Energy: 1.6817646637136894
Energy: 1.945733902651678
Energy: 1.4479840880621155
Energy: 1.945733902651678

minimum gb energy = 1.4474800282960314 eV
minimum distance =  2.21036543861018 Angstroms
sigma value = 57


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

Energy: 1.6319661974222692
Energy: 1.6485305970124031
Energy: 1.7822422796593607
Energy: 1.6485305970124031
Energy: 1.6319661974222692
Energy: 1.6485305970124031
Energy: 1.6008081522609874
Energy: 1.6642312722088142
Energy: 1.5986658051509433
Energy: 1.6696943891209801
Energy: 1.6008081522593618
Energy: 1.6642312722088142
Energy: 1.5988870914800846
Energy: 1.6783659174049588
Energy: 1.5986999555634143
Energy: 1.6783659174033332
Energy: 1.5988870914800846
Energy: 1.6783659174049588
Energy: 1.599244846938898
Energy: 1.7004683317231586
Energy: 1.5991395396762405
Energy: 1.7403186185848893
Energy: 1.599244846938898
Energy: 1.7020127843369472
Energy: 1.5986943766701573
Energy: 1.6783831281699482
Energy: 1.5990606298059005
Energy: 1.6783831281683224
Energy: 1.5986943766701573
Energy: 1.6783831281683224
Energy: 1.5985247485239087
Energy: 1.664219044709464
Energy: 1.600927252870775
Energy: 1.664219044709464
Energy: 1.5985247485239087
Energy: 1.664219044709464
Energy: 1.7813846186881306
Energy: 1.6485305970124031
Energy: 1.6319661974222692
Energy: 1.6485305970124031
Energy: 1.7813846186881306
Energy: 1.6485305970124031
Energy: 1.5986658051509433
Energy: 1.6696943891209801
Energy: 1.6008081522609874
Energy: 1.8617232931557475
Energy: 1.5986658051509433
Energy: 1.6696943891209801
Energy: 1.5986999555634143
Energy: 1.6783659174049588
Energy: 1.5988870914800846
Energy: 1.6783659174049588
Energy: 1.5986999555634143
Energy: 1.6783659174033332
Energy: 1.5991395396762405
Energy: 1.7004683317231586
Energy: 1.599244846938898
Energy: 1.7020127843369472
Energy: 1.5991395396762405
Energy: 1.75348921800828
Energy: 1.5990606298059005
Energy: 1.6783831281699482
Energy: 1.5986943766701573
Energy: 1.6783831281699482
Energy: 1.5990606298059005
Energy: 1.6783831281683224
Energy: 1.600927252870775
Energy: 1.664219044709464
Energy: 1.5985247485255345
Energy: 1.664219044709464
Energy: 1.600927252870775
Energy: 1.664219044709464
Energy: 1.6319661974222692
Energy: 1.6485305970124031
Energy: 1.7813846186881306
Energy: 1.6485305970124031
Energy: 1.6319661974222692
Energy: 1.6485305970124031
Energy: 1.6008081522593618
Energy: 1.6642312722088142
Energy: 1.5986658051509433
Energy: 1.6696943891209801
Energy: 1.6008081522609874
Energy: 1.6642312722088142
Energy: 1.5988870914800846
Energy: 1.6783659174033332
Energy: 1.5986999555634143
Energy: 1.6783659174049588
Energy: 1.5988870914800846
Energy: 1.6783659174049588
Energy: 1.599244846938898
Energy: 1.702012784333696
Energy: 1.5991395396762405
Energy: 1.740318618583264
Energy: 1.599244846938898
Energy: 1.702012784341824
Energy: 1.5986943766701573
Energy: 1.6783831281699482
Energy: 1.5990606298059005
Energy: 1.6783831281683224
Energy: 1.5986943766701573
Energy: 1.6783831281699482

minimum gb energy = 1.5985247485239087 eV
minimum distance =  2.25443122625367 Angstroms
sigma value = 9


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

Energy: 1.6296565831815066
Energy: 1.837094543634014
Energy: 1.758770342914094
Energy: 1.8370945436326869
Energy: 1.6296565831801793
Energy: 1.8370945436326869
Energy: 1.5727780396972688
Energy: 1.7384804107213556
Energy: 1.6615119280282218
Energy: 1.7384804107240104
Energy: 1.5727780396972688
Energy: 1.7384804107240104
Energy: 1.6813462398185388
Energy: 1.810407700951714
Energy: 1.6621510260944614
Energy: 1.8104077009477322
Energy: 1.6813462398185388
Energy: 1.8104077009490596
Energy: 1.6843459357932227
Energy: 1.723044060298417
Energy: 1.589125811649087
Energy: 1.723044060298417
Energy: 1.6843459357918953
Energy: 1.723044060298417
Energy: 1.5744534197393252
Energy: 1.8210368089463127
Energy: 1.662763818847849
Energy: 1.8210368089463127
Energy: 1.5744534197379982
Energy: 1.8210368089463127
Energy: 1.6844817577507079
Energy: 1.7231586281192337
Energy: 1.8501962508802101
Energy: 1.7231586281192337
Energy: 1.6844817577507079
Energy: 1.7231586281192337
Energy: 1.682265383889113
Energy: 1.8102367197894762
Energy: 1.6622191041263077
Energy: 1.8102367197908038
Energy: 1.682265383889113
Energy: 1.8102367197908038
Energy: 1.5748054264316464
Energy: 1.6458600192512596
Energy: 1.6634846124665192
Energy: 1.6458600192512596
Energy: 1.574805426430319
Energy: 1.6458600192499624
Energy: 1.6870134148719003
Energy: 1.795000125373935
Energy: 1.5913946915175605
Energy: 1.795000125375262
Energy: 1.6870134148719003
Energy: 1.795000125375262
Energy: 1.6817338336862409
Energy: 1.8578390227563382
Energy: 1.6728501537302611
Energy: 1.8578390227576655
Energy: 1.6817338336862409
Energy: 1.8578390227576655
Energy: 1.6812780357744443
Energy: 1.7321490784110352
Energy: 1.6471755448442245
Energy: 1.7321490784083806
Energy: 1.6812780357744443
Energy: 1.7321490784083806
Energy: 1.6816190551312278
Energy: 1.8093818994193378
Energy: 1.6422100072029704
Energy: 1.809381899420665
Energy: 1.6816190551312278
Energy: 1.809381899420665
Energy: 1.6810299199438141
Energy: 1.8061373745990044
Energy: 1.6468049827945297
Energy: 1.8061373745976772
Energy: 1.6810299199438141
Energy: 1.8061373745976772
Energy: 1.6819233247337015
Energy: 1.6921287159760647
Energy: 1.5878840300635229
Energy: 1.6921287159720826
Energy: 1.6819233247337015
Energy: 1.6921287159707554
Energy: 1.7582796913911949
Energy: 1.8625141222879098
Energy: 1.6707644245302982
Energy: 1.8625141222905643
Energy: 1.7582796913911949
Energy: 1.8625141222905643
Energy: 1.5728303479930654
Energy: 1.795566013512921
Energy: 1.5883721509972555
Energy: 1.7955660135142482
Energy: 1.5728303479930654
Energy: 1.7955660135142482
Energy: 1.5737477711103884
Energy: 1.7947903788387685
Energy: 1.62106154407593
Energy: 1.7947903788387685
Energy: 1.573747771109061
Energy: 1.7947903788387685
Energy: 1.689866675424322
Energy: 1.8605813547154186
Energy: 1.672834422568708
Energy: 1.8605813547154186
Energy: 1.689866675425649
Energy: 1.8605813547154186
Energy: 1.681320996178014
Energy: 1.7235960094104938
Energy: 1.817921024103325
Energy: 1.7235960094104938
Energy: 1.681320996178014
Energy: 1.7235960094104938
Energy: 1.6839692737682055
Energy: 1.8198636520917502
Energy: 1.67440634896827
Energy: 1.8198636520917502
Energy: 1.6839692737682055
Energy: 1.8198636520917502
Energy: 1.681091436401295
Energy: 1.72427464920338
Energy: 1.6412624333816972
Energy: 1.72427464920338
Energy: 1.681091436401295
Energy: 1.72427464920338

minimum gb energy = 1.5727780396972688 eV
minimum distance =  2.25908363861398 Angstroms
sigma value = 27


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

Energy: 1.8330148542575642
Energy: 1.799876156559873
Energy: 1.8938826849495296
Energy: 1.799876156559873
Energy: 1.8330148542564453
Energy: 1.799876156559873
Energy: 1.688182744321731
Energy: 1.7808705351983165
Energy: 1.600643518515251
Energy: 1.7808705351994352
Energy: 1.688182744321731
Energy: 1.7808705351994352
Energy: 1.6049027385130141
Energy: 1.6050784434853367
Energy: 1.6005174277191674
Energy: 1.6050784434842176
Energy: 1.6049027385130141
Energy: 1.6050784434842176
Energy: 1.6488995191335494
Energy: 1.7973903220896337
Energy: 1.7188168815679616
Energy: 1.7973903220873957
Energy: 1.6488995191324303
Energy: 1.7973903220873957
Energy: 1.5857588274883758
Energy: 1.8279152791565274
Energy: 1.5834193868907798
Energy: 1.8279152791554085
Energy: 1.5857588274883758
Energy: 1.8279152791554085
Energy: 1.643177212591571
Energy: 1.6841614078005107
Energy: 1.6726994197651588
Energy: 1.6841614078016296
Energy: 1.643177212591571
Energy: 1.6841614078005107
Energy: 1.6157387807834047
Energy: 1.7711612656194748
Energy: 1.6736879189798186
Energy: 1.7711612656205937
Energy: 1.6157387807834047
Energy: 1.7711612656205937
Energy: 1.600451422101579
Energy: 1.7536118941618652
Energy: 1.6748138494560536
Energy: 1.7536118941629837
Energy: 1.600451422101579
Energy: 1.7536118941629837
Energy: 1.7199620459571987
Energy: 1.7962938021193304
Energy: 1.9529628095968599
Energy: 1.7962938021193304
Energy: 1.7199620459571987
Energy: 1.796293802120449
Energy: 1.6004524665562945
Energy: 1.799234559174563
Energy: 1.6276576517642942
Energy: 1.7992345591779195
Energy: 1.6004524665562945
Energy: 1.7992345591779195
Energy: 1.6005945988711092
Energy: 1.7889603210251734
Energy: 1.627006625798252
Energy: 1.7889603210240548
Energy: 1.6005945988711092
Energy: 1.7889603210240548
Energy: 1.7200482193863127
Energy: 1.7954756279617636
Energy: 1.7690099525765886
Energy: 1.7954756279606445
Energy: 1.7200482193863127
Energy: 1.7954756279606445
Energy: 1.6007377671815592
Energy: 1.7260719418523858
Energy: 1.6735866639933754
Energy: 1.7260719418535044
Energy: 1.6007377671815592
Energy: 1.7260719418546233
Energy: 1.58564547372202
Energy: 1.7528805351413472
Energy: 1.675261569095283
Energy: 1.752880535142466
Energy: 1.58564547372202
Energy: 1.752880535142466
Energy: 1.654612570734781
Energy: 1.6834495267505667
Energy: 1.6724965930941806
Energy: 1.6834495267505667
Energy: 1.654612570734781
Energy: 1.6834495267505667
Energy: 1.5855388249714892
Energy: 1.8279152791554085
Energy: 1.6450214411297954
Energy: 1.8279152791565274
Energy: 1.5855388249714892
Energy: 1.8279152791565274
Energy: 1.6488812449874768
Energy: 1.8013750399348654
Energy: 1.6148132927567513
Energy: 1.8013750399337465
Energy: 1.6488812449874768
Energy: 1.8013750399348654
Energy: 1.6049230258529474
Energy: 1.6054203338393969
Energy: 1.6007294068033115
Energy: 1.6054203338382782
Energy: 1.604923025854066
Energy: 1.6054203338382782
Energy: 1.6872597620008483
Energy: 1.5949501400916237
Energy: 1.6009683981741758
Energy: 1.5949501400938613
Energy: 1.6872597620008483
Energy: 1.5949501400938613
Energy: 1.8330148542575642
Energy: 1.7998761565587544
Energy: 1.8938826849495296
Energy: 1.7998761565587544
Energy: 1.8330148542575642
Energy: 1.799876156559873
Energy: 1.6881827443228499
Energy: 1.7808705351971978
Energy: 1.600643518515251
Energy: 1.7808705351983165
Energy: 1.688182744321731
Energy: 1.7808705351983165
Energy: 1.6049027385130141
Energy: 1.6050784434864556
Energy: 1.6005174277191674
Energy: 1.6050784434842176
Energy: 1.6049027385130141
Energy: 1.6050784434842176
Energy: 1.6488995191335494
Energy: 1.7973903220896337
Energy: 1.7188168815690803
Energy: 1.797390322086277
Energy: 1.6488995191335494
Energy: 1.797390322086277
Energy: 1.5857588274883758
Energy: 1.8279152791565274
Energy: 1.5834193868896609
Energy: 1.8279152791554085
Energy: 1.5857588274894947
Energy: 1.8279152791554085
Energy: 1.6431772125926898
Energy: 1.6841614078005107
Energy: 1.6726994197651588
Energy: 1.6841614078016296
Energy: 1.6431772125926898
Energy: 1.6841614078005107

minimum gb energy = 1.5834193868896609 eV
minimum distance =  2.25277679815244 Angstroms
sigma value = 19


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

Energy: 1.8460654658351006
Energy: 1.5830916757705589
Energy: 1.7448211323163512
Energy: 1.5830916757705589
Energy: 1.8460654658351006
Energy: 1.5830916757715245
Energy: 1.6388973835924214
Energy: 1.6965190680047562
Energy: 1.5905991971600892
Energy: 1.6965190680037905
Energy: 1.6388973835924214
Energy: 1.6965190680037905
Energy: 1.5536611644663014
Energy: 1.7808303925891726
Energy: 1.5905637833135406
Energy: 1.780830392587241
Energy: 1.5536611644663014
Energy: 1.780830392588207
Energy: 1.625435095168565
Energy: 1.8088104027400398
Energy: 1.5819548003830248
Energy: 1.8088104027390743
Energy: 1.625435095168565
Energy: 1.8088104027390743
Energy: 1.5509516596049646
Energy: 1.7535149592259176
Energy: 1.5562009033631024
Energy: 1.7535149592259176
Energy: 1.5509516596049646
Energy: 1.7535149592259176
Energy: 1.5594474591847207
Energy: 1.7106959550259895
Energy: 1.5736113894098605
Energy: 1.7106959550259895
Energy: 1.5594474591856864
Energy: 1.7106959550259895
Energy: 1.5378935239850888
Energy: 1.75575669120879
Energy: 1.5560551047272646
Energy: 1.75575669120879
Energy: 1.5378935239850888
Energy: 1.75575669120879
Energy: 1.5377043979348144
Energy: 1.7113031479986758
Energy: 1.573287430034955
Energy: 1.7113031479986758
Energy: 1.5377043979348144
Energy: 1.7113031479986758
Energy: 1.5825336200647655
Energy: 1.7391140433246217
Energy: 1.6106856951298065
Energy: 1.7391140433246217
Energy: 1.5825336200647655
Energy: 1.7391140433246217
Energy: 1.5507048943270063
Energy: 1.6484170496517025
Energy: 1.590356737823307
Energy: 1.6484170496517025
Energy: 1.5507048943270063
Energy: 1.6484170496517025
Energy: 1.5374250565479
Energy: 1.7851577759184314
Energy: 1.5909304623656313
Energy: 1.7851577759174655
Energy: 1.5374250565479
Energy: 1.7851577759174655
Energy: 1.5761778994068534
Energy: 1.7698023936757032
Energy: 1.5910306630147142
Energy: 1.769802393676669
Energy: 1.5761778994058877
Energy: 1.769802393676669
Energy: 1.5778777013925995
Energy: 1.5363670539677983
Energy: 1.5906682049747378
Energy: 1.5363670539677983
Energy: 1.5778777013925995
Energy: 1.5363670539677983
Energy: 1.5541538079618895
Energy: 1.7798865778336646
Energy: 1.672654684781418
Energy: 1.7798865778326987
Energy: 1.5541538079618895
Energy: 1.7798865778326987
Energy: 1.5568091016383783
Energy: 1.7393616505770024
Energy: 1.5907524837869178
Energy: 1.739361650576037
Energy: 1.5568091016374124
Energy: 1.739361650576037
Energy: 1.572705268117933
Energy: 1.6784814653819389
Energy: 1.5386752605114116
Energy: 1.6784814653819389
Energy: 1.572705268117933
Energy: 1.6784814653819389
Energy: 1.5537544252725808
Energy: 1.7103446838682435
Energy: 1.553832644101365
Energy: 1.7103446838682435
Energy: 1.5537544252725808
Energy: 1.7103446838682435
Energy: 1.575526234983294
Energy: 1.751499211391364
Energy: 1.5360110346660534
Energy: 1.7514992113903982
Energy: 1.575526234983294
Energy: 1.751499211391364
Energy: 1.553694467051413
Energy: 1.7106884593412979
Energy: 1.5538227913987175
Energy: 1.7106884593412979
Energy: 1.553694467051413
Energy: 1.710688459340332
Energy: 1.5727790198310678
Energy: 1.6768168485977064
Energy: 1.550688189568615
Energy: 1.6768168485977064
Energy: 1.5727790198310678
Energy: 1.6768168485977064
Energy: 1.556688784457188
Energy: 1.7843924405889646
Energy: 1.5910677648847904
Energy: 1.7843924405899305
Energy: 1.5566887844562223
Energy: 1.7843924405889646
Energy: 1.571798620588943
Energy: 1.7331005478957127
Energy: 1.673309545646449
Energy: 1.7331005478976442
Energy: 1.571798620588943
Energy: 1.7331005478966786
Energy: 1.6427493516617486
Energy: 1.778004370460541
Energy: 1.5906383295926
Energy: 1.778004370460541
Energy: 1.6427493516617486
Energy: 1.778004370460541
Energy: 1.6430781258659182
Energy: 1.5671369971412454
Energy: 1.5507781906634004
Energy: 1.5671369971412454
Energy: 1.6430781258659182
Energy: 1.5671369971412454
Energy: 1.655508323990223
Energy: 1.5625661493787175
Energy: 1.5699763932151443
Energy: 1.5625661493777736
Energy: 1.655508323990223
Energy: 1.5625661493777736
Energy: 1.5508414916083275
Energy: 1.6368486107987694
Energy: 1.5903323764623802
Energy: 1.6368486107987694
Energy: 1.5508414916073618
Energy: 1.6368486107987694
Energy: 1.5822469947535105
Energy: 1.6779756311234775
Energy: 1.5791859516046913
Energy: 1.6779756311225116
Energy: 1.5822469947525446
Energy: 1.6779756311225116
Energy: 1.5379237644833277
Energy: 1.71083139753781
Energy: 1.5731744149997333
Energy: 1.7108313975368445
Energy: 1.5379237644833277
Energy: 1.7108313975368445
Energy: 1.537892397225699
Energy: 1.7515895257712195
Energy: 1.5559831362620073
Energy: 1.751589525770254
Energy: 1.537892397225699
Energy: 1.7515895257712195

minimum gb energy = 1.5360110346660534 eV
minimum distance =  2.23463155321395 Angstroms
sigma value = 101


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

Energy: 1.7491841314339953
Energy: 1.563300267724909
Energy: 1.5696442226814755
Energy: 1.563300267725758
Energy: 1.7491841314339953
Energy: 1.563300267725758
Energy: 1.4996467589321771
Energy: 1.6440724330537184
Energy: 1.497503885113177
Energy: 1.6440724330545673
Energy: 1.4996467589313283
Energy: 1.6440724330537184
Energy: 1.484563763019229
Energy: 1.698949585552733
Energy: 1.5176929610482253
Energy: 1.6989495855535819
Energy: 1.484563763019229
Energy: 1.6989495855535819
Energy: 1.5011913168181068
Energy: 1.6738785014791462
Energy: 1.4997958611661195
Energy: 1.67971893804178
Energy: 1.5011913168181068
Energy: 1.4846515670060436
Energy: 1.471450204541551
Energy: 1.6298449840329485
Energy: 1.490139743177279
Energy: 1.6298449840337972
Energy: 1.4714502045424
Energy: 1.6298449840329485
Energy: 1.484336208671048
Energy: 1.6952249797046754
Energy: 1.4711053626137087
Energy: 1.6952249797038264
Energy: 1.484336208671897
Energy: 1.6952249797038264
Energy: 1.4899306519989004
Energy: 1.73609610513468
Energy: 1.471168843849195
Energy: 1.73609610513468
Energy: 1.4899306519989004
Energy: 1.736096105133831
Energy: 1.4836220552978059
Energy: 1.6843885135963903
Energy: 1.486716169333525
Energy: 1.713582154921328
Energy: 1.4836220552969568
Energy: 1.6843885135963903
Energy: 1.470946492230845
Energy: 1.6949826096015985
Energy: 1.485064446753994
Energy: 1.6949826096007494
Energy: 1.470946492230845
Energy: 1.6949826096007494
Energy: 1.4706698739907738
Energy: 1.6939313567996566
Energy: 1.472411745793897
Energy: 1.6939313568005059
Energy: 1.4706698739907738
Energy: 1.6939313568005059
Energy: 1.5098855778688465
Energy: 1.6977449252327397
Energy: 1.5522650351875045
Energy: 1.6977449252335886
Energy: 1.5098855778688465
Energy: 1.6977449252327397
Energy: 1.49737321173855
Energy: 1.561247131469026
Energy: 1.4722096606343598
Energy: 1.561247131469026
Energy: 1.49737321173855
Energy: 1.5612471314681768
Energy: 1.5177438325059551
Energy: 1.4928314895810657
Energy: 1.5915120533499187
Energy: 1.4928314895810657
Energy: 1.5177438325059551
Energy: 1.4928314895810657
Energy: 1.5125468444250005
Energy: 1.4876901758887588
Energy: 1.4974130131815673
Energy: 1.5158035183205674
Energy: 1.5125468444250005
Energy: 1.48769017588791
Energy: 1.481530718493967
Energy: 1.5946110408698615
Energy: 1.497435585679831
Energy: 1.5946110408698615
Energy: 1.4815307184948159
Energy: 1.5946110408690126
Energy: 1.5303751921884334
Energy: 1.6984209321974169
Energy: 1.4835531426379953
Energy: 1.6984209321982655
Energy: 1.5303751921884334
Energy: 1.6984209321974169
Energy: 1.4711731622844642
Energy: 1.7127228867592077
Energy: 1.5012154861995914
Energy: 1.7127228867592077
Energy: 1.4711731622844642
Energy: 1.7127228867600568
Energy: 1.4856847031862888
Energy: 1.6443629183351551
Energy: 1.470476454921596
Energy: 1.644362918336004
Energy: 1.4856847031854397
Energy: 1.644362918336004
Energy: 1.4851709500763477
Energy: 1.6941075687052654
Energy: 1.4847764960933971
Energy: 1.6941075687052654
Energy: 1.4851709500763477
Energy: 1.6941075687052654
Energy: 1.4719560234960272
Energy: 1.7364818041266772
Energy: 1.4703620544645835
Energy: 1.7364818041266772
Energy: 1.4719560234951783
Energy: 1.7364818041266772
Energy: 1.4994037650116079
Energy: 1.6439436127996763
Energy: 1.4842553736084485
Energy: 1.6439436127996763
Energy: 1.4994037650116079
Energy: 1.6439436127996763
Energy: 1.4719155570855231
Energy: 1.6953759942611273
Energy: 1.470581117136041
Energy: 1.6953759942611273
Energy: 1.4719155570855231
Energy: 1.6953759942619764
Energy: 1.4841143177663747
Energy: 1.694002365074227
Energy: 1.4710159134911107
Energy: 1.694002365075076
Energy: 1.4841143177663747
Energy: 1.694002365075076
Energy: 1.5011626321666527
Energy: 1.7199668867718882
Energy: 1.5363084655371628
Energy: 1.7199668867710394
Energy: 1.5011626321666527
Energy: 1.7151628309233327
Energy: 1.4712311065642867
Energy: 1.5665290022591338
Energy: 1.4814588311563106
Energy: 1.5665290022591338
Energy: 1.4712311065634378
Energy: 1.5665290022591338
Energy: 1.4882264417654851
Energy: 1.4736729146320422
Energy: 1.530407947555602
Energy: 1.4736729146320422
Energy: 1.4882264417654851
Energy: 1.4736729146320422
Energy: 1.4973705789033755
Energy: 1.7223497241482018
Energy: 1.4707944367743986
Energy: 1.7223497241482018
Energy: 1.4973705789042244
Energy: 1.7223497241482018
Energy: 1.4974931643076501
Energy: 1.7228066257640067
Energy: 1.4704059060674777
Energy: 1.7228066257640067
Energy: 1.497493164306801
Energy: 1.7228066257640067
Energy: 1.6958346672196336
Energy: 1.471399924102193
Energy: 1.57922640239942
Energy: 1.471399924102193
Energy: 1.6958346672196336
Energy: 1.471399924100495
Energy: 1.470557930312422
Energy: 1.6400676359733206
Energy: 1.4727854562663087
Energy: 1.6400676359724715
Energy: 1.470557930312422
Energy: 1.6400676359724715
Energy: 1.5012036325492097
Energy: 1.6442853109226556
Energy: 1.4836320209704674
Energy: 1.6442853109226556
Energy: 1.5012036325500586
Energy: 1.6442853109226556
Energy: 1.4887736651330343
Energy: 1.6800001093619978
Energy: 1.472117076557536
Energy: 1.6800001093611487
Energy: 1.4887736651321855
Energy: 1.6800001093611487
Energy: 1.47107921204019
Energy: 1.6972492388793101
Energy: 1.484280584783489
Energy: 1.6972492388793101
Energy: 1.47107921204019
Energy: 1.6972492388793101

minimum gb energy = 1.4703620544645835 eV
minimum distance =  2.24625074841693 Angstroms
sigma value = 33


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

Energy: 0.01501585086509739
Energy: 0.015619883299368188
Energy: 1.3657938187684253
Energy: 0.015619883299368188
Energy: 0.01501585086509739
Energy: 0.015619883299368188
Energy: 0.015389147894615665
Energy: 0.8794503430923848
Energy: 0.015389147894615665
Energy: 0.8794503430923848
Energy: 0.015389147894615665
Energy: 0.8794503430923848
Energy: 1.6520900993357277
Energy: 0.015619883299368188
Energy: 0.01501585086509739
Energy: 0.015619883299368188
Energy: 1.6520900993357277
Energy: 0.015619883298662823
Energy: 0.015389147894615665
Energy: 0.8794503430923848
Energy: 0.015389147894615665
Energy: 0.8794503430923848
Energy: 0.015389147894615665
Energy: 0.8794503430923848

minimum gb energy = 0.01501585086509739 eV
minimum distance =  2.46562807978395 Angstroms
sigma value = 1