Model name: model_name=EAM_Dynamo_MendelevSunZhang_2019_CuZr__MO_609260676108_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.639087408781052
cohesive_energy=3.2833744154333835
mass=63.546
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: 0.012534987307622272
Energy: 1.0453856893650997
Energy: 0.012534987307622272
Energy: 1.045385689365409
Energy: 0.012534987307622272
Energy: 1.0453856893650997
Energy: 1.045385689365409
Energy: 0.4247615184972489
Energy: 1.0453856893650997
Energy: 0.42476151849907146
Energy: 1.045385689365409
Energy: 0.424761518498143
Energy: 0.012534987307622272
Energy: 1.0453856893650997
Energy: 0.012534987307622272
Energy: 1.0453856893650997
Energy: 0.012534987307622272
Energy: 1.0453856893650997
Energy: 1.045385689365409
Energy: 0.42476151849907146
Energy: 1.045385689365409
Energy: 0.7385737042136896
Energy: 1.0453856893650997
Energy: 0.915050874507395
Energy: 0.012534987307622272
Energy: 1.045385689365409
Energy: 0.012534987307622272
Energy: 1.045385689365409
Energy: 0.012534987307622272
Energy: 1.0453856893650997
Energy: 1.045385689365409
Energy: 0.9046220381570902
Energy: 1.0453856893650997
Energy: 0.915050874507395
Energy: 1.0453856893648248
Energy: 0.9046220381549926

minimum gb energy = 0.012534987307622272 eV
minimum distance =  2.31363150521343 Angstroms
sigma value = 1


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

Energy: 1.0400209668918579
Energy: 0.9800433489654126
Energy: 0.9842839626162991
Energy: 0.9800433489594532
Energy: 1.0400209668978173
Energy: 0.9800433489587083
Energy: 1.1961578234792916
Energy: 0.913437079296033
Energy: 1.196157821325927
Energy: 0.9134370792937982
Energy: 1.1961578155611952
Energy: 0.9134370792937982
Energy: 1.0193793412071455
Energy: 1.0181605513594705
Energy: 1.0193793412078904
Energy: 1.0181605513550007
Energy: 1.0193793412064005
Energy: 1.0181605513520209
Energy: 1.156452127907078
Energy: 0.9408332250108005
Energy: 1.1564521279011188
Energy: 0.9408332250078207
Energy: 1.1564521279033535
Energy: 0.9408332250078207
Energy: 0.9944965420809605
Energy: 1.058934211853314
Energy: 0.9944965420824503
Energy: 1.0589342118466096
Energy: 0.994496542076491
Energy: 1.0589342118480995
Energy: 1.0738721647050624
Energy: 0.9490429052117195
Energy: 1.0738721647043175
Energy: 0.9490429052139543
Energy: 1.0738721647013376
Energy: 0.9490429052132096
Energy: 0.9644343880981805
Energy: 1.0114404090443798
Energy: 0.9644343880989253
Energy: 1.0114404090369307
Energy: 0.9644343880989253
Energy: 1.0114404090369307
Energy: 0.9449554655817307
Energy: 1.047435010559685
Energy: 0.9449554655772612
Energy: 1.0474350105567052
Energy: 0.9449554655742815
Energy: 1.0474350105559604
Energy: 1.0529763389331326
Energy: 1.026109802104587
Energy: 1.0529763389361124
Energy: 1.0261098021008621
Energy: 1.0529763389405822
Energy: 1.0261098021008621
Energy: 0.8975804694818885
Energy: 1.1133693645329752
Energy: 0.8975804694833784
Energy: 1.1133693645285057
Energy: 0.8975804694818885
Energy: 1.113369364527016
Energy: 0.9958668103784281
Energy: 0.9493799760919085
Energy: 0.9958668103784281
Energy: 0.9493799760956332
Energy: 0.9958668103791729
Energy: 0.9493799760956332
Energy: 0.9279847424284189
Energy: 1.3849447894225848
Energy: 0.9279323658768877
Energy: 1.3849447894166254
Energy: 0.9279847424254393
Energy: 1.384944789421095
Energy: 1.191598122054845
Energy: 0.9174092496988628
Energy: 1.191598122051865
Energy: 0.9174092497048222
Energy: 1.1915981220496303
Energy: 0.9174092497048222
Energy: 0.9622848188393377
Energy: 0.9917147991279
Energy: 0.9622469733824605
Energy: 0.9917147991256652
Energy: 0.9622848188415726
Energy: 0.9917147991234304
Energy: 1.189187040784806
Energy: 0.9327853660270201
Energy: 1.1159644190308748
Energy: 0.9327853660367044
Energy: 1.189187040785551
Energy: 0.9327853660359593
Energy: 1.1966977249618238
Energy: 1.0099493409318316
Energy: 1.1344178060893162
Energy: 1.0099493409281068
Energy: 1.1966977249640587
Energy: 1.0099493409318316
Energy: 1.0190758933214608
Energy: 0.9771463172934448
Energy: 1.0190758933177362
Energy: 0.9771463172986592
Energy: 1.0190758933125215
Energy: 0.9771463172986592
Energy: 1.0190069058134381
Energy: 0.9428232308215823
Energy: 1.0190069058126934
Energy: 0.9428232308215823
Energy: 1.0190069058112035
Energy: 0.9428232308200923
Energy: 0.9079452311477406
Energy: 0.9397484831449084
Energy: 0.9079452311469957
Energy: 0.9397484831449084
Energy: 0.9079452311484855
Energy: 0.9397484831434525
Energy: 1.0660818646175696
Energy: 0.9493295197959798
Energy: 1.066081864622039
Energy: 0.9493295198004493
Energy: 1.0660818646168244
Energy: 0.9493295198011944
Energy: 0.9410485986737868
Energy: 1.0401883057311223
Energy: 0.941048598672297
Energy: 1.0401883055360515
Energy: 0.9410485986693172
Energy: 1.0401883059508097
Energy: 1.0536508273085434
Energy: 1.0287464991083666
Energy: 1.053166435065343
Energy: 1.0287464991106012
Energy: 1.053650827302584
Energy: 1.0287464991106012
Energy: 0.9565637001489625
Energy: 1.2382340810651231
Energy: 0.9565423729508039
Energy: 1.238234081063633
Energy: 0.9565637001519424
Energy: 1.2382340810606534

minimum gb energy = 0.8975804694818885 eV
minimum distance =  2.31107774053345 Angstroms
sigma value = 33


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

Energy: 1.0277379612079427
Energy: 1.0519361074743812
Energy: 0.9893116927676432
Energy: 1.0519361074680253
Energy: 1.0277379612058242
Energy: 1.0519361074680253
Energy: 1.161921745447536
Energy: 0.9450578681598688
Energy: 1.1619217454505022
Energy: 0.9450578681590213
Energy: 1.1619217454534683
Energy: 0.9450578681585976
Energy: 0.9059533339518008
Energy: 0.943962714821073
Energy: 0.9059533339547667
Energy: 0.9439627148164121
Energy: 0.9059533339513772
Energy: 0.9439627148189543
Energy: 1.074628099830629
Energy: 1.067842202347483
Energy: 1.074628099827239
Energy: 1.06784220234028
Energy: 1.0746280998234259
Energy: 1.0678422023398564
Energy: 0.9668142112547338
Energy: 0.9793301383338806
Energy: 0.9668142112551574
Energy: 0.9793301383398128
Energy: 0.9668142112488018
Energy: 0.979330138339389
Energy: 0.9536375465753699
Energy: 0.9059875913490825
Energy: 0.9536375465791833
Energy: 0.9059875913431505
Energy: 0.9536375465821493
Energy: 0.9059875913431505
Energy: 1.1795747349168724
Energy: 0.9888111635236686
Energy: 1.1795747349143688
Energy: 0.9888111635164655
Energy: 1.1795747349143688
Energy: 0.9888111635164655
Energy: 0.8799969747524506
Energy: 1.0272998905999011
Energy: 0.8799969747596539
Energy: 1.0272998906028674
Energy: 0.8799969747630436
Energy: 1.0272998906007487
Energy: 0.9372497061763775
Energy: 0.909362402921833
Energy: 0.9372497061763775
Energy: 0.9093624029252226
Energy: 0.9372497061772247
Energy: 0.9093624029247991
Energy: 0.8917090105309423
Energy: 1.0609710753259827
Energy: 0.891713042277723
Energy: 1.06097107532683
Energy: 0.8917090105271289
Energy: 1.06097107532683
Energy: 1.065853583322199
Energy: 0.8943128772341088
Energy: 1.0658535833340632
Energy: 0.8943128772324137
Energy: 1.065853583368384
Energy: 0.8943128772328376
Energy: 0.9067063056608199
Energy: 0.9640016343061606
Energy: 0.9067045526087063
Energy: 0.9640016342934492
Energy: 0.9067063056574303
Energy: 0.9640016342934492
Energy: 0.9892025233341597
Energy: 0.9028584570981352
Energy: 0.9892025233278041
Energy: 0.9028584570977113
Energy: 0.9892025233290752
Energy: 0.9028584570981352
Energy: 0.9887904655351669
Energy: 1.0492702155348679
Energy: 0.9887904655385567
Energy: 1.049270215537834
Energy: 0.9887904655381329
Energy: 1.0492702155399525
Energy: 0.9745635650891911
Energy: 0.9440421065229768
Energy: 0.9745635650925807
Energy: 0.9440421065217055
Energy: 0.974563565090462
Energy: 0.9440421065234005
Energy: 0.9062878176406193
Energy: 0.9438773664008875
Energy: 0.906287817636806
Energy: 0.9438773664021588
Energy: 0.9062878176376532
Energy: 0.9438773664034299
Energy: 1.096049630071507
Energy: 1.0667939129058497
Energy: 1.096049630071507
Energy: 1.0667939129117814
Energy: 1.0960496300710831
Energy: 1.066793912911358
Energy: 0.9670901391141081
Energy: 0.9060508748295585
Energy: 0.9670901391149557
Energy: 0.9060508748401511
Energy: 0.9670901391124134
Energy: 0.9060508748401511
Energy: 0.9537309842349034
Energy: 0.9587708450589821
Energy: 0.9537309842344797
Energy: 0.9587708450547449
Energy: 0.9537309842306662
Energy: 0.9587708450547449
Energy: 1.0532164639445325
Energy: 0.9925653262753557
Energy: 1.0532164639470747
Energy: 0.9925653262808637
Energy: 1.0532164639462271
Energy: 0.9925653262804401
Energy: 0.8796528952628639
Energy: 1.0285414701116184
Energy: 0.8796528952615927
Energy: 1.0285414701095
Energy: 0.8796528952620165
Energy: 1.028541470104839
Energy: 1.188374640329454
Energy: 0.9094443509327939
Energy: 1.18837464033242
Energy: 0.9094443509209297
Energy: 1.1883746403264879
Energy: 0.9094443509209297
Energy: 0.8919835920682259
Energy: 1.0623315792411305
Energy: 0.8919743764385454
Energy: 1.0623315784402314
Energy: 0.8919835920686495
Energy: 1.0623315764047419
Energy: 1.0702995631345922
Energy: 0.9683385786890288
Energy: 1.070299563135401
Energy: 0.9683385786915713
Energy: 1.070299563131626
Energy: 0.968338578691995
Energy: 0.9059724674030781
Energy: 0.9533035908038011
Energy: 0.9059504803453161
Energy: 0.9533035908122752
Energy: 0.9059724674022307
Energy: 0.9533035908105806
Energy: 1.0272648792247243
Energy: 1.0175558008692565
Energy: 0.9889757032725036
Energy: 1.017555800864172
Energy: 1.027264879228114
Energy: 1.017555800867138
Energy: 1.0272937177705017
Energy: 1.007471931030661
Energy: 0.9889567099278406
Energy: 1.0074719310315086
Energy: 1.0272937177721968
Energy: 1.007471931034051
Energy: 0.9060157215994797
Energy: 0.943625581738693
Energy: 0.9060157215969374
Energy: 0.9436255817467436
Energy: 0.9060157215952425
Energy: 0.9436255817475911
Energy: 1.0612560981081114
Energy: 0.9449176962266479
Energy: 1.0612560981034507
Energy: 0.944917696220716
Energy: 1.0612560981076877
Energy: 0.9449176962194448
Energy: 0.8917987787004482
Energy: 1.195908928950553
Energy: 0.8917987787012955
Energy: 1.1959089289509768
Energy: 0.8917987786996007
Energy: 1.1959089289488583
Energy: 1.2400486912974298
Energy: 0.9094947447918948
Energy: 1.240048691293616
Energy: 0.9094947447940134
Energy: 1.2400486912919213
Energy: 0.9094947447940134
Energy: 0.901808747084589
Energy: 0.989886256505501
Energy: 0.9018087470884026
Energy: 0.9898862565008402
Energy: 0.9018087470879788
Energy: 0.9898862565029587
Energy: 1.0538646476537414
Energy: 0.9925599971361985
Energy: 1.0538646476465383
Energy: 0.9925599971353511
Energy: 1.0538646476469622
Energy: 0.9925599971357749
Energy: 0.9440800355160739
Energy: 0.9744121226268165
Energy: 0.9440800355156502
Energy: 0.9744121226293588
Energy: 0.9440800355156502
Energy: 0.9744121226302063
Energy: 0.9439504615234198
Energy: 0.9060917484629013
Energy: 0.943950461521725
Energy: 0.9060917484675621
Energy: 0.9439504615187589
Energy: 0.9060917484667149
Energy: 1.0699078091987986
Energy: 1.0955878138972925
Energy: 1.069907809206002
Energy: 1.0955878139019535
Energy: 1.0699078092102388
Energy: 1.0955878139036483
Energy: 0.9064440924113493
Energy: 0.9669648534947749
Energy: 0.9064466107220065
Energy: 0.9669648534922326
Energy: 0.9064440924215185
Energy: 0.9669648534918089
Energy: 0.9588557235686147
Energy: 0.9537910648366261
Energy: 0.9588557235673436
Energy: 0.9537910648319652
Energy: 0.9588557235673436
Energy: 0.9537910648311178
Energy: 0.9887976182661697
Energy: 1.0519593592688996
Energy: 0.9887976182682883
Energy: 1.0519593592638152
Energy: 0.9887976182729491
Energy: 1.0519593592676286
Energy: 1.0276188270222368
Energy: 0.880409794823642
Energy: 1.027618827023508
Energy: 0.8804097948270316
Energy: 1.0276188270184234
Energy: 0.8804097948278791
Energy: 0.9066574229927676
Energy: 0.9361223086757352
Energy: 0.9066574229910728
Energy: 0.9361223086740402
Energy: 0.9066574229881068
Energy: 0.9361223086740402

minimum gb energy = 0.8796528952615927 eV
minimum distance =  2.38441348597974 Angstroms
sigma value = 51


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

Energy: 1.0436075209637983
Energy: 1.0198434576562752
Energy: 0.970964374426532
Energy: 1.0198434576543116
Energy: 1.0436075209618347
Energy: 1.0198434576543116
Energy: 1.128090277510941
Energy: 0.9618278231580328
Energy: 1.1280902775089776
Energy: 0.9618278231570511
Energy: 1.1280902775089776
Energy: 0.9618278231570511
Energy: 1.0088565640294958
Energy: 0.986989756945819
Energy: 1.008856564028514
Energy: 0.986989756949746
Energy: 1.0088565640314593
Energy: 0.9869897569477827
Energy: 1.0536922278787249
Energy: 0.9370954080470956
Energy: 1.053692227873816
Energy: 0.9370954080451321
Energy: 1.0536922278699112
Energy: 0.9370954080451321
Energy: 1.0576195839671292
Energy: 1.01757205536145
Energy: 1.0576195839690925
Energy: 1.0175720553624317
Energy: 1.0576195839681108
Energy: 1.0175720553634133
Energy: 1.0176842355853548
Energy: 0.9660091493491425
Energy: 1.0176842355873184
Energy: 0.9660091495463835
Energy: 1.017684235589282
Energy: 0.9660091492107838
Energy: 1.0753388229393974
Energy: 1.0175906413929194
Energy: 1.075338822941361
Energy: 1.017590641394883
Energy: 1.0753388229423426
Energy: 1.017590641394883
Energy: 0.9292686237881647
Energy: 1.0180908830105486
Energy: 0.9292686237911101
Energy: 1.0180908830056399
Energy: 0.9292686237891464
Energy: 1.0180908830056399
Energy: 1.1072101837654065
Energy: 0.937245087537701
Energy: 1.1072101837644248
Energy: 0.9372450875367192
Energy: 1.1072101837644248
Energy: 0.9372450875367192
Energy: 0.9540711511262617
Energy: 1.2201916992925568
Energy: 0.9538799814045321
Energy: 1.220191699287648
Energy: 0.9540711511282253
Energy: 1.2201916992886297
Energy: 1.1179887370812611
Energy: 0.9374199286617125
Energy: 1.0484266996667544
Energy: 0.9374199286617125
Energy: 1.1179887370861696
Energy: 0.9374199286617125
Energy: 1.0394124914826879
Energy: 1.018327298964845
Energy: 0.9673846032672333
Energy: 1.0183272989668086
Energy: 1.0394124914738523
Energy: 1.0183272989668086
Energy: 1.2322075442877751
Energy: 0.9633661840776423
Energy: 1.2322075442858116
Energy: 0.9633661840776423
Energy: 1.2322075442838483
Energy: 0.9633661840776423
Energy: 1.008887346163089
Energy: 0.9402524704464696
Energy: 1.0088873461611254
Energy: 0.9402524704435243
Energy: 1.0088873461650525
Energy: 0.9402524704445061
Energy: 1.0537096286100796
Energy: 0.9947527760535603
Energy: 1.053709628612043
Energy: 0.9947527760555237
Energy: 1.0537096286130025
Energy: 0.994752776054542
Energy: 1.057873547671085
Energy: 1.0176714502991473
Energy: 1.0578735476691217
Energy: 1.0176714503001287
Energy: 1.0578735476720669
Energy: 1.0176714503001287
Energy: 1.0182910302590449
Energy: 1.0282841016686357
Energy: 1.0182910302610084
Energy: 1.0282841016686357
Energy: 1.0182910302600265
Energy: 1.0282841016686357
Energy: 1.0020241899929436
Energy: 1.0177242907415502
Energy: 1.0020241899929436
Energy: 1.0177242907405686
Energy: 1.002024189989039
Energy: 1.0177242907405686

minimum gb energy = 0.9292686237881647 eV
minimum distance =  2.23548836293853 Angstroms
sigma value = 19


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

Energy: 1.0039395304185086
Energy: 1.0188639813799665
Energy: 0.8750949297355188
Energy: 1.0188639813770548
Energy: 1.0039395304190912
Energy: 1.0188639813782197
Energy: 0.9669509035259363
Energy: 0.9965726965486182
Energy: 0.966950904773337
Energy: 0.9965726965486182
Energy: 0.966950906105733
Energy: 0.9965726965480359
Energy: 0.9690087112161291
Energy: 0.8675473104256651
Energy: 0.9690087112172937
Energy: 0.8675473104262474
Energy: 0.969008711217876
Energy: 0.8675473104274121
Energy: 0.9476666775188101
Energy: 0.9698577424246184
Energy: 0.9476666775182275
Energy: 0.969865446190118
Energy: 0.9476666775188101
Energy: 0.9698577424310243
Energy: 0.9571086296078087
Energy: 0.9470571733749557
Energy: 0.9571086296066442
Energy: 0.9470757647301657
Energy: 0.9571086296095557
Energy: 0.9470571733743733
Energy: 0.8667624818980952
Energy: 0.9468594367261283
Energy: 0.8666602951476112
Energy: 0.946907569934194
Energy: 0.8667624818980952
Energy: 0.9468594367267107
Energy: 0.8546394280891925
Energy: 0.9700188923280881
Energy: 0.8546394280897749
Energy: 0.9700188923275057
Energy: 0.8546394280915219
Energy: 0.9700188923286703
Energy: 0.968919610912297
Energy: 1.125879326431861
Energy: 0.9688631848841504
Energy: 1.1258793264336082
Energy: 0.9689196109117147
Energy: 1.1258793264306965
Energy: 0.9282175561095043
Energy: 0.9476359684696755
Energy: 0.9463423451588445
Energy: 0.9476359684720048
Energy: 0.928217556114163
Energy: 0.9476359684702577
Energy: 0.9920316585763516
Energy: 1.0172523853326447
Energy: 0.9034449102142805
Energy: 1.0174344750842097
Energy: 0.9920316585780721
Energy: 1.017252385330898
Energy: 0.9669509035346713
Energy: 0.996572696549783
Energy: 0.9669509047588049
Energy: 0.9965726965492007
Energy: 0.9669509060760337
Energy: 0.9965726965480359
Energy: 0.9690087112161291
Energy: 0.8675473104245005
Energy: 0.9690087112190408
Energy: 0.8675473104256651
Energy: 0.9690087112202055
Energy: 0.8675473104262474
Energy: 0.947666677517063
Energy: 0.9696965895536718
Energy: 0.9476666775176452
Energy: 0.9698696006500822
Energy: 0.9476666775176452
Energy: 0.9696965895560012
Energy: 0.9571086296078087
Energy: 0.9470571733732085
Energy: 0.9571086296066442
Energy: 0.9470675872828878
Energy: 0.9571086296101381
Energy: 0.9470571733749557
Energy: 0.8667624818969306
Energy: 0.9468594367249638
Energy: 0.8666602951464466
Energy: 0.9469177432377792
Energy: 0.8667624818986776
Energy: 0.9468594367261283
Energy: 0.8546394280897749
Energy: 0.9700188923275057
Energy: 0.8546394280903573
Energy: 0.9700188923251762
Energy: 0.8546394280932689
Energy: 0.9700188923269234
Energy: 0.9463284985108407
Energy: 1.1258793264341904
Energy: 0.9463937136075901
Energy: 1.125879326431861
Energy: 0.946328498509676
Energy: 1.1258793264336082
Energy: 0.8902429810666574
Energy: 0.9476359684702577
Energy: 0.9468924975893441
Energy: 0.9476359684714224
Energy: 0.8902429810672396
Energy: 0.9476359684714224
Energy: 1.0039395304196732
Energy: 1.0188639813799665
Energy: 0.8750949297331894
Energy: 1.0188639813770548
Energy: 1.0039395304179262
Energy: 1.0188639813788019
Energy: 0.966950903520695
Energy: 0.9965726965492007
Energy: 0.9669509047884778
Energy: 0.9965726965486182
Energy: 0.9669509061226209
Energy: 0.9965726965480359
Energy: 0.9690087112143821
Energy: 0.8675473104245005
Energy: 0.9690087112155467
Energy: 0.8675473104245005
Energy: 0.969008711217876
Energy: 0.8675473104262474
Energy: 0.947666677517063
Energy: 0.9698577424252008
Energy: 0.9476666775176452
Energy: 0.969865446190118
Energy: 0.9476666775182275
Energy: 0.9698577424316066
Energy: 0.9571086296078087
Energy: 0.9470571733749557
Energy: 0.9571086296078087
Energy: 0.947075764729001
Energy: 0.9571086296107205
Energy: 0.9470571733755379
Energy: 0.8667624818980952
Energy: 0.9468594367243813
Energy: 0.8666602951458643
Energy: 0.9469075699336117
Energy: 0.8667624818980952
Energy: 0.946859436725546
Energy: 0.8546394280897749
Energy: 0.9700188923263409
Energy: 0.8546394280903573
Energy: 0.9700188923257587
Energy: 0.8546394280938513
Energy: 0.9700188923269234
Energy: 0.9689196109128794
Energy: 1.1258793264336082
Energy: 0.9688631848847328
Energy: 1.1258793264336082
Energy: 0.9689196109111322
Energy: 1.1258793264330256
Energy: 0.9282175561095043
Energy: 0.9476359684731694
Energy: 0.9463423451576797
Energy: 0.9476359684737519
Energy: 0.928217556112416
Energy: 0.947635968472587
Energy: 0.9920316585769072
Energy: 1.0172523853314803
Energy: 0.9034449102148628
Energy: 1.0174344750836273
Energy: 0.9920316585809836
Energy: 1.0172523853297333
Energy: 0.966950903544571
Energy: 0.9965726965503654
Energy: 0.9669509047913896
Energy: 0.9965726965503654
Energy: 0.9669509061709287
Energy: 0.996572696549783
Energy: 0.9690087112149643
Energy: 0.8675473104245005
Energy: 0.969008711217876
Energy: 0.8675473104262474
Energy: 0.9690087112196231
Energy: 0.8675473104256651

minimum gb energy = 0.8546394280891925 eV
minimum distance =  2.36050001268834 Angstroms
sigma value = 27


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

Energy: 0.8193429466232923
Energy: 0.8090960973738925
Energy: 0.8193429466232923
Energy: 0.8090960973738925
Energy: 0.8193429466218658
Energy: 0.8090960973738925
Energy: 0.9472137964930286
Energy: 0.8502830793058895
Energy: 0.9472137964930286
Energy: 0.850283079304463
Energy: 0.9472137964930286
Energy: 0.850283079304463
Energy: 0.7841992045510655
Energy: 0.8971520954486872
Energy: 0.7841992045510655
Energy: 0.8971520954486872
Energy: 0.7841992045510655
Energy: 0.8971520954486872
Energy: 0.9306402798588245
Energy: 0.7859006673078628
Energy: 0.9306402798573981
Energy: 0.7859006673064363
Energy: 0.9306402798573981
Energy: 0.7859006673078628
Energy: 0.9304324156955658
Energy: 0.7858619850116212
Energy: 0.9304324156969922
Energy: 0.7858619850116212
Energy: 0.9304324156969922
Energy: 0.7858619850116212
Energy: 0.9273781212697029
Energy: 0.9525010856224426
Energy: 0.9273781212697029
Energy: 0.9525010856224426
Energy: 0.9273781212682765
Energy: 0.9525010856224426
Energy: 0.8319920918060798
Energy: 0.8524253079290093
Energy: 0.8319920918060798
Energy: 0.8524253079290093
Energy: 0.8319920918075062
Energy: 0.8524253079290093
Energy: 0.8191565864999004
Energy: 0.8089451988218294
Energy: 0.8191565864999004
Energy: 0.8089451988189764
Energy: 0.8191565865013268
Energy: 0.8089451988189764
Energy: 0.9484548007526935
Energy: 0.8317240502308342
Energy: 0.9484548007541198
Energy: 0.8317240502308342
Energy: 0.9484548007526935
Energy: 0.8317240502308342
Energy: 0.8989473368533369
Energy: 0.9487434257954965
Energy: 0.8989473368519104
Energy: 0.9487434257954965
Energy: 0.8989473368533369
Energy: 0.948743425796923
Energy: 0.851640033970522
Energy: 0.7871145210838423
Energy: 0.851640033970522
Energy: 0.7871145210838423
Energy: 0.851640033970522
Energy: 0.7871145210838423
Energy: 0.9735076572408357
Energy: 0.8861104708650287
Energy: 0.9735076572422621
Energy: 0.8861104708664551
Energy: 0.9735076572422621
Energy: 0.8861104708664551

minimum gb energy = 0.7841992045510655 eV
minimum distance =  2.2194793731272 Angstroms
sigma value = 9


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

Energy: 0.8098404727201077
Energy: 0.8091478531007607
Energy: 0.8098404727201077
Energy: 0.8091478531007607
Energy: 0.8098404727201077
Energy: 0.8091478531007607
Energy: 1.0377314400972972
Energy: 0.7840934001115787
Energy: 1.0377314400968964
Energy: 0.7840934001119795
Energy: 1.037731440100103
Energy: 0.7772501810822477
Energy: 0.7334288732528337
Energy: 0.9163469480428037
Energy: 0.7334288732584447
Energy: 0.9163469480375933
Energy: 0.7334288732532346
Energy: 0.9163469480399982
Energy: 0.760626402269203
Energy: 0.712075922880226
Energy: 0.7606264022680005
Energy: 0.7120759228786228
Energy: 0.7606264022704055
Energy: 0.7120759228790235
Energy: 0.8101663591041786
Energy: 0.7792004502054084
Energy: 0.8101663591049801
Energy: 0.7792004502054084
Energy: 0.8101663591041786
Energy: 0.7792004502054084
Energy: 0.7955588426198554
Energy: 0.7856328406804627
Energy: 0.7955588426178514
Energy: 0.7856328406840699
Energy: 0.795558842614645
Energy: 0.7856328406832684
Energy: 0.7521169472351251
Energy: 0.8412714280440166
Energy: 0.7521169472347243
Energy: 0.8412714280440166
Energy: 0.7521169472351251
Energy: 0.8412714280436158
Energy: 0.7029768881922599
Energy: 0.8428215370966656
Energy: 0.7029768881910574
Energy: 0.8428215370970664
Energy: 0.7029768881922599
Energy: 0.8428215370970664
Energy: 0.9377590851300623
Energy: 0.7796325135186012
Energy: 0.9377590851348717
Energy: 0.7796325135186012
Energy: 0.9377590851292606
Energy: 0.779632513519002
Energy: 0.8081094116928612
Energy: 0.9061307639794923
Energy: 0.8081094116896548
Energy: 0.90613076397829
Energy: 0.8081094116916587
Energy: 0.9061307639786906
Energy: 0.7591920928534336
Energy: 0.7190769287182338
Energy: 0.7591920928522312
Energy: 0.7190769287190354
Energy: 0.7591920928538344
Energy: 0.7190769287186346
Energy: 0.7698276792882708
Energy: 0.8355856983844672
Energy: 0.7698276792878699
Energy: 0.835585698384868
Energy: 0.7698276792882708
Energy: 0.835585698384868
Energy: 0.7670272115492613
Energy: 0.7865579863059171
Energy: 0.7670272115444519
Energy: 0.7865579863074839
Energy: 0.7670272115524677
Energy: 0.7865579863027108
Energy: 0.8043907980897107
Energy: 1.0273371509790268
Energy: 0.804390798092917
Energy: 1.0273371509790268
Energy: 0.8043907980897107
Energy: 1.0273371509786262
Energy: 0.7324065998837455
Energy: 0.8234226042607005
Energy: 0.7324065998845471
Energy: 0.823422604259899
Energy: 0.7324065998841464
Energy: 0.8234226042602998
Energy: 0.742426118154912
Energy: 0.775707597007131
Energy: 0.7424261181577175
Energy: 0.7757075970059286
Energy: 0.7424261181573166
Energy: 0.7757075970063294
Energy: 0.9280596182502735
Energy: 0.7121039125340617
Energy: 0.9280596182494718
Energy: 0.7121039125384704
Energy: 0.9280596182498726
Energy: 0.7121039125352642
Energy: 0.7467128529999295
Energy: 0.7825499522754547
Energy: 0.7467128529995287
Energy: 0.7825499522750538
Energy: 0.7467128529983628
Energy: 0.782549952274653
Energy: 0.699422649789401
Energy: 0.9639237231433625
Energy: 0.6994226497873971
Energy: 0.9639237231437633
Energy: 0.6994226497938097
Energy: 0.9639237231437633
Energy: 0.8594409432832171
Energy: 0.8545230293160251
Energy: 0.8594409432836181
Energy: 0.8545230293156244
Energy: 0.8594409432844196
Energy: 0.8545230293152236
Energy: 0.6994330048256202
Energy: 0.9639649853893367
Energy: 0.6994330048240169
Energy: 0.9639649853897374
Energy: 0.6994330048248185
Energy: 0.9639649853893367
Energy: 0.7467290437401064
Energy: 0.7824945493076382
Energy: 0.7467290437401064
Energy: 0.7824945493072373
Energy: 0.7467290437397055
Energy: 0.7824945493076382
Energy: 0.9280015734585179
Energy: 0.7121421668041449
Energy: 0.9280015734569146
Energy: 0.7121421668021409
Energy: 0.9280015734533076
Energy: 0.712142166798133
Energy: 0.7425152667685773
Energy: 0.7970213294330895
Energy: 0.7425152667681766
Energy: 0.7970213294302837
Energy: 0.7425152667717836
Energy: 0.7970213294306845
Energy: 0.7321970347182594
Energy: 0.8234303903623824
Energy: 0.7321970347194617
Energy: 0.8234303903619814
Energy: 0.7321970347202633
Energy: 0.8234303903623824
Energy: 0.8043870007717917
Energy: 0.8084178507519413
Energy: 0.8043870007709901
Energy: 0.8084178507519413
Energy: 0.8043870007749983
Energy: 0.8084178507507388
Energy: 0.7671284020954258
Energy: 0.7865167404471555
Energy: 0.767128402101037
Energy: 0.7865167404475563
Energy: 0.7671284021018385
Energy: 0.7865167404495602
Energy: 0.7699563904343674
Energy: 0.7797757501997763
Energy: 0.7699563904347682
Energy: 0.7797757502025817
Energy: 0.769956390433165
Energy: 0.7797757502025817
Energy: 0.7591888902075651
Energy: 0.7191277335388224
Energy: 0.7591888902075651
Energy: 0.7191277335392232
Energy: 0.7591888902083668
Energy: 0.7191277335392232
Energy: 0.8081244316062633
Energy: 0.93493146244095
Energy: 0.8081244316062633
Energy: 0.9349314624413507
Energy: 0.8081244316042593
Energy: 0.9349314624417515
Energy: 0.9377584224978361
Energy: 0.7796560679319299
Energy: 0.9377584224986378
Energy: 0.7796560679315289
Energy: 0.9377584224990385
Energy: 0.7796560679315289
Energy: 0.7029610251516631
Energy: 0.8427769031442306
Energy: 0.7029610251504608
Energy: 0.8427769031434289
Energy: 0.7029610251512625
Energy: 0.8427769031442306
Energy: 0.7521146531567956
Energy: 0.8413125872570156
Energy: 0.7521146531592002
Energy: 0.8413125872570156
Energy: 0.752114653157597
Energy: 0.841312587256615
Energy: 0.7956620310028395
Energy: 0.785093746952747
Energy: 0.7956620310000339
Energy: 0.785093746954751
Energy: 0.7956620310004346
Energy: 0.7850937469535486
Energy: 0.8101584525498988
Energy: 0.7792090217864063
Energy: 0.8101584525507006
Energy: 0.7792090217868071
Energy: 0.8101584525507006
Energy: 0.779209021787208
Energy: 0.7606629371823304
Energy: 0.7119038646839172
Energy: 0.7606629371831319
Energy: 0.7119038646851196
Energy: 0.7606629371827313
Energy: 0.7119038646839172
Energy: 0.7334058716082703
Energy: 0.9170514001229302
Energy: 0.7334058716090719
Energy: 0.9170514001225294
Energy: 0.7334058716090719
Energy: 0.9170514001221286
Energy: 1.037698348083032
Energy: 0.7840508863574361
Energy: 1.0376983480842343
Energy: 0.7840508863570353
Energy: 1.0376983480826314
Energy: 0.7840508863566346
Energy: 0.8098404727209093
Energy: 0.8091478531035661
Energy: 0.8098404727213101
Energy: 0.8091478531035661
Energy: 0.8098404727205085
Energy: 0.8091478531035661
Energy: 1.037731440097698
Energy: 0.7814629946371078
Energy: 1.0377314401005036
Energy: 0.7814629946371078
Energy: 1.0377314400980988
Energy: 0.7814629946379091
Energy: 0.7334288732508297
Energy: 0.9163469480315813
Energy: 0.7334288732528337
Energy: 0.9163469480331846
Energy: 0.7334288732504289
Energy: 0.9163469480283751
Energy: 0.7606264022667981
Energy: 0.7120759228750156
Energy: 0.7606264022671989
Energy: 0.7120759228746149
Energy: 0.7606264022680005
Energy: 0.7120759228754164
Energy: 0.8101663591021746
Energy: 0.7792004502054084
Energy: 0.8101663591053808
Energy: 0.7792004502050076
Energy: 0.8101663591025754
Energy: 0.7792004502050076

minimum gb energy = 0.6994226497873971 eV
minimum distance =  2.3191517677587 Angstroms
sigma value = 57


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

Energy: 0.4864557415306313
Energy: 0.47168194214104064
Energy: 0.38138535444143457
Energy: 0.47168194214469006
Energy: 0.48645574152971893
Energy: 0.4716819421437777
Energy: 0.5153817194139706
Energy: 0.4637306733346512
Energy: 0.5153817194176201
Energy: 0.4637306733328264
Energy: 0.515381719414883
Energy: 0.4637306733328264
Energy: 0.49163292110784196
Energy: 0.5552819980400975
Energy: 0.4916329211124038
Energy: 0.55528199804101
Energy: 0.4916329211114914
Energy: 0.5552819980419224
Energy: 0.47357509500775175
Energy: 0.3808802282705863
Energy: 0.4735750950104888
Energy: 0.38088022827788515
Energy: 0.47357509501140116
Energy: 0.38088022827788515
Energy: 0.43054726146816874
Energy: 0.5144123929685717
Energy: 0.4305472614663441
Energy: 0.5144123929667468
Energy: 0.4305472614663441
Energy: 0.5144123929667468
Energy: 0.38107939800112717
Energy: 0.4909158257395368
Energy: 0.38107939800112717
Energy: 0.4909158257395368
Energy: 0.3810793980029518
Energy: 0.4909158257395368
Energy: 0.3811036586068969
Energy: 0.4068414331109415
Energy: 0.3811036586068969
Energy: 0.4068414331072922
Energy: 0.3811036586068969
Energy: 0.4068414331072922
Energy: 0.5154127226045526
Energy: 0.4292558632887014
Energy: 0.5154127226045526
Energy: 0.42925586328961385
Energy: 0.5154127226045526
Energy: 0.42925586328961385
Energy: 0.47374530129226705
Energy: 0.3808750305728552
Energy: 0.47374530129591647
Energy: 0.3808750305728552
Energy: 0.47374530129226705
Energy: 0.3808750305728552
Energy: 0.40732270551412514
Energy: 0.5494943266173642
Energy: 0.40732270551230043
Energy: 0.5494943266164518
Energy: 0.4073227055113881
Energy: 0.5494943266173642
Energy: 0.4316145375633668
Energy: 0.46389098871048395
Energy: 0.4316145375642791
Energy: 0.46389098870683454
Energy: 0.43161453756154206
Energy: 0.46389098870683454
Energy: 0.48645574152971893
Energy: 0.47168194214104064
Energy: 0.3813853544423055
Energy: 0.47168194214195297
Energy: 0.4864557415269819
Energy: 0.47168194214104064
Energy: 0.5153817194139706
Energy: 0.46373067333556345
Energy: 0.5153817194167077
Energy: 0.4637306733319141
Energy: 0.5153817194130583
Energy: 0.4637306733319141
Energy: 0.4916329211114914
Energy: 0.5552819980428346
Energy: 0.4916329211114914
Energy: 0.55528199804101
Energy: 0.49163292111057905
Energy: 0.55528199804101
Energy: 0.4735750950095764
Energy: 0.3808802282705863
Energy: 0.4735750950104888
Energy: 0.3808802282751481
Energy: 0.4735750950123135
Energy: 0.3808802282751481
Energy: 0.43054726146725636
Energy: 0.5144123929694839
Energy: 0.4305472614663441
Energy: 0.5144123929667468
Energy: 0.43054726146543165
Energy: 0.5144123929667468
Energy: 0.3810793980029518
Energy: 0.4909158257386244
Energy: 0.3810793980029518
Energy: 0.4909158257377121
Energy: 0.3810793980047766
Energy: 0.4909158257377121
Energy: 0.38110365860507217
Energy: 0.4068414331082045
Energy: 0.38110365860598455
Energy: 0.4068414331045551
Energy: 0.38110365860598455
Energy: 0.4068414331045551
Energy: 0.5154127226045526
Energy: 0.4292558632868767
Energy: 0.5154127226036403
Energy: 0.4292558632859644
Energy: 0.515412722605465
Energy: 0.4292558632859644

minimum gb energy = 0.3808750305728552 eV
minimum distance =  2.46860760134034 Angstroms
sigma value = 11


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

Energy: 0.7157351612740702
Energy: 0.8306717451426165
Energy: 0.642810638811585
Energy: 0.8306717451406116
Energy: 0.7157351612600356
Energy: 0.8306717451406116
Energy: 0.7824420424653693
Energy: 0.7916494454486352
Energy: 0.7824420424633645
Energy: 0.7916494454472985
Energy: 0.7824420424506664
Energy: 0.7916494454472985
Energy: 0.8295760008581587
Energy: 0.9838285279442813
Energy: 0.8295760008635052
Energy: 0.9838285279375981
Energy: 0.8295760008615002
Energy: 0.9838285279369298
Energy: 0.9286852101098473
Energy: 0.6902566237245698
Energy: 0.9286852101058373
Energy: 0.6902566237352628
Energy: 0.9286852101098473
Energy: 0.6902566237359311
Energy: 0.7822346355232529
Energy: 0.6615716365655363
Energy: 0.7821949647370791
Energy: 0.6615716365702144
Energy: 0.7822346355259262
Energy: 0.6615716365702144
Energy: 0.732238387511814
Energy: 0.8084397374319134
Energy: 0.7322383875138191
Energy: 0.8084397374299087
Energy: 0.7322383875164923
Energy: 0.8084397374299087
Energy: 0.6779808551566815
Energy: 0.8210640432770628
Energy: 0.6779808551560133
Energy: 0.8210640432723847
Energy: 0.6779808551540082
Energy: 0.8210640432723847
Energy: 0.8250970714939714
Energy: 0.6416077147711162
Energy: 0.8250970714919664
Energy: 0.6416077147798043
Energy: 0.8250970714966447
Energy: 0.641607714779136
Energy: 0.7756243067640316
Energy: 0.6455204673413185
Energy: 0.7756243067687097
Energy: 0.6455204673473335
Energy: 0.7756243067620266
Energy: 0.6455204673473335
Energy: 0.6490180508561868
Energy: 0.9965546208935053
Energy: 0.6490060303174497
Energy: 0.9965546209015251
Energy: 0.6490180508495036
Energy: 0.9965546209035302
Energy: 0.7090775513517217
Energy: 1.0171063651007233
Energy: 0.7090775513477119
Energy: 1.0171063651060699
Energy: 0.7090775513530584
Energy: 1.0171063651060699
Energy: 0.7779801343802895
Energy: 0.6021825122148357
Energy: 0.7779801343829627
Energy: 0.6021825122181772
Energy: 0.7779801343816262
Energy: 0.6021825122181772
Energy: 0.8856122156210159
Energy: 0.6938405778104415
Energy: 0.8853142216005163
Energy: 0.6938405778124463
Energy: 0.8856122155969565
Energy: 0.6938405778124463
Energy: 0.8821003928664085
Energy: 0.9791620132953653
Energy: 0.8821441360756961
Energy: 0.9791620132980386
Energy: 0.8821003928623985
Energy: 0.9791620132987069
Energy: 0.8015466036117856
Energy: 0.7822660092678174
Energy: 0.8015466036104492
Energy: 0.7822660092704907
Energy: 0.8015466036178006
Energy: 0.782266009271159
Energy: 0.7014358772042243
Energy: 0.822844464423387
Energy: 0.643645368620879
Energy: 0.8228444644187087
Energy: 0.7014358772008827
Energy: 0.8228444644187087
Energy: 0.7480569469481051
Energy: 0.7787275065842997
Energy: 0.7480569469427586
Energy: 0.7787275065796216
Energy: 0.7480569469407535
Energy: 0.7787275065796216
Energy: 1.013840847885696
Energy: 0.9342379053474642
Energy: 1.0138408478863643
Energy: 0.9342379053494692
Energy: 1.0138408478863643
Energy: 0.934237905355484
Energy: 0.9102508758887758
Energy: 0.6877278591579161
Energy: 0.9102508758874392
Energy: 0.687727859165936
Energy: 0.9102508758840976
Energy: 0.6877278591672726
Energy: 0.777785282658709
Energy: 0.7410321109088792
Energy: 0.7779208284800604
Energy: 0.7410321109155624
Energy: 0.7777852826593774
Energy: 0.7410321109162308
Energy: 0.6498001643981907
Energy: 0.8093996711563328
Energy: 0.6498001643981907
Energy: 0.8093996711509861
Energy: 0.6498001644022007
Energy: 0.8093996711509861
Energy: 0.7786916745840643
Energy: 0.8206128617733901
Energy: 0.7786916745773812
Energy: 0.8206128617854198
Energy: 0.778691674579386
Energy: 0.8206128617854198
Energy: 0.8228854751034176
Energy: 0.6874468680107803
Energy: 0.8228854751054225
Energy: 0.6874468680141218
Energy: 0.8228854751101008
Energy: 0.6874468680127851
Energy: 0.7775802700210707
Energy: 0.6997704448986533
Energy: 0.7775802700163925
Energy: 0.699770444885287
Energy: 0.7775802700190657
Energy: 0.699770444885287
Energy: 0.6499679003216806
Energy: 0.9595801057093142
Energy: 0.6499670505115176
Energy: 0.9595801057059726
Energy: 0.6499679003283637
Energy: 0.9595801057059726
Energy: 1.0734001072459878
Energy: 1.0034242935643314
Energy: 1.073400107244651
Energy: 1.0034242935670046
Energy: 1.0734001072366919
Energy: 1.003424293566336

minimum gb energy = 0.6021825122148357 eV
minimum distance =  2.2439200614406 Angstroms
sigma value = 41


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

Energy: 0.7178918370159906
Energy: 0.6745498046082153
Energy: 0.7178918370165174
Energy: 0.6745498046082153
Energy: 0.7178918370159906
Energy: 0.6745498046082153
Energy: 0.8200648901640787
Energy: 0.8925391148096038
Energy: 0.8200648901630252
Energy: 0.8925391148096038
Energy: 0.8200648901646054
Energy: 0.892539114809077
Energy: 1.0431686934483524
Energy: 1.0438609775714345
Energy: 1.043168693448879
Energy: 1.0438609775714345
Energy: 1.043168693448879
Energy: 1.0438609775714345
Energy: 0.7872292965220006
Energy: 0.6436786175817021
Energy: 0.7872292965235808
Energy: 0.6436786175811753
Energy: 0.7872292965230541
Energy: 0.6436786175817021
Energy: 0.6418837447051408
Energy: 0.6807427828651305
Energy: 0.6418837447056674
Energy: 0.6807427828651305
Energy: 0.6418837447051408
Energy: 0.6807427828656573
Energy: 0.7942263383057795
Energy: 0.9028943852154819
Energy: 0.7942263383052528
Energy: 0.9028943852149551
Energy: 0.7942263383052528
Energy: 0.9028943852149551
Energy: 0.6474651947892776
Energy: 0.91158326224343
Energy: 0.6474651947887508
Energy: 0.9115832622439568
Energy: 0.647465194788224
Energy: 0.9115832622439568
Energy: 0.6396828720152097
Energy: 0.6438433001012975
Energy: 0.6396828720157364
Energy: 0.6438433001007707
Energy: 0.6396828720146828
Energy: 0.6438433001007707
Energy: 0.6508793916400326
Energy: 0.6737401847972274
Energy: 0.6508793916395059
Energy: 0.6737401847956471
Energy: 0.6508793916405594
Energy: 0.6737401847951204
Energy: 0.6803269598108268
Energy: 0.9638353448764118
Energy: 0.6803269598103
Energy: 0.9638353448758851
Energy: 0.6803269598118803
Energy: 0.9638353448764118
Energy: 0.6807557856562191
Energy: 0.9606156769407329
Energy: 0.6807557856562191
Energy: 0.9606156769402062
Energy: 0.6807557856567459
Energy: 0.9606156769407329
Energy: 0.6331084758001938
Energy: 0.8313047144914542
Energy: 0.633108475799667
Energy: 0.8313047144914542
Energy: 0.6331084758001938
Energy: 0.8313047144914542
Energy: 0.6400397657395868
Energy: 0.6646585880199918
Energy: 0.6400397657390601
Energy: 0.664658588019465
Energy: 0.6400397657390601
Energy: 0.6646585880199918
Energy: 0.6202367070358038
Energy: 0.8431136177224008
Energy: 0.6202367070368573
Energy: 0.8431136177234543
Energy: 0.6202367070363305
Energy: 0.8431136177229276
Energy: 0.7920391082275008
Energy: 1.0012131031375364
Energy: 0.7920391082275008
Energy: 1.0012131031380633
Energy: 0.7920391082264473
Energy: 1.0012131031380633
Energy: 0.6194591755754618
Energy: 0.840144943247844
Energy: 0.6194591755749351
Energy: 0.8555444272542361
Energy: 0.6194591755749351
Energy: 0.8555444272542361
Energy: 0.6479376495448276
Energy: 0.6648284092617547
Energy: 0.6479376495453543
Energy: 0.6648284092612279
Energy: 0.6479376495453543
Energy: 0.6648284092617547
Energy: 0.9071983237984783
Energy: 1.044043781672603
Energy: 0.9071983238000585
Energy: 1.044043781672603
Energy: 0.9071983237984783
Energy: 1.044043781672603
Energy: 0.8169987191223778
Energy: 0.8900074585962168
Energy: 0.8169987191223778
Energy: 0.8900074585962168
Energy: 0.8169987191223778
Energy: 0.8900074585962168
Energy: 0.679603803127943
Energy: 0.8942212099913922
Energy: 0.6796038031268895
Energy: 0.8942212099908655
Energy: 0.6796038031274163
Energy: 0.8942212099913922
Energy: 0.653158170610809
Energy: 0.8963925104541646
Energy: 0.6531581706113359
Energy: 0.8963925104546914
Energy: 0.6531581706102823
Energy: 0.8963925104541646
Energy: 0.795223343025041
Energy: 1.054758048339942
Energy: 0.7952233430229341
Energy: 1.0547580483404686
Energy: 0.7952233430260945
Energy: 1.0547580483409953
Energy: 0.7891857039774551
Energy: 0.6458098889329821
Energy: 0.7891857039785086
Energy: 0.6458098889319286
Energy: 0.7891857039774551
Energy: 0.6458098889324554
Energy: 0.6194003139740908
Energy: 0.8986949965610938
Energy: 0.6194003139746175
Energy: 0.8986949965610938
Energy: 0.6194003139740908
Energy: 0.8986949965610938
Energy: 0.6256236473445349
Energy: 0.9069773380385816
Energy: 0.6256236473434814
Energy: 0.9069773380385816
Energy: 0.6256236473440081
Energy: 0.9069773380385816
Energy: 0.6474577335430886
Energy: 0.6571582559371099
Energy: 0.647457733544142
Energy: 0.6571582559376365
Energy: 0.6474577335436154
Energy: 0.6571582559371099
Energy: 0.6436060737257568
Energy: 0.6456767345891289
Energy: 0.64360607372523
Energy: 0.6456767345891289
Energy: 0.6436060737257568
Energy: 0.6456767345880754
Energy: 0.651714995584076
Energy: 0.8906220512648493
Energy: 0.651714995584076
Energy: 0.8906220512643226
Energy: 0.651714995584076
Energy: 0.8906220512643226
Energy: 0.6798814636399183
Energy: 0.8932648531863512
Energy: 0.6798814636393914
Energy: 0.8932648531863512
Energy: 0.6798814636393914
Energy: 0.8932648531863512
Energy: 0.8735236528856442
Energy: 0.6807340154562844
Energy: 0.8735236528856442
Energy: 0.6807340154562844
Energy: 0.8735236528861708
Energy: 0.6807340154594449
Energy: 0.6361564921694881
Energy: 0.7622758005399567
Energy: 0.6361564921684346
Energy: 0.7622758005399567
Energy: 0.6361564921700148
Energy: 0.7622758005399567
Energy: 0.6580897637432124
Energy: 0.66435039140183
Energy: 0.6580897637432124
Energy: 0.66435039140183
Energy: 0.6580897637442659
Energy: 0.66435039140183
Energy: 0.6251312259411472
Energy: 0.7755906419138676
Energy: 0.6251312259416739
Energy: 0.7755906419138676
Energy: 0.6251312259411472
Energy: 0.7755906419138676

minimum gb energy = 0.6194003139740908 eV
minimum distance =  2.41796786515402 Angstroms
sigma value = 33


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

Energy: 0.7368747139229122
Energy: 0.7003362878139592
Energy: 0.7368747139240212
Energy: 0.7003362878021295
Energy: 0.7368747139258695
Energy: 0.7003362878106322
Energy: 0.920945260421485
Energy: 0.674134506608433
Energy: 0.9209452604133522
Energy: 0.6741345066091723
Energy: 0.9209452604218549
Energy: 0.6741345066091723
Energy: 0.9068189900524167
Energy: 1.011379631516572
Energy: 0.9068189900398813
Energy: 1.011379631517681
Energy: 0.9068189900446869
Energy: 1.0113796315224532
Energy: 0.8986979200008135
Energy: 0.6791238450451421
Energy: 0.8986979200100553
Energy: 0.6791238450473601
Energy: 0.8986979200100553
Energy: 0.6791238450436634
Energy: 0.6929279955521574
Energy: 1.0596439070037729
Energy: 0.6929279955517877
Energy: 1.0596439070096877
Energy: 0.6929279955551149
Energy: 1.059643906991977
Energy: 0.8967795033932574
Energy: 0.696576117388827
Energy: 0.896779503398433
Energy: 0.696576117388827
Energy: 0.8967795033973238
Energy: 0.6965761173921541
Energy: 0.6934799398924936
Energy: 0.7437340419145758
Energy: 0.6934799399079864
Energy: 0.7437340419105093
Energy: 0.6934799399032142
Energy: 0.7437340419101397
Energy: 0.7199294077006575
Energy: 0.728542769381777
Energy: 0.7199294077124871
Energy: 0.7285427693836254
Energy: 0.7199294077180323
Energy: 0.7285427693754924
Energy: 1.0612148762307032
Energy: 0.7110985758983319
Energy: 1.061214876221831
Energy: 0.7110985759035072
Energy: 1.0612148762255276
Energy: 0.7110985759001803
Energy: 0.9291123082167226
Energy: 0.6921452040130905
Energy: 0.9291123082063717
Energy: 0.6921452040130905
Energy: 0.9291123082115472
Energy: 0.6921452040171571
Energy: 0.7186845674174791
Energy: 0.7173508615368483
Energy: 0.7186845674263513
Energy: 0.7173508615349999
Energy: 0.7186845674208062
Energy: 0.7173508615364786
Energy: 1.063138460413563
Energy: 0.6789236471381538
Energy: 1.063138460413563
Energy: 0.6789236471403717
Energy: 1.0631384604128238
Energy: 0.6789236471418504
Energy: 0.7101923171932596
Energy: 1.0673327129215986
Energy: 0.7101923172039802
Energy: 1.0673327129275134
Energy: 0.7101923172002834
Energy: 1.0673327129278831
Energy: 0.7368594736462831
Energy: 0.7239212562547029
Energy: 0.7368594736533071
Energy: 0.7239212562606178
Energy: 0.73685947364998
Energy: 0.72392125625803
Energy: 0.7298038041630337
Energy: 0.6922055636434021
Energy: 0.7298038041718724
Energy: 0.6922055636411841
Energy: 0.7298038041703937
Energy: 0.6922055636382267
Energy: 0.7004973961270815
Energy: 0.9006226893257757
Energy: 0.7004973961241241
Energy: 0.900622689323188
Energy: 0.7004973961285602
Energy: 0.9006226893309512
Energy: 1.0755114127144145
Energy: 0.6933601937547766
Energy: 1.0755114127151537
Energy: 0.6933601937618005
Energy: 1.0755114127155232
Energy: 0.6933601937581038
Energy: 0.6762553335117788
Energy: 0.704244052872381
Energy: 0.6762553335276749
Energy: 0.7042440528690539
Energy: 0.6762553335132575
Energy: 0.704244052872381
Energy: 0.9246260440486204
Energy: 0.9083496723772254
Energy: 0.924626044050099
Energy: 0.9083496723794434
Energy: 0.9246260440585681
Energy: 0.9083496723827705
Energy: 1.0645367103353143
Energy: 0.710127258113349
Energy: 1.064536710334575
Energy: 0.7101272581015193
Energy: 1.0645367103342052
Energy: 0.7101272581055857
Energy: 0.6754522491855012
Energy: 0.737211675553058
Energy: 0.6754522491906768
Energy: 0.737211675557494
Energy: 0.6754522491977006
Energy: 0.7372116755619302
Energy: 0.6722263100886445
Energy: 0.9236893781255638
Energy: 0.6722263100875356
Energy: 0.9236893781388722
Energy: 0.6722263100886445
Energy: 0.9236893781307394
Energy: 0.893134448311984
Energy: 0.8722471608774514
Energy: 0.8931344483164201
Energy: 0.8722471608859539
Energy: 0.893134448313093
Energy: 0.8722471608796692
Energy: 0.6829468959723625
Energy: 0.8892951056521309
Energy: 0.6829468959801256
Energy: 0.8892951056923919
Energy: 0.6829468959760592
Energy: 0.8892951055468067
Energy: 1.0593432484587473
Energy: 0.69343904998774
Energy: 1.059343248454681
Energy: 0.6934390499984606
Energy: 1.0593432484572685
Energy: 0.69343905001066
Energy: 0.6933462252884093
Energy: 0.8943086960916884
Energy: 0.6933462252895184
Energy: 0.894308696085404
Energy: 0.6933462252909971
Energy: 0.8943086960976032
Energy: 0.7469043994357317
Energy: 0.6959195376321363
Energy: 0.7469043994316652
Energy: 0.6959195376284395
Energy: 0.7469043994390587
Energy: 0.6959195376221551
Energy: 0.7183055923201067
Energy: 0.6834616451765348
Energy: 0.7183055923267607
Energy: 0.6834616451750561
Energy: 0.7183055923466898
Energy: 0.6834616451824496
Energy: 0.7122259067125077
Energy: 1.0671968743036016
Energy: 0.7122259067191619
Energy: 1.067196874299535
Energy: 0.7122259067176832
Energy: 1.0671968742999045
Energy: 0.6896948435424093
Energy: 0.9267389590116714
Energy: 0.6896948435442242
Energy: 0.926738959008714
Energy: 0.6896948435431152
Energy: 0.9267389590109321
Energy: 0.701447483928652
Energy: 0.6749470279089711
Energy: 0.7014474839312398
Energy: 0.6749470279089711
Energy: 0.701447483926434
Energy: 0.6749470279097105
Energy: 0.6830220726417976
Energy: 1.0664371993436392
Energy: 0.6830220726377312
Energy: 1.0664371993407153
Energy: 0.6830220726362525
Energy: 1.0664371993403456
Energy: 1.0648355682966313
Energy: 0.7104037268028105
Energy: 1.0648355683003279
Energy: 0.7104037268017014
Energy: 1.0648355682973705
Energy: 0.7104037267957867
Energy: 0.7208343959687489
Energy: 0.7326161594311812
Energy: 0.7208343959683793
Energy: 0.7326161594285935
Energy: 0.7208343959698579
Energy: 0.7326161594322902
Energy: 0.720699536327854
Energy: 0.7326192037634819
Energy: 0.7206995363230483
Energy: 0.7326192037620032
Energy: 0.7206995363160245
Energy: 0.7326192037682876
Energy: 1.0648081947497812
Energy: 0.7105380078664708
Energy: 1.0648081947494112
Energy: 0.7105380078631437
Energy: 1.0648081947479324
Energy: 0.7105380078598167
Energy: 0.6829411714739925
Energy: 1.0662101141554956
Energy: 0.6829411714691866
Energy: 1.0662101141554956
Energy: 0.6829411714739925
Energy: 1.0662101141547562
Energy: 0.701455705484577
Energy: 0.6748774094440583
Energy: 0.7014557054779228
Energy: 0.674877409447755
Energy: 0.7014557054801409
Energy: 0.6748774094399919
Energy: 0.6896471512831064
Energy: 0.9268361726528408
Energy: 0.6896471512908695
Energy: 0.9268361726550589
Energy: 0.6896471512923482
Energy: 0.9268361726513622
Energy: 0.7122330830777056
Energy: 1.0677163293463903
Energy: 0.712233083070312
Energy: 1.06771632934676
Energy: 0.7122330830843596
Energy: 1.0677163293504233
Energy: 0.7183908698179358
Energy: 0.6832669106520566
Energy: 0.7183908695988184
Energy: 0.6832669106516869
Energy: 0.7183908760124361
Energy: 0.6832669106531657
Energy: 0.7469971144345808
Energy: 0.6960188384537652
Energy: 0.7469971144242299
Energy: 0.6960188384596464
Energy: 0.7469971144305144
Energy: 0.6960188384574284
Energy: 0.6934734197237156
Energy: 0.8943880396172074
Energy: 0.6934734197203883
Energy: 0.8943880396168377
Energy: 0.6934734197133645
Energy: 0.8943880396160981
Energy: 1.0591280891403665
Energy: 0.6933274774512487
Energy: 1.0591280891429542
Energy: 0.6933274774627086
Energy: 1.0591280891329728
Energy: 0.6933274774575332
Energy: 0.6830279720048631
Energy: 0.8881778514355692
Energy: 0.6830279720063418
Energy: 0.8881778514562712
Energy: 0.6830279720063418
Energy: 0.8881778514544226
Energy: 0.8931469010202735
Energy: 0.8722504969386539
Energy: 0.8931469010147284
Energy: 0.8722504969449385
Energy: 0.8931469010191645
Energy: 0.8722504969449385
Energy: 0.6722337349216589
Energy: 0.9238460767014038
Energy: 0.6722337349205499
Energy: 0.9238460766995554
Energy: 0.6722337349205499
Energy: 0.9238460767014038

minimum gb energy = 0.6722263100875356 eV
minimum distance =  2.34441218055484 Angstroms
sigma value = 67


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

Energy: 0.9854548862276179
Energy: 0.9525918717396091
Energy: 0.7929806017078531
Energy: 0.9525918717378685
Energy: 0.9854548862268598
Energy: 0.9525918717378685
Energy: 0.9817067871101113
Energy: 0.9195676323122031
Energy: 0.9817067871091286
Energy: 0.9195676323119505
Energy: 0.9817067871098866
Energy: 0.9195676323119505
Energy: 1.2168159690375058
Energy: 0.8579727098014668
Energy: 0.9946486721259833
Energy: 0.8579727098002314
Energy: 0.996116962352178
Energy: 0.8579727098002314
Energy: 0.777920169305912
Energy: 0.9200325699626436
Energy: 0.777920169305182
Energy: 0.9200325699611557
Energy: 0.7779201693056875
Energy: 0.9200325699614084
Energy: 0.9854548862280952
Energy: 0.9525918717386265
Energy: 0.7929806017081057
Energy: 0.9525918717373912
Energy: 0.9854548862271126
Energy: 0.9525918717371386
Energy: 0.9817067871101113
Energy: 0.9195676323134384
Energy: 0.981706787108876
Energy: 0.9195676323116977
Energy: 0.9817067871096339
Energy: 0.9195676323114731
Energy: 1.2526722921486615
Energy: 0.8579727098004841
Energy: 0.7650444229405399
Energy: 0.8579727097997261
Energy: 0.9961169623511953
Energy: 0.8579727097997261

minimum gb energy = 0.7650444229405399 eV
minimum distance =  2.3497911169157 Angstroms
sigma value = 3


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

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Energy: 0.905421938412016
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Energy: 0.8574160979563259
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Energy: 0.8574131079445886
Energy: 0.8530358276670793
Energy: 0.8574147333835112
Energy: 1.0040490103618052
Energy: 0.8650337389936936
Energy: 1.0040490103597879
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Energy: 1.0040490103614994
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Energy: 0.8680577915100284
Energy: 0.9992202951813425
Energy: 0.8680577915120457
Energy: 0.9992202952008429
Energy: 0.8680577915083166
Energy: 0.9992202952011485
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Energy: 0.8351429246898926
Energy: 0.8778359068738047
Energy: 0.835142924689587
Energy: 0.8778359068643906
Energy: 0.835142924689587
Energy: 0.8667925762260629
Energy: 0.9086415266921853
Energy: 0.8667925762244124
Energy: 0.9086415267076511
Energy: 0.8667925762253905
Energy: 0.9086415267076511
Energy: 0.9345128657436984
Energy: 0.8415811681828121
Energy: 0.9345128657309832
Energy: 0.8415811681845237
Energy: 0.9345128657229141
Energy: 0.8415811681845237
Energy: 0.9274935988869354
Energy: 0.9595979531904483
Energy: 0.9274950782976689
Energy: 0.959597953193138
Energy: 0.9274935988866299
Energy: 0.959597953193138
Energy: 0.9216393782461441
Energy: 0.8696317264730163
Energy: 0.9216393782548247
Energy: 0.8696317264770509
Energy: 0.9216393782632605
Energy: 0.8696317264763785
Energy: 0.8530122051318044
Energy: 0.9268452013779872
Energy: 0.853012205126425
Energy: 0.9268452013850172
Energy: 0.8530122051294816
Energy: 0.926845201383
Energy: 0.8777935917475499
Energy: 0.8788285352780901
Energy: 0.8777935917495672
Energy: 0.8788285352659864
Energy: 0.8777935917488947
Energy: 0.878828535266292
Energy: 0.9081684877238219
Energy: 0.8684653877135209
Energy: 0.9081595715425628
Energy: 0.8684653877162106
Energy: 0.9081684877191761
Energy: 0.8684653877158439

minimum gb energy = 0.8241343296648396 eV
minimum distance =  2.29498698036267 Angstroms
sigma value = 81


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

Energy: 0.9946674659676285
Energy: 0.9064207268870668
Energy: 0.9164172825529691
Energy: 0.9064207268773763
Energy: 0.9946674659643983
Energy: 0.9064207268764534
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Energy: 0.8411755795622432
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Energy: 0.8411755795631662
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Energy: 0.9033602375294101
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Energy: 0.8702423720369925
Energy: 0.8212759928290553
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Energy: 0.8859757194002114
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Energy: 0.8617903203099557
Energy: 0.8830985716666002
Energy: 0.9245363742846161
Energy: 0.9049073857917096
Energy: 0.9245363742795402
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Energy: 0.904907385779712
Energy: 0.9070479600974781
Energy: 0.8832408955046613
Energy: 0.9070479601020927
Energy: 0.8832408955032769
Energy: 0.9070479601011698
Energy: 0.8832408955028154
Energy: 0.9144567943984924
Energy: 0.869565779865786
Energy: 0.9144567943948007
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Energy: 0.9144567943998766
Energy: 0.8695657798745536
Energy: 0.9399346629270869
Energy: 0.7827086727370065
Energy: 0.9399346629243183
Energy: 0.7827086727402367
Energy: 0.9399346629266254
Energy: 0.7827086727351608
Energy: 0.9063558102483819
Energy: 0.8614775648132041
Energy: 0.9052814711830518
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Energy: 0.9063558097977544
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Energy: 0.8751337986059943
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Energy: 0.8751337986078401
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Energy: 0.9065027571599499
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Energy: 0.9168170965455671
Energy: 1.111042898698694
Energy: 0.9168170965464899
Energy: 1.1110428986940792
Energy: 0.8696734643975059
Energy: 0.8449506497205592
Energy: 0.8696734643979676
Energy: 0.8449506497205592
Energy: 0.869673464403505
Energy: 0.8449506497265581
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Energy: 0.821091712894655
Energy: 0.8908308557529624
Energy: 0.861843039686877
Energy: 0.8908308557451176
Energy: 0.8210917128914248
Energy: 0.8685198655485777
Energy: 0.9242941513785077
Energy: 0.8685661760700478
Energy: 0.9242941513794308
Energy: 0.8685198655522693
Energy: 0.9242941513752777
Energy: 0.9207727153090862
Energy: 0.8241265657247462
Energy: 0.9207727153215453
Energy: 0.824132013132429
Energy: 0.9207727153118549
Energy: 0.8241265657224389
Energy: 0.879369674634132
Energy: 0.9158541035260669
Energy: 0.8793696746309017
Energy: 0.915854103524221
Energy: 0.8793696746309017
Energy: 0.915854103524221
Energy: 0.7967162057310926
Energy: 0.9739021234421016
Energy: 0.7967162057223249
Energy: 0.9739021234402557
Energy: 0.7967162057287853
Energy: 0.9739021234402557
Energy: 0.8616504298355024
Energy: 0.8705955875380633
Energy: 0.8616494324180157
Energy: 0.870859900247511
Energy: 0.8616504298272383
Energy: 0.8705955868129992
Energy: 0.9981197153866387
Energy: 0.9240367803824048
Energy: 0.9981028499769825
Energy: 0.923862563673769
Energy: 0.9981197153843314
Energy: 0.9240367803759446
Energy: 0.9375455713275079
Energy: 1.1217475291216086
Energy: 0.9370642460055985
Energy: 1.1217475291206858
Energy: 0.9375455713220127
Energy: 1.1217475291165326
Energy: 0.9674176431241368
Energy: 0.915533371410384
Energy: 0.9674176431130619
Energy: 0.9155333714108455
Energy: 0.9674176431135233
Energy: 0.9155333714025813
Energy: 0.8688520940601447
Energy: 0.8541494317950449
Energy: 0.8688520940592217
Energy: 0.8541494317964291
Energy: 0.868852094060606
Energy: 0.8541494317922761
Energy: 0.886994781092309
Energy: 0.8622512560204508
Energy: 0.8869947810983079
Energy: 0.8210487275092933
Energy: 0.8869947810950778
Energy: 0.8622512560107606

minimum gb energy = 0.7634925937001819 eV
minimum distance =  2.35953400956036 Angstroms
sigma value = 43


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

Energy: 1.0514291792331636
Energy: 0.9233702224008924
Energy: 1.0039052795497865
Energy: 0.9233702224014593
Energy: 1.0514291792359975
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Energy: 0.9636084434540542
Energy: 0.8605048813301672
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Energy: 0.8605048813256326
Energy: 0.8544998064771713
Energy: 1.0188556373234803
Energy: 0.8546539331535115
Energy: 1.0188556373240472
Energy: 0.8544998064732036
Energy: 1.0188556373240472
Energy: 0.9399493021010357
Energy: 0.887933871706858
Energy: 0.939949302099902
Energy: 0.8879338717113925
Energy: 0.9399493020976346
Energy: 0.8879338717113925
Energy: 0.9280840467732889
Energy: 0.8999799253152025
Energy: 0.9280840467732889
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Energy: 0.8999799253146357
Energy: 0.9093687030349239
Energy: 0.9180043656401661
Energy: 0.9093687030349239
Energy: 0.9180043656430001
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Energy: 0.9180043656424333
Energy: 0.9005761312498083
Energy: 0.9914855002350191
Energy: 0.9005761312549094
Energy: 0.9914855002321853
Energy: 0.9005761312537759
Energy: 0.9914855002344524
Energy: 0.8978994137429566
Energy: 0.9134561359033184
Energy: 0.8979063843455746
Energy: 0.9134561358959499
Energy: 0.8978994137429566
Energy: 0.9134561359112536
Energy: 0.9973593910175627
Energy: 0.8438312550274217
Energy: 0.9973593910169958
Energy: 0.8438312550257212
Energy: 0.997359391019263
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Energy: 0.855885499601489
Energy: 0.8923418043086699
Energy: 0.8558854996026224
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Energy: 0.855885499601489
Energy: 0.8923418043092366
Energy: 0.9419802095951316
Energy: 0.8963647844350056
Energy: 0.9419802095934311
Energy: 0.8963647844378395
Energy: 0.9419802095939979
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Energy: 0.8984679076617135
Energy: 0.9538833715364335
Energy: 0.8984679076605797
Energy: 0.953883362561605
Energy: 0.8984679076605797
Energy: 0.9538833413921634
Energy: 0.9484285185374064
Energy: 0.9168425169090634
Energy: 0.9484806259249812
Energy: 0.916842516913031
Energy: 0.9484285185396738
Energy: 0.916842516913031
Energy: 0.8408126218633566
Energy: 0.9985660991018003
Energy: 0.82872450272858
Energy: 0.9985660991001
Energy: 0.8408126218661905
Energy: 0.9985660991001
Energy: 0.8633532829703768
Energy: 0.9235579803168686
Energy: 0.8633532829703768
Energy: 0.9235579803197027
Energy: 0.8633532829709436
Energy: 0.9235579803191358
Energy: 0.902903673527789
Energy: 0.9222336256351056
Energy: 0.9029036735243883
Energy: 0.9222336256345388
Energy: 0.9029036735255219
Energy: 0.9222336256345388
Energy: 0.9089607692458357
Energy: 0.860469633419801
Energy: 0.9089607692458357
Energy: 0.8604696334237686
Energy: 0.9089607692458357
Energy: 0.8604696334243355
Energy: 0.9782293637923749
Energy: 0.9008127686082816
Energy: 0.9290146019033519
Energy: 0.9008127686060142
Energy: 0.9782293637957759
Energy: 0.9008127686060142
Energy: 0.9749085809796826
Energy: 0.8962724259104385
Energy: 0.9242304000781919
Energy: 0.8962724259093051
Energy: 0.9749085809785489
Energy: 0.8962724259093051
Energy: 0.9821365016559738
Energy: 0.9396578577156384
Energy: 0.9821365016537066
Energy: 0.9396578577173389
Energy: 0.9821365016525729
Energy: 0.9396578577173389
Energy: 0.8729373910420234
Energy: 0.8850398533101145
Energy: 0.8729373910397562
Energy: 0.8850398533072804
Energy: 0.8729373910391893
Energy: 0.8850398533067135
Energy: 0.9327571053629078
Energy: 0.9393676723735543
Energy: 0.9327571053640414
Energy: 0.939367672374688
Energy: 0.9327571053623409
Energy: 0.939367672374688
Energy: 0.8285472400335362
Energy: 0.9536727443611798
Energy: 0.8285472400324027
Energy: 0.9536727443617466
Energy: 0.8285472400301352
Energy: 0.9536727443611798
Energy: 0.9514579821498631
Energy: 0.9194197950291194
Energy: 0.9514579821481628
Energy: 0.9194197950308197
Energy: 0.9514579821498631
Energy: 0.9194197950308197
Energy: 0.8978909974784981
Energy: 0.8902109635277705
Energy: 0.8978863787122869
Energy: 0.8902109635283374
Energy: 0.8978909974733966
Energy: 0.8902109635283374
Energy: 0.9978275356230419
Energy: 0.9547091500033165
Energy: 0.9978275356213414
Energy: 0.9547091500021827
Energy: 0.9978275356236088
Energy: 0.9547091500016159
Energy: 0.9015284144964706
Energy: 0.916637498151363
Energy: 0.901528414495337
Energy: 0.9166374981530635
Energy: 0.901528414495337
Energy: 0.9166374981530635
Energy: 0.9126242797356229
Energy: 0.8423983927428647
Energy: 0.9126242797378903
Energy: 0.8423983927405975
Energy: 0.9126242797344893
Energy: 0.8423983927400308
Energy: 0.8978752961262106
Energy: 0.9259622876583026
Energy: 0.8978752961273442
Energy: 0.9259622876566022
Energy: 0.8978752961279111
Energy: 0.9259622876571688
Energy: 0.952706202588608
Energy: 0.9421560682941066
Energy: 0.9527062025874745
Energy: 0.942156068287305
Energy: 0.9527062025869076
Energy: 0.9421560682878718
Energy: 0.8898235116199465
Energy: 0.9195848038894493
Energy: 0.8899095569340807
Energy: 0.9195848038911498
Energy: 0.889922248440057
Energy: 0.919584803890583

minimum gb energy = 0.8285472400301352 eV
minimum distance =  2.28157547998686 Angstroms
sigma value = 57


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

Energy: 0.955342272414966
Energy: 0.8501347244372064
Energy: 0.8993395071984254
Energy: 0.8501347244452793
Energy: 0.9553422724171677
Energy: 0.8501347244452793
Energy: 0.9250021944209579
Energy: 0.8212696621400742
Energy: 0.9250021944224257
Energy: 0.8212696621437436
Energy: 0.9250021944238934
Energy: 0.8212696621430098
Energy: 0.9464232573196361
Energy: 0.9646154676762925
Energy: 0.9447627676903632
Energy: 0.9646154676740908
Energy: 0.9464232573181683
Energy: 0.9646154676748248
Energy: 1.0451545999795118
Energy: 0.9139525265170355
Energy: 1.0451545999816803
Energy: 0.9139525265199709
Energy: 1.0451545999802458
Energy: 0.9139525265199709
Energy: 0.9703285321380397
Energy: 0.9304401103629878
Energy: 0.970328532136572
Energy: 0.9304401103666573
Energy: 0.9703285321373057
Energy: 0.9304401103673912
Energy: 0.9333497348346451
Energy: 0.8176841970548382
Energy: 0.9333497348302418
Energy: 0.8176841970533705
Energy: 0.9333497348309757
Energy: 0.8176841970541044
Energy: 0.9547476237426799
Energy: 0.9787731074392941
Energy: 0.9547476237419459
Energy: 0.9787731074378264
Energy: 0.9547476237434137
Energy: 0.9787731074385602
Energy: 0.8975615996517587
Energy: 0.8536124875822366
Energy: 0.8975615996524927
Energy: 0.8536124875822366
Energy: 0.897561599650291
Energy: 0.8536124875822366
Energy: 0.9600173270459891
Energy: 0.8206058866501137
Energy: 0.9600173270437873
Energy: 0.820605886647912
Energy: 0.9600173270467229
Energy: 0.820605886647912
Energy: 0.813423741955024
Energy: 0.8508153258189096
Energy: 0.8133870245078736
Energy: 0.8508153258225791
Energy: 0.8134237419557577
Energy: 0.8508153258225791
Energy: 0.8778651548952021
Energy: 0.9434811718959155
Energy: 0.8778651548959361
Energy: 0.9434811718937138
Energy: 0.8778651548981378
Energy: 0.9434811718937138
Energy: 0.8854367541770037
Energy: 0.9322501721952144
Energy: 0.8854367541777375
Energy: 0.9322501721974161
Energy: 0.8854367541784715
Energy: 0.9322501721908111
Energy: 0.9131027220532245
Energy: 0.8208641560406787
Energy: 0.9131027220546925
Energy: 0.8208641560443483
Energy: 0.9131027220561602
Energy: 0.8208641560443483
Energy: 0.9536021004824724
Energy: 0.8269199009718918
Energy: 0.8668401561744464
Energy: 0.8269199009696903
Energy: 0.9536021004824724
Energy: 0.8269199009696903
Energy: 0.919715268634914
Energy: 0.8230357322651456
Energy: 0.8364781769051364
Energy: 0.8230357322636778
Energy: 0.9197152686378496
Energy: 0.8230357322636778
Energy: 0.9787391778216256
Energy: 0.8842740887451418
Energy: 0.9787391778260289
Energy: 0.8842740887400379
Energy: 0.9787391778260289
Energy: 0.8842740887400379
Energy: 0.8129902415092457
Energy: 0.8639295703920523
Energy: 0.8128049629914678
Energy: 0.8639295703913183
Energy: 0.8129902415085117
Energy: 0.8639295703913183
Energy: 0.8807036516421853
Energy: 0.9107524371548005
Energy: 0.8807036516429193
Energy: 0.910752437151131
Energy: 0.8807036516429193
Energy: 0.910752437151131
Energy: 0.8125349619982901
Energy: 0.863983422642871
Energy: 0.8125349619982901
Energy: 0.8639834226355322
Energy: 0.8125349620034275
Energy: 0.8639834226355322
Energy: 0.9215303575316637
Energy: 0.8841945440240391
Energy: 0.9215303575338654
Energy: 0.8841945440299102
Energy: 0.9215303575353331
Energy: 0.8841945440299102
Energy: 0.8365050345634688
Energy: 0.8262780777606957
Energy: 0.8365050345612671
Energy: 0.8262780777650991
Energy: 0.8365050345634688
Energy: 0.8262780777650991
Energy: 0.9553418941933666
Energy: 0.9036338312379903
Energy: 0.9553418941926326
Energy: 0.9036338312394583
Energy: 0.9553418941911649
Energy: 0.9036338312394583
Energy: 0.9501323914470697
Energy: 0.822183736697519
Energy: 0.9503660098005896
Energy: 0.8221837366909138
Energy: 0.9501323914470697
Energy: 0.8221837366909138
Energy: 0.9340564521013365
Energy: 0.9121796532859547
Energy: 0.934141907089509
Energy: 0.9121795493925494
Energy: 0.9340564520984008
Energy: 0.9121792864456537

minimum gb energy = 0.8125349619982901 eV
minimum distance =  2.11240379377666 Angstroms
sigma value = 17


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

Energy: 0.837433855973318
Energy: 0.7526805711955156
Energy: 0.837433855973318
Energy: 0.7526805711955156
Energy: 0.8374338559743557
Energy: 0.7526805711955156
Energy: 0.7288195819178029
Energy: 0.7205623437519253
Energy: 0.7288195819188408
Energy: 0.7205623437519253
Energy: 0.7288195819178029
Energy: 0.7205623437519253
Energy: 0.8639456890733249
Energy: 0.8429660993504541
Energy: 0.8639456890722871
Energy: 0.8429660993504541
Energy: 0.8639456890733249
Energy: 0.842966099351492
Energy: 0.6883232735671982
Energy: 0.857549141763073
Energy: 0.6883232735671982
Energy: 0.857549141763073
Energy: 0.6883232735671982
Energy: 0.8575491417641106
Energy: 0.8425678441564881
Energy: 0.8031308912245757
Energy: 0.8425678441596018
Energy: 0.8031308912245757
Energy: 0.8425678441585639
Energy: 0.8031308912245757
Energy: 0.7801034400714439
Energy: 0.8243717121378231
Energy: 0.7801034400714439
Energy: 0.8243717121378231
Energy: 0.7801034400714439
Energy: 0.8243717121378231
Energy: 0.7934062657079
Energy: 0.7305570115277501
Energy: 0.7934062657079
Energy: 0.7305570115267122
Energy: 0.793406265706862
Energy: 0.7305570115277501
Energy: 0.6882679102194621
Energy: 0.8255715584722728
Energy: 0.6882679102184242
Energy: 0.8255715584722728
Energy: 0.6882679102184242
Energy: 0.8255715584722728
Energy: 0.8381617918510016
Energy: 0.7206222407222959
Energy: 0.8381617918510016
Energy: 0.7206222407222959
Energy: 0.8381617918510016
Energy: 0.7206222407222959
Energy: 0.7727007816550657
Energy: 0.7304245089342241
Energy: 0.7727007816550657
Energy: 0.7304245089342241
Energy: 0.7727007816550657
Energy: 0.7304245089342241
Energy: 0.7614303218310231
Energy: 0.8354041373410012
Energy: 0.7614303218299853
Energy: 0.8354041373410012
Energy: 0.7614303218310231
Energy: 0.8354041373420391
Energy: 0.7880147572610198
Energy: 0.7199502321433815
Energy: 0.7880147572620577
Energy: 0.7199502321433815
Energy: 0.7880147572620577
Energy: 0.7199502321433815
Energy: 0.6883467145624241
Energy: 0.8239860933385096
Energy: 0.6883467145634621
Energy: 0.8239860933385096
Energy: 0.6883467145634621
Energy: 0.8239860933385096
Energy: 0.7723406524674095
Energy: 0.8451731075515443
Energy: 0.7723406524674095
Energy: 0.8451731075515443
Energy: 0.7723406524674095
Energy: 0.8451731075515443
Energy: 0.779482177292974
Energy: 0.8035867139923497
Energy: 0.779482177292974
Energy: 0.8035867139933875
Energy: 0.779482177292974
Energy: 0.8035867139933875
Energy: 0.7796933184523108
Energy: 0.9601339785374687
Energy: 0.7796933184523108
Energy: 0.9601339785374687
Energy: 0.7796933184512731
Energy: 0.9601339785374687
Energy: 0.770994101714429
Energy: 0.8457746193417734
Energy: 0.770994101714429
Energy: 0.8457746193417734
Energy: 0.770994101714429
Energy: 0.8457746193417734

minimum gb energy = 0.6882679102184242 eV
minimum distance =  2.34378099636823 Angstroms
sigma value = 17


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

Energy: 0.779085233801758
Energy: 0.7038514305346077
Energy: 0.7498551995913051
Energy: 0.7038514305374134
Energy: 0.7790852338045271
Energy: 0.7038514305374134
Energy: 0.718525591766406
Energy: 0.7044042612463967
Energy: 0.685735739129877
Energy: 0.7044042612443927
Energy: 0.7185255917627987
Energy: 0.7044042612439918
Energy: 0.8094936528648888
Energy: 0.7592214288508533
Energy: 0.7684419150485841
Energy: 0.7592214288488492
Energy: 0.8094936528628849
Energy: 0.7592214288488492
Energy: 0.6568349723639898
Energy: 0.7129778149956486
Energy: 0.6566972424462233
Energy: 0.7129778149924423
Energy: 0.6568349723627873
Energy: 0.7129778149868312
Energy: 0.7793354506937162
Energy: 0.6740612836817298
Energy: 0.7793354506937162
Energy: 0.674061283689345
Energy: 0.7793354506881052
Energy: 0.6740612836897457
Energy: 0.7754152152407059
Energy: 0.687687126597228
Energy: 0.7752512314113408
Energy: 0.6876871265908153
Energy: 0.7754152152395035
Energy: 0.687687126591216
Energy: 0.687449025515457
Energy: 0.7114479244654847
Energy: 0.687449025515457
Energy: 0.7114479244642822
Energy: 0.6874490255166594
Energy: 0.7114479244634806
Energy: 0.7213016661234267
Energy: 0.8529867097966749
Energy: 0.7213016661222242
Energy: 0.8529867097922662
Energy: 0.7213016661342116
Energy: 0.8529867097922662
Energy: 0.7178551706792783
Energy: 0.7201653193145561
Energy: 0.7178551706804807
Energy: 0.7201653193181631
Energy: 0.7178551706800799
Energy: 0.7201653193173615
Energy: 0.6880351552917762
Energy: 0.6446331299303055
Energy: 0.6880351552925776
Energy: 0.6446331299355159
Energy: 0.6880351552945817
Energy: 0.644633129935115
Energy: 0.6566911774738471
Energy: 0.841629154369574
Energy: 0.6566911774742478
Energy: 0.8416291543631614
Energy: 0.6566911774738471
Energy: 0.8416291543631614
Energy: 0.7945733320264715
Energy: 0.7842565460706792
Energy: 0.7945733320308804
Energy: 0.7842565460742864
Energy: 0.7945733320336859
Energy: 0.7842565460750879
Energy: 0.7536719827812823
Energy: 0.6988064195154248
Energy: 0.7536719827812823
Energy: 0.6988064195094493
Energy: 0.7536719827828855
Energy: 0.6988064195094493
Energy: 0.6982140113710857
Energy: 0.7730176439743621
Energy: 0.6982140113750936
Energy: 0.7730176439763295
Energy: 0.6982140113726889
Energy: 0.7730176439763295
Energy: 0.7236550961855186
Energy: 0.692258540629542
Energy: 0.7236573820227843
Energy: 0.6922585406331491
Energy: 0.7236550961831139
Energy: 0.6922585406331491
Energy: 0.710704605755288
Energy: 0.8220904653863021
Energy: 0.7107685826377101
Energy: 0.8220904653907108
Energy: 0.7107046057568911
Energy: 0.8220904653907108
Energy: 0.6971281981354954
Energy: 0.7763368638652122
Energy: 0.6971281981330908
Energy: 0.7763368638648114
Energy: 0.6971281981255121
Energy: 0.7763368638648114
Energy: 0.8103090063191501
Energy: 0.8692525379203028
Energy: 0.8103090063167454
Energy: 0.8692525379106836
Energy: 0.8103090063159438
Energy: 0.8692525379102829
Energy: 0.7029391614792907
Energy: 0.7953717356334826
Energy: 0.702939161478489
Energy: 0.7953717356330818
Energy: 0.7029391614804931
Energy: 0.7953717356350858
Energy: 0.6966084684935232
Energy: 0.6394488472029091
Energy: 0.6966084684955273
Energy: 0.6394488472153337
Energy: 0.6966084684959281
Energy: 0.639448847214532
Energy: 0.7218212906564175
Energy: 0.7957247882178491
Energy: 0.7218212906580207
Energy: 0.7957247882174484
Energy: 0.7218212906604254
Energy: 0.7957247882182501
Energy: 0.7404243426193411
Energy: 0.869372002877508
Energy: 0.7404243426201427
Energy: 0.8693720028783096
Energy: 0.7404243426193411
Energy: 0.8693720028783096
Energy: 0.6972832570881237
Energy: 0.7502294336080758
Energy: 0.6972832570929332
Energy: 0.7502294336064727
Energy: 0.6972832570949371
Energy: 0.7502294336068734
Energy: 0.6569187906126944
Energy: 0.7670356446036869
Energy: 0.6569187906126944
Energy: 0.7670356446040878
Energy: 0.6569187906138969
Energy: 0.7670356446036869
Energy: 0.7566530648999474
Energy: 0.6925634808584114
Energy: 0.7566530649003482
Energy: 0.6925634808552049
Energy: 0.7566530649031538
Energy: 0.6925634808556057
Energy: 0.7393053977464661
Energy: 0.7824731877206856
Energy: 0.6983906383025716
Energy: 0.782473187725896
Energy: 0.7393053977520772
Energy: 0.782473187725896
Energy: 0.7183373182890898
Energy: 0.6928819271416784
Energy: 0.6898596500993321
Energy: 0.6928819271416784
Energy: 0.7183373182962677
Energy: 0.6928819271412776
Energy: 0.8077127238121129
Energy: 0.6923509051386867
Energy: 0.7670736704032608
Energy: 0.6923509051363183
Energy: 0.807712723814117
Energy: 0.6923509051359176
Energy: 0.6570549018283478
Energy: 0.8261510716374748
Energy: 0.6570095267192234
Energy: 0.8261510716398796
Energy: 0.6570549018315542
Energy: 0.8261510716402806
Energy: 0.6877348939087624
Energy: 0.6440168770950959
Energy: 0.6877348939027506
Energy: 0.6440168771051159
Energy: 0.6877348938975402
Energy: 0.6440168771051159
Energy: 0.7368544891444653
Energy: 0.7204122254541222
Energy: 0.7368544891384533
Energy: 0.7204122254549238
Energy: 0.7368544891364494
Energy: 0.7204122254549238
Energy: 0.7526710754744544
Energy: 0.8836566405049436
Energy: 0.7526710754740538
Energy: 0.8836566405021382
Energy: 0.7526710754764584
Energy: 0.8836566405029397
Energy: 0.6874764318855634
Energy: 0.6928136048527591
Energy: 0.6874764318863651
Energy: 0.6928136048523583
Energy: 0.6874764318859642
Energy: 0.6928136048523583
Energy: 0.7596745884918883
Energy: 0.6646720037388425
Energy: 0.7596745884954955
Energy: 0.6646720037316282
Energy: 0.7596745884958963
Energy: 0.664672003732029
Energy: 0.6857224340222633
Energy: 0.6735853064927123
Energy: 0.6857224340198584
Energy: 0.6735853064903077
Energy: 0.6857224340218625
Energy: 0.6735853064903077
Energy: 0.6566905414309486
Energy: 0.7479641473818969
Energy: 0.656690541430147
Energy: 0.7479641473790914
Energy: 0.6566905414329526
Energy: 0.7479641473782898
Energy: 0.8276865344900267
Energy: 0.6813784230093201
Energy: 0.827686534487221
Energy: 0.6813784230141297
Energy: 0.827686534487221
Energy: 0.6813784230141297
Energy: 0.7079762530208299
Energy: 0.6911502108507036
Energy: 0.707976253014818
Energy: 0.6911502108543107
Energy: 0.7079762530132149
Energy: 0.6911502108551124
Energy: 0.7498551995884996
Energy: 0.7038514305358102
Energy: 0.7498551995893011
Energy: 0.7038514305374134
Energy: 0.7498551995901028
Energy: 0.7038514305378142
Energy: 0.6857357391350875
Energy: 0.7486023909433812
Energy: 0.685735739131881
Energy: 0.7486023909445836
Energy: 0.6857357391350875
Energy: 0.7486023909441828
Energy: 0.8192781418236545
Energy: 0.7589649731851832
Energy: 0.8192787713994056
Energy: 0.758964973181576
Energy: 0.8192781418272618
Energy: 0.7589649731819768
Energy: 0.6568492392163401
Energy: 0.7761295577549547
Energy: 0.6568491318847709
Energy: 0.7761295577561572
Energy: 0.6568492392143362
Energy: 0.7761295577541532
Energy: 0.7793354506925139
Energy: 0.6742306940724965
Energy: 0.779335450694117
Energy: 0.6742306940704925
Energy: 0.7793354506881052
Energy: 0.6742306940708933

minimum gb energy = 0.6394488472029091 eV
minimum distance =  2.31402015771513 Angstroms
sigma value = 57


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

Energy: 0.6854156358456547
Energy: 0.6221327280457862
Energy: 0.685415635845002
Energy: 0.6221327280457862
Energy: 0.6854156358469597
Energy: 0.6221327280457862
Energy: 0.7048425456973684
Energy: 0.6132068850679538
Energy: 0.7048425456941054
Energy: 0.6132068850679538
Energy: 0.7048425456973684
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Energy: 0.7202338959235176
Energy: 0.6721721698300996
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Energy: 0.7202338959241701
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Energy: 0.593231228724053
Energy: 0.690825984441063
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Energy: 0.690825984441063
Energy: 0.5932312287220952
Energy: 0.690825984441063
Energy: 0.7065424934224853
Energy: 0.6071356222578603
Energy: 0.7065424934237905
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Energy: 0.7065424934231378
Energy: 0.6071356222572077
Energy: 0.6886083675785839
Energy: 0.613170757946633
Energy: 0.6886083675792365
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Energy: 0.6886083675792365
Energy: 0.6131707579459804
Energy: 0.7735073369836171
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Energy: 0.7833778832628887
Energy: 0.7814593898951574
Energy: 0.7833778832628887
Energy: 0.6281293112830858
Energy: 0.6146222939065675
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Energy: 0.7880397472631049
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Energy: 0.6257114277325837
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Energy: 0.626454551025575
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Energy: 0.7272454183284435
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Energy: 0.706454747229785
Energy: 0.6560698748593774
Energy: 0.7064547472271746
Energy: 0.6560698748580721
Energy: 0.7064547472278272
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Energy: 0.6424922272280477
Energy: 0.7014997640193474
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Energy: 0.6424922272280477
Energy: 0.701499764018695
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Energy: 0.7106371066672613
Energy: 0.6422664404062861
Energy: 0.7106371066672613
Energy: 0.6422664404030232
Energy: 0.7106371066666088
Energy: 0.7467611277124903
Energy: 0.6218483259194627
Energy: 0.7467611277151007
Energy: 0.6218483259188101
Energy: 0.746761127714448
Energy: 0.6218483259188101
Energy: 0.5945205944837472
Energy: 0.7424449792542879
Energy: 0.5945205944850523
Energy: 0.7424449792549404
Energy: 0.5945205944850523
Energy: 0.7424449792542879
Energy: 0.6239948048338699
Energy: 0.6884741989862742
Energy: 0.6239948048338699
Energy: 0.6884741989862742
Energy: 0.6239948048338699
Energy: 0.6884741989862742
Energy: 0.674584644111602
Energy: 0.7930576500255406
Energy: 0.6745846441089917
Energy: 0.7930576500242356
Energy: 0.6745846441096442
Energy: 0.793057650024888
Energy: 0.5859612337052026
Energy: 0.7434211926070599
Energy: 0.5859612337052026
Energy: 0.7434211926064072
Energy: 0.5859612337052026
Energy: 0.7434211926064072
Energy: 0.6420572302833408
Energy: 0.6622643409269554
Energy: 0.6420572302820358
Energy: 0.6622643409269554
Energy: 0.6420572302852987
Energy: 0.6622643409269554
Energy: 0.6453986391862521
Energy: 0.8537705810852579
Energy: 0.6453986391862521
Energy: 0.8537705810846054
Energy: 0.6453986391875571
Energy: 0.8537705810852579
Energy: 0.6464314112179813
Energy: 0.7992301316192578
Energy: 0.6464314112160235
Energy: 0.7992301316186052
Energy: 0.6464314112192865
Energy: 0.7992301316192578
Energy: 0.6245717008044415
Energy: 0.6615013527316272
Energy: 0.624571700805094
Energy: 0.6615013527309747
Energy: 0.6245717008057466
Energy: 0.6615013527309747
Energy: 0.5965690398494219
Energy: 0.7423575358671304
Energy: 0.5965690398500745
Energy: 0.7423575358684356
Energy: 0.5965690398481168
Energy: 0.742357535867783

minimum gb energy = 0.5859612337052026 eV
minimum distance =  2.31541761029359 Angstroms
sigma value = 43


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

Energy: 0.7541636213099935
Energy: 0.5569243427248749
Energy: 0.754163621310469
Energy: 0.5569243427248749
Energy: 0.7541636213114199
Energy: 0.5569243427248749
Energy: 0.6077228364882676
Energy: 0.6444272517572445
Energy: 0.6077228364906451
Energy: 0.64442725175772
Energy: 0.6077228364920714
Energy: 0.6444272517581955
Energy: 0.6087526025906685
Energy: 0.6445871158870445
Energy: 0.6087526025901931
Energy: 0.6445871158870445
Energy: 0.6087526025897176
Energy: 0.6445871158870445
Energy: 0.6319931978925237
Energy: 0.5873841430945134
Energy: 0.6319931978939503
Energy: 0.5873841430945134
Energy: 0.6319931978934747
Energy: 0.5873841430945134
Energy: 0.6069470635642223
Energy: 0.5379681642256535
Energy: 0.606947063561845
Energy: 0.5379681642261288
Energy: 0.6069470635656489
Energy: 0.5379681642256535
Energy: 0.5783988023230096
Energy: 0.6114824542122054
Energy: 0.5783988023234851
Energy: 0.6114824542122054
Energy: 0.5783988023234851
Energy: 0.6114824542122054
Energy: 0.6149105512416896
Energy: 0.5748905016375702
Energy: 0.614910551241214
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Energy: 0.5748905016375702
Energy: 0.7313541932826403
Energy: 0.5956671782369006
Energy: 0.7313541932840666
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Energy: 0.7313541932821648
Energy: 0.5956671782373761
Energy: 0.5558897419258377
Energy: 0.6037107277632664
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Energy: 0.6037107277627909
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Energy: 0.6148346629147311
Energy: 0.5480625619839297
Energy: 0.6148346629152066
Energy: 0.5480625619844052
Energy: 0.6148346629142556
Energy: 0.5480625619829788
Energy: 0.6170560756669978
Energy: 0.6016851686361705
Energy: 0.6170560756655713
Energy: 0.6016851686361705
Energy: 0.6170560756660468
Energy: 0.601685168635695
Energy: 0.5252695967841781
Energy: 0.602933503339472
Energy: 0.5252695967841781
Energy: 0.602933503339472
Energy: 0.5252695967837026
Energy: 0.6029335033389966
Energy: 0.6146311027695714
Energy: 0.5235721731214558
Energy: 0.6146311027690959
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Energy: 0.6146311027690959
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Energy: 0.6130544459120499
Energy: 0.6019086743204974
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Energy: 0.6019086743200219
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Energy: 0.5465003337231155
Energy: 0.6028657002037618
Energy: 0.54650033372264
Energy: 0.6028657002042372
Energy: 0.5465003337240664
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Energy: 0.6306702971216169
Energy: 0.6063512532083138
Energy: 0.6306702971211416
Energy: 0.6063512532083138
Energy: 0.6306702971216169
Energy: 0.6063512532078383
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Energy: 0.5963492500887861
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Energy: 0.6149851767299527
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Energy: 0.5631730644583551
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Energy: 0.5631730644588305
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Energy: 0.5631730644583551
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Energy: 0.6103838282119228
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Energy: 0.6103838282138248
Energy: 0.6117716606546926
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Energy: 0.611771660655168
Energy: 0.6310979512462654
Energy: 0.5977624582384126
Energy: 0.631097951246741
Energy: 0.5977624582374617
Energy: 0.6310979512481673
Energy: 0.597762458237937
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Energy: 0.6040320889302752
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Energy: 0.6512007255768858
Energy: 0.5551711219809974
Energy: 0.6512007255787877
Energy: 0.5551711219809974
Energy: 0.6512007255750271
Energy: 0.5551711219790955
Energy: 0.6617138604299231
Energy: 0.6051650640423847
Energy: 0.6617138604284966
Energy: 0.6051650640419093
Energy: 0.6617138604299231
Energy: 0.6051650640419093
Energy: 0.6351762207076599
Energy: 0.5488586541642521
Energy: 0.635176220706709
Energy: 0.5488586541652029
Energy: 0.6351762207076599
Energy: 0.5488586541642521
Energy: 0.6141252420885969
Energy: 0.528190309492861
Energy: 0.6141252420895477
Energy: 0.5281903094942876
Energy: 0.6141252420890723
Energy: 0.5281903094938121
Energy: 0.6134769561295107
Energy: 0.587443216978987
Energy: 0.6134769561299862
Energy: 0.5874432169785114
Energy: 0.6134769561285597
Energy: 0.5874432169785114
Energy: 0.5841857240177699
Energy: 0.6889651751087122
Energy: 0.5841857240187208
Energy: 0.6889651751087122
Energy: 0.5841857240191964
Energy: 0.6889651751087122
Energy: 0.592514042399731
Energy: 0.5918108658477
Energy: 0.5925140424002066
Energy: 0.5918108658477
Energy: 0.592514042399731
Energy: 0.5918108658481754
Energy: 0.5338981680536798
Energy: 0.5579075986396169
Energy: 0.5338981680532046
Energy: 0.5579075986396169
Energy: 0.5338981680532046
Energy: 0.5579075986396169
Energy: 0.5451704247878038
Energy: 0.6572250556570982
Energy: 0.5451704247873282
Energy: 0.6572250556570982
Energy: 0.5451704247873282
Energy: 0.6572250556570982
Energy: 0.5154899200180773
Energy: 0.7331818845640478
Energy: 0.5154899200161753
Energy: 0.7331818845640478
Energy: 0.5154899200161753
Energy: 0.7331818845640478
Energy: 0.534858220681248
Energy: 0.5431639841578286
Energy: 0.534858220681248
Energy: 0.5431639841578286
Energy: 0.5348582206821989
Energy: 0.5431639841578286
Energy: 0.5244523687641766
Energy: 0.595491812621993
Energy: 0.5244523687617991
Energy: 0.5954918126200911
Energy: 0.5244523687651275
Energy: 0.5954918126215175
Energy: 0.618303531082838
Energy: 0.6645672081858891
Energy: 0.618303531081887
Energy: 0.6645672081858891
Energy: 0.6183035310823626
Energy: 0.6645672081858891
Energy: 0.5365207612392336
Energy: 0.5220645510531168
Energy: 0.5365207612397092
Energy: 0.5220645510531168
Energy: 0.5365207612392336
Energy: 0.5220645510535923
Energy: 0.48319399790993284
Energy: 0.5949158913075815
Energy: 0.48319399791088374
Energy: 0.594915891308057
Energy: 0.4831939979104083
Energy: 0.594915891308057

minimum gb energy = 0.48319399790993284 eV
minimum distance =  2.31970546204593 Angstroms
sigma value = 81


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

Energy: 0.032062657512370946
Energy: 0.06492112291292448
Energy: 0.032062657512549615
Energy: 0.06492112291151494
Energy: 0.032062657512549615
Energy: 0.06492112291395681
Energy: 0.625876321073491
Energy: 0.03245314076232674
Energy: 0.6258763210749005
Energy: 0.03245402680813626
Energy: 0.625876321073491
Energy: 0.032456430077134196
Energy: 0.6258764016745118
Energy: 0.03337952661099468
Energy: 0.6258764016739758
Energy: 0.03337988112257775
Energy: 0.6258764016739758
Energy: 0.033379949457930234
Energy: 0.032062657512549615
Energy: 0.06492112291256713
Energy: 0.032062657512370946
Energy: 0.0649211229118723
Energy: 0.032062657512370946
Energy: 0.06492112291536634
Energy: 0.625876321074027
Energy: 0.03245387462426592
Energy: 0.6258763210745432
Energy: 0.032454808141469234
Energy: 0.6258763210733322
Energy: 0.03245381673303259
Energy: 0.625876401675028
Energy: 0.03337856942220822
Energy: 0.6258764016746905
Energy: 0.03338268513468252
Energy: 0.6258764016741545
Energy: 0.03338245170142747
Energy: 0.03206265751288711
Energy: 0.06492112291151494
Energy: 0.032062657512549615
Energy: 0.06492112291205096
Energy: 0.032062657512370946
Energy: 0.06492112290645255
Energy: 0.6258763210724586
Energy: 0.032453298239954104
Energy: 0.6258763210738483
Energy: 0.03245352827221237
Energy: 0.6258763210736696
Energy: 0.032454217982041504
Energy: 0.625876401673817
Energy: 0.03337954946937842
Energy: 0.6258764016748493
Energy: 0.033379091287656135
Energy: 0.6258764016739758
Energy: 0.033378185341073195
Energy: 0.03206265751288711
Energy: 0.06492112291395681
Energy: 0.032062657512549615
Energy: 0.06492112291274581
Energy: 0.032062657512549615
Energy: 0.064921122915009

minimum gb energy = 0.032062657512370946 eV
minimum distance =  2.54772612809936 Angstroms
sigma value = 3


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

Energy: 0.5955398881117441
Energy: 0.5169832582482027
Energy: 0.5955398881117441
Energy: 0.51698325824768
Energy: 0.5955398881101757
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Energy: 0.5308459770551197
Energy: 0.5325170779839646
Energy: 0.530845977054597
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Energy: 0.540384763309709
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Energy: 0.5403847633107546
Energy: 0.4678732343865028
Energy: 0.6105203432989346
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Energy: 0.6105203433015486
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Energy: 0.5474267686446794
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Energy: 0.5474267686452022
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Energy: 0.5573097463778662
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Energy: 0.5479824879055665
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Energy: 0.5358523465484161
Energy: 0.5553799027407076
Energy: 0.5493795618370034
Energy: 0.5553799027401848
Energy: 0.5493795618375262
Energy: 0.5553799027407076
Energy: 0.5493795618370034

minimum gb energy = 0.46775282227312937 eV
minimum distance =  2.36757154321878 Angstroms
sigma value = 67


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

Energy: 0.7358593908035453
Energy: 0.6902330492591464
Energy: 0.7358593908035453
Energy: 0.6902330492591464
Energy: 0.7358593908035453
Energy: 0.6902330492591464
Energy: 0.6611381431307753
Energy: 0.6722218583522918
Energy: 0.6611381431322652
Energy: 0.6722218583522918
Energy: 0.6611381431315202
Energy: 0.6722218583522918
Energy: 0.69444762616922
Energy: 0.6805140942319968
Energy: 0.6944476261684751
Energy: 0.6805140942327417
Energy: 0.6944476261684751
Energy: 0.6805140942327417
Energy: 0.6949240283512947
Energy: 0.6697695055792264
Energy: 0.6949240283505497
Energy: 0.6697695055755016
Energy: 0.6949240283498047
Energy: 0.6697695055807162
Energy: 0.5993159514617283
Energy: 0.6463173703674044
Energy: 0.5993159514617283
Energy: 0.6463173703666595
Energy: 0.5993159514609834
Energy: 0.6463173703666595
Energy: 0.692849217780295
Energy: 0.6798408125895719
Energy: 0.692849217780295
Energy: 0.6798408125895719
Energy: 0.692849217780295
Energy: 0.6798408125895719
Energy: 0.6708212169125067
Energy: 0.7229877437678058
Energy: 0.6708212169117619
Energy: 0.7229877437678058
Energy: 0.6708212169125067
Energy: 0.7229877437678058
Energy: 0.6553883990367121
Energy: 0.6444798032916851
Energy: 0.6553883990382019
Energy: 0.6444798032916851
Energy: 0.6553883990367121
Energy: 0.6444798032916851
Energy: 0.7114712873969911
Energy: 0.7228478450364861
Energy: 0.711471287395501
Energy: 0.7228478450364861
Energy: 0.7114712873962459
Energy: 0.7228478450364861
Energy: 0.6678235266687769
Energy: 0.7412663314048472
Energy: 0.6678235266687769
Energy: 0.7412663314055921
Energy: 0.6678235266687769
Energy: 0.7412663314048472
Energy: 0.7375413499845492
Energy: 0.6818586059283669
Energy: 0.737541349986039
Energy: 0.6818586059283669
Energy: 0.7375413499852942
Energy: 0.6818586059283669
Energy: 0.6680130787694926
Energy: 0.6823780534147644
Energy: 0.6680130787687477
Energy: 0.6823780534147644
Energy: 0.6680130787687477
Energy: 0.6823780534147644
Energy: 0.6669808166473853
Energy: 0.7812161992329424
Energy: 0.6669808166466404
Energy: 0.7812161992329424
Energy: 0.6669808166481302
Energy: 0.7812161992336873
Energy: 0.6735587463383164
Energy: 0.7001439894720811
Energy: 0.6735587463390612
Energy: 0.7001439894728261
Energy: 0.6735587463375713
Energy: 0.7001439894720811
Energy: 0.6645379840456854
Energy: 0.6547848244948441
Energy: 0.6645379840449405
Energy: 0.6547848244955891
Energy: 0.6645379840479202
Energy: 0.6547848244955891
Energy: 0.7184309962788258
Energy: 0.6772647237610302
Energy: 0.7184309962795707
Energy: 0.6772647237625201
Energy: 0.7184309962803156
Energy: 0.6772647237617752
Energy: 0.6942758440428537
Energy: 0.6964571894094235
Energy: 0.6942758440428537
Energy: 0.6964571894094235
Energy: 0.6942758440428537
Energy: 0.6964571894094235
Energy: 0.6795757629303907
Energy: 0.6434937315108958
Energy: 0.6795757629311355
Energy: 0.6434937315108958
Energy: 0.6795757629303907
Energy: 0.6434937315108958
Energy: 0.6787365315606253
Energy: 0.6961616448183509
Energy: 0.6787365315613701
Energy: 0.6961616448176058
Energy: 0.6787365315606253
Energy: 0.6961616448183509
Energy: 0.7650194561896877
Energy: 0.6815453500754841
Energy: 0.7650194561889427
Energy: 0.6815453500754841
Energy: 0.7650194561904325
Energy: 0.6815453500747393
Energy: 0.7108122477618091
Energy: 0.6529640570623422
Energy: 0.7108122477618091
Energy: 0.6529640570615972
Energy: 0.7108122477618091
Energy: 0.6529640570623422
Energy: 0.7027152657612602
Energy: 0.7282163846666126
Energy: 0.7027152657605152
Energy: 0.7282163846673575
Energy: 0.7027152657605152
Energy: 0.7282163846666126
Energy: 0.6436099858963338
Energy: 0.6804924749829482
Energy: 0.643609985894844
Energy: 0.6804924749822031
Energy: 0.6436099858970786
Energy: 0.6804924749829482

minimum gb energy = 0.5993159514609834 eV
minimum distance =  2.36827953202729 Angstroms
sigma value = 33


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

Energy: 0.8506807495101375
Energy: 0.7778331033921594
Energy: 0.8169858667852552
Energy: 0.7778331033987754
Energy: 0.8506807495106102
Energy: 0.7778331033987754
Energy: 0.7691744021458955
Energy: 0.801057464722364
Energy: 0.7691744021496761
Energy: 0.8010574647185834
Energy: 0.769174402151996
Energy: 0.8010574647185834
Energy: 0.7889783983110483
Energy: 0.8023138553973278
Energy: 0.7889783983053776
Energy: 0.8023138554029988
Energy: 0.7889783983134112
Energy: 0.8023138554029988
Energy: 0.8011397258004794
Energy: 0.7792329483000516
Energy: 0.8011397257990617
Energy: 0.7792329482939082
Energy: 0.8011397257948085
Energy: 0.779232948294381
Energy: 0.7594139554401074
Energy: 0.7584477519630863
Energy: 0.7594139554382171
Energy: 0.7584477519588333
Energy: 0.7594139554382171
Energy: 0.7584477519588333
Energy: 0.8382790937608329
Energy: 0.7865970020145646
Energy: 0.838279093761778
Energy: 0.7739179048516358
Energy: 0.8382790937579973
Energy: 0.773917904850218
Energy: 0.751396510753326
Energy: 0.7819989319457485
Energy: 0.7513965107486003
Energy: 0.7819989319490566
Energy: 0.7513965107509631
Energy: 0.7819989319490566
Energy: 0.8165856018215402
Energy: 0.7857001507336506
Energy: 0.8165856018187049
Energy: 0.7857001507350682
Energy: 0.8165856018153967
Energy: 0.7857001507350682
Energy: 0.7865767566044373
Energy: 0.8393793927727295
Energy: 0.7865776323865711
Energy: 0.8393793927661134
Energy: 0.7865767566034922
Energy: 0.8393793927656409
Energy: 0.7974725081370049
Energy: 0.7923447939921379
Energy: 0.7974725081365324
Energy: 0.7648409844613492
Energy: 0.7974725081393678
Energy: 0.7816791652217068
Energy: 0.8318097522555526
Energy: 0.8060495976662571
Energy: 0.831805485879729
Energy: 0.8060495976676748
Energy: 0.8318097522522446
Energy: 0.8060495976672022
Energy: 0.738025870476594
Energy: 0.7816538413222406
Energy: 0.7380258704775392
Energy: 0.7816538413142068
Energy: 0.7380258704732859
Energy: 0.7816538413142068
Energy: 0.8116603773870456
Energy: 0.793603079988867
Energy: 0.8116603773861004
Energy: 0.7936030799869767
Energy: 0.8116603773894084
Energy: 0.7936030799869767
Energy: 0.7776259419451957
Energy: 0.8023856527207127
Energy: 0.7776259419423603
Energy: 0.8023856527244932
Energy: 0.7776259419404701
Energy: 0.8023856527244932
Energy: 0.7619327717503808
Energy: 0.7788414390695981
Energy: 0.7619327717484904
Energy: 0.7788414390625095
Energy: 0.7619327717442373
Energy: 0.7788414390620368
Energy: 0.7935010652236538
Energy: 0.7899808045325022
Energy: 0.7935010652212909
Energy: 0.7899808045306119
Energy: 0.7935010652203458
Energy: 0.7899808045306119
Energy: 0.8730074333803888
Energy: 0.7743762528521335
Energy: 0.8730074333818064
Energy: 0.7743762528568592
Energy: 0.873007433381334
Energy: 0.7743762528568592
Energy: 0.8051977967057934
Energy: 0.8594216770794383
Energy: 0.8051977967086287
Energy: 0.8594216770832187
Energy: 0.8051977967142995
Energy: 0.8594216770832187
Energy: 0.7347040571350323
Energy: 0.8079557265502604
Energy: 0.7347040571373951
Energy: 0.8079557265469524
Energy: 0.7347040571373951
Energy: 0.8079557265483701
Energy: 0.857291184347609
Energy: 0.7735818820370701
Energy: 0.8572911843480816
Energy: 0.7735818820356524
Energy: 0.8572911843485541
Energy: 0.7735818820356524
Energy: 0.7994423017602993
Energy: 0.8484498114759522
Energy: 0.7994340626534969
Energy: 0.8484498114811504
Energy: 0.7994423017584089
Energy: 0.8484498114811504
Energy: 0.766068176252242
Energy: 0.7612237724446915
Energy: 0.7660681762527146
Energy: 0.7612237724413835
Energy: 0.7660681762546049
Energy: 0.7612237724413835
Energy: 0.8317995130524893
Energy: 0.8063849387201502
Energy: 0.7598286316477844
Energy: 0.8063849387300741
Energy: 0.8317995130581601
Energy: 0.8063849387305467
Energy: 0.8431855813747836
Energy: 0.7775134854963902
Energy: 0.7977748665714286
Energy: 0.7775134855006434
Energy: 0.8431855813724207
Energy: 0.7775134855001707
Energy: 0.7655922907455165
Energy: 0.7743740171716863
Energy: 0.7370623503927496
Energy: 0.774374017158927
Energy: 0.7655922907478792
Energy: 0.7743740171593995
Energy: 0.8082243663822786
Energy: 0.8109952266692575
Energy: 0.8082243663832237
Energy: 0.810995226668785
Energy: 0.8082243663813335
Energy: 0.810995226668785
Energy: 0.7378635860003451
Energy: 0.7509613896587414
Energy: 0.7378635859993998
Energy: 0.7509613896516527
Energy: 0.7378635860055003
Energy: 0.7509613896516527
Energy: 0.8022311444998464
Energy: 0.8355876598237016
Energy: 0.8022311444941754
Energy: 0.8355876598270098
Energy: 0.8022311444922853
Energy: 0.8355876598270098
Energy: 0.7928437035319273
Energy: 0.7878987636439246
Energy: 0.7928437035314548
Energy: 0.7878987636406165
Energy: 0.7928437035319273
Energy: 0.7878987636410892
Energy: 0.7343092718844066
Energy: 0.854613577127788
Energy: 0.7343092718853518
Energy: 0.8546135771231053
Energy: 0.7343092718886598
Energy: 0.8546135771235778
Energy: 0.850016387108467
Energy: 0.826406090580701
Energy: 0.8500163871103573
Energy: 0.8264060905783382
Energy: 0.8500163871046865
Energy: 0.8264060905778655
Energy: 0.796039899904686
Energy: 0.7736138841921041
Energy: 0.7960748156543249
Energy: 0.773613884191159
Energy: 0.7960398999061039
Energy: 0.773613884191159
Energy: 0.8047258512950081
Energy: 0.9060401130195028
Energy: 0.8047261307709649
Energy: 0.9060401130218656
Energy: 0.8047258512931609
Energy: 0.9060401130223383
Energy: 0.8074512835186046
Energy: 0.7887718573321839
Energy: 0.8074512835134062
Energy: 0.7887718573425375
Energy: 0.8074512835119887
Energy: 0.7887718573425375
Energy: 0.73677697053034
Energy: 0.8033444999428165
Energy: 0.736776970527032
Energy: 0.8033444999413989
Energy: 0.736776970531285
Energy: 0.8033444999413989
Energy: 0.8117697445364737
Energy: 0.7806427753465257
Energy: 0.8117697445331657
Energy: 0.7806427753460533
Energy: 0.8117697445293851
Energy: 0.7806427753455807
Energy: 0.7675307054317249
Energy: 0.7906064655790853
Energy: 0.76753070543267
Energy: 0.7906064655800304
Energy: 0.7675307054321975
Energy: 0.7906064655795579

minimum gb energy = 0.7343092718844066 eV
minimum distance =  2.27011831595748 Angstroms
sigma value = 41


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

Energy: 1.0115890001314833
Energy: 0.9800258582608534
Energy: 0.9284978571905086
Energy: 0.9800258582621436
Energy: 1.011589000134064
Energy: 0.9800258582621436
Energy: 0.9318377022539402
Energy: 0.9746941581171027
Energy: 0.9318377022513599
Energy: 0.9746941581183929
Energy: 0.9318377022526501
Energy: 0.9746941581183929
Energy: 1.0149112318692843
Energy: 0.9591965045470521
Energy: 1.0149112318679943
Energy: 0.9591965045483424
Energy: 1.0414852379807102
Energy: 0.9591965045483424
Energy: 0.9239058265610988
Energy: 0.9442324085011643
Energy: 0.923905826557228
Energy: 0.9442324084972935
Energy: 0.923905826557228
Energy: 0.9442324084972935
Energy: 0.9986832591973466
Energy: 0.9380320235530126
Energy: 0.9986832591960563
Energy: 0.9380320235530126
Energy: 0.9986832591947661
Energy: 0.9380320235530126
Energy: 1.018812297738192
Energy: 1.0744549937596615
Energy: 1.018812297738192
Energy: 1.0744549937609518
Energy: 1.018812297738192
Energy: 1.0744549937596615
Energy: 0.9245995174760572
Energy: 0.9297126652848587
Energy: 0.9245995174760572
Energy: 0.929712665286149
Energy: 0.9245995174786379
Energy: 0.929712665286149
Energy: 1.0295830359607856
Energy: 0.9607255079553086
Energy: 1.0295830359646563
Energy: 0.960725507956599
Energy: 1.0295830359659464
Energy: 0.9607255079553086
Energy: 0.9589642911908048
Energy: 0.8600777420914467
Energy: 0.8579598360024379
Energy: 0.8600777420914467
Energy: 0.9589642911895145
Energy: 0.8600777420914467
Energy: 1.0080648260162877
Energy: 0.9827052476419555
Energy: 0.9243189175111711
Energy: 0.9827052476419555
Energy: 1.0080648260188392
Energy: 0.9827052476419555
Energy: 0.9359322936907322
Energy: 0.958764907795355
Energy: 0.9359322936920225
Energy: 0.9587649077940648
Energy: 0.9359322936920225
Energy: 0.958764907795355
Energy: 0.9104793470344997
Energy: 0.9196347748197882
Energy: 0.9104793470357899
Energy: 0.9196347748184979
Energy: 0.9104793470344997
Energy: 0.9196347748184979
Energy: 0.9495596693027759
Energy: 0.9455021997948316
Energy: 0.9495596693027759
Energy: 0.9455021997948316
Energy: 0.9495596692989049
Energy: 0.9455021997948316
Energy: 0.9980779173788283
Energy: 0.9074072108014354
Energy: 0.9980779173775381
Energy: 0.9074072108014354
Energy: 0.9980779173775381
Energy: 0.9074072108014354

minimum gb energy = 0.8579598360024379 eV
minimum distance =  2.28361857357218 Angstroms
sigma value = 11


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

Energy: 1.0910133534919249
Energy: 1.096979721630061
Energy: 1.0523686196830098
Energy: 1.0969797216294943
Energy: 1.0910133534924917
Energy: 1.096979721630061
Energy: 1.0453921842492486
Energy: 1.0440305455384236
Energy: 1.0453921842520828
Energy: 1.0440305455378571
Energy: 1.0453921842526495
Energy: 1.0440305455378571
Energy: 1.0397247276015618
Energy: 1.0256349418587702
Energy: 1.0397247275992945
Energy: 1.0256349418599038
Energy: 1.039724727600428
Energy: 1.025634941859337
Energy: 1.013316578111886
Energy: 0.9795772770073469
Energy: 1.0133165781096187
Energy: 0.9795772770062132
Energy: 1.0133165781073514
Energy: 0.9795772770067801
Energy: 1.0586455738519076
Energy: 0.9939604221580817
Energy: 1.0586455738502072
Energy: 0.9939604221535473
Energy: 1.0586455738513407
Energy: 0.9939604221535473
Energy: 1.0255227251244434
Energy: 1.0258829643400416
Energy: 1.0255927803017986
Energy: 1.0258829643406084
Energy: 1.0255227251244434
Energy: 1.0258829643406084
Energy: 1.0359749633673736
Energy: 1.0367366973111347
Energy: 1.0359902474994354
Energy: 1.0367366973111347
Energy: 1.0359749633679403
Energy: 1.036736697310568
Energy: 1.0358300713223205
Energy: 1.0338014136874665
Energy: 1.0358300713206199
Energy: 1.033801413685766
Energy: 1.0358300713206199
Energy: 1.0338014136851992
Energy: 1.0130321053258406
Energy: 1.0200225579545301
Energy: 1.013032105327541
Energy: 1.020022557953963
Energy: 1.0130321053286748
Energy: 1.0200225579533964
Energy: 1.0023990963192686
Energy: 1.0251660333037114
Energy: 1.0023990963204024
Energy: 1.0251660333014438
Energy: 1.002399096320969
Energy: 1.0251660333014438
Energy: 1.0294152837289088
Energy: 0.9947809702397992
Energy: 1.029415283728342
Energy: 0.9947809702409329
Energy: 1.0294152837277752
Energy: 0.994780970240366
Energy: 1.0038646639815816
Energy: 1.0263226634912943
Energy: 1.0038646639810147
Energy: 1.0263226634918612
Energy: 1.0038646639821485
Energy: 1.0263226634918612
Energy: 1.0127367299575076
Energy: 1.013701771246443
Energy: 1.0127367299575076
Energy: 1.0137017712430418
Energy: 1.0127367299563739
Energy: 1.0137017712436087
Energy: 1.0773485030483718
Energy: 1.0571631333920644
Energy: 1.0772512929939058
Energy: 1.0571631333858296
Energy: 1.0773485030506391
Energy: 1.0571631333858296
Energy: 0.9994980876577393
Energy: 1.0067195034687657
Energy: 1.0304221443654284
Energy: 1.0067195034704661
Energy: 1.021436833033599
Energy: 1.006719503471033
Energy: 1.039123417048653
Energy: 1.0606477104174012
Energy: 1.0391234170509198
Energy: 1.0606477104174012
Energy: 1.0391234170509198
Energy: 1.0606477104174012
Energy: 0.98473573351728
Energy: 1.0100764005487257
Energy: 0.9847357335144461
Energy: 1.010076400550993
Energy: 0.9847357335161464
Energy: 1.01007640055156
Energy: 1.035532824250801
Energy: 1.0664196921816878
Energy: 1.035532824251368
Energy: 1.0664196921822549
Energy: 1.0355328242525017
Energy: 1.0664196921828215
Energy: 0.9828091867574845
Energy: 0.9938920059761327
Energy: 0.9828091867591849
Energy: 0.9938920059755658
Energy: 0.9828091867591849
Energy: 0.9938920059755658
Energy: 1.0620109422458763
Energy: 1.021798100478001
Energy: 1.0620109422447428
Energy: 1.0217981004797014
Energy: 1.0620109422458763
Energy: 1.0217981004797014
Energy: 1.0388448561654888
Energy: 0.984273878816669
Energy: 0.9977835477796435
Energy: 0.9842738788138351
Energy: 1.0388448561666226
Energy: 0.9842738788138351
Energy: 1.093774003073275
Energy: 1.0608615591286166
Energy: 1.0556467147309683
Energy: 1.0608615591314505
Energy: 1.093774003073275
Energy: 1.0608615591320176
Energy: 1.0336944324063508
Energy: 1.0209474368794351
Energy: 1.0336944324040835
Energy: 1.0209474368783016
Energy: 1.0336944324018162
Energy: 1.0209474368788682
Energy: 1.0358361829444382
Energy: 1.0472915889901508
Energy: 1.0358361829444382
Energy: 1.0472915889861831
Energy: 1.0358361829461389
Energy: 1.0472915889861831
Energy: 0.9821346446719422
Energy: 1.005838988742691
Energy: 0.9821346446725091
Energy: 1.005838988742691
Energy: 0.9821346446713756
Energy: 1.005838988743258
Energy: 1.0311428632362472
Energy: 0.9924407459149059
Energy: 1.0311428632379476
Energy: 0.9924407459200072
Energy: 1.031142863236814
Energy: 0.9924407459194404
Energy: 1.024545943696917
Energy: 1.0423188849348337
Energy: 1.0245678458085368
Energy: 1.0423188849302991
Energy: 1.024545943697484
Energy: 1.0423188849308662
Energy: 1.039631017416286
Energy: 1.0210470042994788
Energy: 1.0396586912055796
Energy: 1.0210470043006126
Energy: 1.0396310174151522
Energy: 1.0210470043006126
Energy: 1.054767277462222
Energy: 1.0473864350162505
Energy: 1.0547672774644892
Energy: 1.0473864350162505
Energy: 1.0547672774616552
Energy: 1.0473864350162505
Energy: 0.9888805320762849
Energy: 0.9740402267389433
Energy: 0.9888805320751511
Energy: 0.9740402267383765
Energy: 0.9888805320774186
Energy: 0.9740402267383765
Energy: 1.0005220965933688
Energy: 1.0480167426561666
Energy: 1.0005220965945023
Energy: 1.0480167426561666
Energy: 1.000522096595636
Energy: 1.0480167426584337

minimum gb energy = 0.9740402267383765 eV
minimum distance =  2.23707936459762 Angstroms
sigma value = 57


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

Energy: 1.0214372225813424
Energy: 1.0504426587189113
Energy: 0.9485017381092273
Energy: 1.0504426587148767
Energy: 1.021437222576322
Energy: 1.0504426587148767
Energy: 1.0714503237619484
Energy: 1.0332213844482283
Energy: 1.0714503237619484
Energy: 1.0332213844492368
Energy: 1.0714503237629571
Energy: 1.0332213844492368
Energy: 1.0323796418683375
Energy: 1.0388853333555674
Energy: 1.0323796418663205
Energy: 1.0388853333535502
Energy: 1.032379641864303
Energy: 1.038885333354559
Energy: 0.9601107570663637
Energy: 1.1311923736380503
Energy: 0.9601107570633379
Energy: 1.1309026670852986
Energy: 0.9601107570673724
Energy: 1.1311923736451108
Energy: 1.0832293843495928
Energy: 1.0389352494462014
Energy: 1.0832293843495928
Energy: 1.0389352494472102
Energy: 1.08322938435161
Energy: 1.0389352494472102
Energy: 1.0100426314799178
Energy: 1.0331442517313498
Energy: 1.0100426314809263
Energy: 1.0331442517353844
Energy: 1.010042631481935
Energy: 1.0331442517353844
Energy: 0.9485017381082187
Energy: 1.0504426587189113
Energy: 0.9485017381082187
Energy: 1.0504426587158855
Energy: 0.9485017381072101
Energy: 1.0504426587158855
Energy: 1.071450323763943
Energy: 1.0332213844472196
Energy: 1.0714503237629571
Energy: 1.0332213844492368
Energy: 1.071450323763943
Energy: 1.0332213844492368
Energy: 1.0323796418673292
Energy: 1.0388853333575847
Energy: 1.0323796418673292
Energy: 1.038885333354559
Energy: 1.0323796418653117
Energy: 1.038885333354559
Energy: 0.9601107570683811
Energy: 1.044116090114211
Energy: 0.9601107570633379
Energy: 1.0438033796429889
Energy: 0.9601107570653551
Energy: 1.0441160901121938
Energy: 1.08322938435161
Energy: 1.0389497827899967
Energy: 1.0832293843495928
Energy: 1.0389497827899967
Energy: 1.0832293843495928
Energy: 1.0389497827899967
Energy: 1.0837642402845038
Energy: 1.0328693503532798
Energy: 1.0100426314849609
Energy: 1.0328693503522708
Energy: 1.0837642402855123
Energy: 1.0328693503522708
Energy: 1.021437222577331
Energy: 1.0504426587189113
Energy: 0.9485017381092273
Energy: 1.0504426587148767
Energy: 1.021437222576322
Energy: 1.0504426587148767
Energy: 1.071450323763943
Energy: 1.0332213844502454
Energy: 1.071450323763943
Energy: 1.0332213844502454
Energy: 1.0714503237649515
Energy: 1.0332213844502454
Energy: 1.0323796418683375
Energy: 1.0388853333565762
Energy: 1.0323796418683375
Energy: 1.0388853333555674
Energy: 1.0323796418693463
Energy: 1.0388853333555674
Energy: 0.9601107570643463
Energy: 1.09712901723521
Energy: 0.9601107570613205
Energy: 1.0971290172331927
Energy: 0.9601107570633379
Energy: 0.9846836095421617
Energy: 1.08322938435161
Energy: 1.0389352494451929
Energy: 1.0832293843506013
Energy: 1.0389352494451929
Energy: 1.0832293843506013
Energy: 1.0389352494451929

minimum gb energy = 0.9485017381072101 eV
minimum distance =  2.23345246923836 Angstroms
sigma value = 9


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

Energy: 1.0463898958951636
Energy: 1.0340398561720763
Energy: 1.0463898958951636
Energy: 1.034039856171253
Energy: 1.0463898958951636
Energy: 1.034039856171253
Energy: 1.0764621867937574
Energy: 1.0277472817318676
Energy: 1.0764621867937574
Energy: 1.0277472817318676
Energy: 1.0764621867945807
Energy: 1.0277472817326911
Energy: 1.059251850162565
Energy: 1.0361569447841714
Energy: 1.0592518501633885
Energy: 1.0361569447841714
Energy: 1.059251850164212
Energy: 1.0361569447841714
Energy: 1.0124777822211313
Energy: 1.1642077443772065
Energy: 1.0124777822211313
Energy: 1.1642077443780303
Energy: 1.0124777822203077
Energy: 1.1642077443772065
Energy: 1.0468342072488035
Energy: 1.0266436954554425
Energy: 1.0468342072488035
Energy: 1.0266436954554425
Energy: 1.0468342072488035
Energy: 1.0266436954554425
Energy: 1.0645642112450395
Energy: 1.0291658886324573
Energy: 1.064564211244216
Energy: 1.0291658886324573
Energy: 1.064564211244216
Energy: 1.029165888634928
Energy: 1.0136443151195946
Energy: 1.0828829397607271
Energy: 1.0136443151195946
Energy: 1.0828829397599038
Energy: 1.0136443151195946
Energy: 1.0828829397607271
Energy: 1.0228319242511401
Energy: 1.0655073063502187
Energy: 1.0228319242527875
Energy: 1.0655073063502187
Energy: 1.0228319242519637
Energy: 1.0655073063502187
Energy: 1.1574608716092725
Energy: 1.0271831606275816
Energy: 1.1574608716100963
Energy: 1.0271831606275816
Energy: 1.1574608716100963
Energy: 1.0271831606275816
Energy: 1.0062901591815905
Energy: 1.0635742430895387
Energy: 1.0062901591815905
Energy: 1.0635742430895387
Energy: 1.006290159180767
Energy: 1.0635742430895387
Energy: 1.0350229729337164
Energy: 1.076129685130193
Energy: 1.0350229729345402
Energy: 1.076129685130193
Energy: 1.0350229729345402
Energy: 1.076129685130193
Energy: 1.1229571833045402
Energy: 1.0267511116172883
Energy: 1.1229571833037169
Energy: 1.0267511116164645
Energy: 1.1229571833037169
Energy: 1.0267511116172883
Energy: 1.0057773737257572
Energy: 1.1356672691912104
Energy: 1.0057773737274043
Energy: 1.1356672691912104
Energy: 1.0057773737257572
Energy: 1.1356672691912104
Energy: 1.0519566120277701
Energy: 1.080799851213272
Energy: 1.0519566120285937
Energy: 1.080799851213272
Energy: 1.0519566120277701
Energy: 1.0807998512124484
Energy: 1.1226273665793969
Energy: 1.0289992134312123
Energy: 1.1226273665793969
Energy: 1.0289992134312123
Energy: 1.1226273665793969
Energy: 1.0289992134312123
Energy: 1.056425533784641
Energy: 1.0647492331238346
Energy: 1.056425533784641
Energy: 1.0647492331254815
Energy: 1.056425533784641
Energy: 1.0647492331254815
Energy: 1.0505528995352171
Energy: 1.0706791455023685
Energy: 1.0505528995352171
Energy: 1.0706791455023685
Energy: 1.0505528995360407
Energy: 1.070679145501545
Energy: 1.1822539565468309
Energy: 1.0307695159597654
Energy: 1.1822539565468309
Energy: 1.0307695159597654
Energy: 1.1822539565468309
Energy: 1.0307695159597654
Energy: 1.0209743296329672
Energy: 1.0781693606609
Energy: 1.0209743296337905
Energy: 1.0781693606609
Energy: 1.0209743296321434
Energy: 1.0781693606609
Energy: 1.0231985170635296
Energy: 1.0797165280149552
Energy: 1.0231985170618825
Energy: 1.0797165280149552
Energy: 1.0231985170618825
Energy: 1.0797165280149552
Energy: 1.1254178282987228
Energy: 1.0233802859405312
Energy: 1.125417828297899
Energy: 1.0233802859405312
Energy: 1.125417828297899
Energy: 1.0233802859405312

minimum gb energy = 1.0057773737257572 eV
minimum distance =  2.26420704512989 Angstroms
sigma value = 27


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

Energy: 1.065328971511855
Energy: 1.0588405333474802
Energy: 1.059820511441273
Energy: 1.0588405333474802
Energy: 1.0653289715076901
Energy: 1.0588405333474802
Energy: 1.0746228764226122
Energy: 1.0519828513990042
Energy: 1.0746228764233068
Energy: 1.0519828513996983
Energy: 1.0746228764260835
Energy: 1.0519828513996983
Energy: 1.0743737159855131
Energy: 0.9623907476075289
Energy: 1.0743737159834306
Energy: 0.962390747604752
Energy: 1.0743737159869018
Energy: 0.9623907476040579
Energy: 0.979209783937987
Energy: 1.0585530529921916
Energy: 0.9792097839386812
Energy: 1.0585530529887204
Energy: 0.9792097839372929
Energy: 1.0585530529894145
Energy: 0.9609003364656994
Energy: 0.9990476638625675
Energy: 0.9609003364629226
Energy: 0.9990476638632616
Energy: 0.9609003364629226
Energy: 0.9990476638639558
Energy: 1.0800428714925738
Energy: 1.0734987913578309
Energy: 1.081338009677075
Energy: 1.0734987913619962
Energy: 1.0800428715009043
Energy: 1.0734987913619962
Energy: 0.9603339968967841
Energy: 1.095555539283941
Energy: 0.96033399689609
Energy: 1.095555539283941
Energy: 0.9603339968974784
Energy: 1.0955555392832466
Energy: 1.025919858855132
Energy: 1.0614305529639125
Energy: 1.0259198588544378
Energy: 1.0614305529666892
Energy: 1.0259198588572145
Energy: 1.061430552965995
Energy: 1.103357056889405
Energy: 0.9818499441227433
Energy: 1.1038773806254747
Energy: 0.9818499441171898
Energy: 1.1033570568914879
Energy: 0.9818499441171898
Energy: 1.0722493486664073
Energy: 0.9650536311375079
Energy: 1.0722269021361275
Energy: 0.96505363113126
Energy: 1.0722493486691842
Energy: 0.96505363113126
Energy: 1.0771250339463512
Energy: 1.0404389680336876
Energy: 1.0771062638262192
Energy: 1.0404389680281343
Energy: 1.0771250339394092
Energy: 1.04043896802744
Energy: 1.0946788158856142
Energy: 0.9605855620062395
Energy: 1.0946788158890854
Energy: 0.9605855620104047
Energy: 1.0946788158897796
Energy: 0.9605855620104047
Energy: 1.0516765215513684
Energy: 1.086377363298541
Energy: 1.0516765215555337
Energy: 1.0863773632943758
Energy: 1.0516765215576163
Energy: 1.0863773632943758
Energy: 0.9792153396771549
Energy: 1.1019782473464297
Energy: 0.979215339677849
Energy: 1.1019782473443471
Energy: 0.9792153396827086
Energy: 1.1019782473443471
Energy: 1.0786100875924645
Energy: 1.0716426720004402
Energy: 1.0790833676473544
Energy: 1.0716426720004402
Energy: 1.0786100875924645
Energy: 1.0716426720004402
Energy: 1.0200875002489116
Energy: 1.001977598146444
Energy: 1.020087500250994
Energy: 1.00197759814575
Energy: 1.0200875002537708
Energy: 1.0019775981478325
Energy: 0.9612036569102181
Energy: 1.0737420525732828
Energy: 0.9612036569095239
Energy: 1.073742052576754
Energy: 0.9612036569067786
Energy: 1.0737420525774481
Energy: 1.0850869604538433
Energy: 0.9635811220733955
Energy: 1.0850869604524551
Energy: 0.963581122074784
Energy: 1.0850869604552318
Energy: 0.963581122074784
Energy: 1.0717223961084885
Energy: 0.9818193674765038
Energy: 1.018665469017306
Energy: 0.9818193674765038
Energy: 1.0717223961071003
Energy: 0.9818193674758096
Energy: 1.0653289715097725
Energy: 1.0588405333453974
Energy: 1.0598205114426615
Energy: 1.0588405333474802
Energy: 1.0653289715056073
Energy: 1.0588405333447033
Energy: 1.0746228764267776
Energy: 1.0519828514003926
Energy: 1.074622876427472
Energy: 1.0519828514003926
Energy: 1.0746228764309427
Energy: 1.0519828514003926
Energy: 1.074373715984125
Energy: 0.9623907476061404
Energy: 1.0743737159820423
Energy: 0.9623907476061404
Energy: 1.0743737159855131
Energy: 0.9623907476068346
Energy: 0.9792097839386812
Energy: 1.0585530529914973
Energy: 0.9792097839393754
Energy: 1.0585530529880263
Energy: 0.9792097839372929
Energy: 1.0585530529873322
Energy: 0.960900336464311
Energy: 0.9990476638618732
Energy: 0.9609003364636167
Energy: 0.999047663861179
Energy: 0.9609003364629226
Energy: 0.9990476638618732
Energy: 1.080042871489797
Energy: 1.073498791358525
Energy: 1.08133800967291
Energy: 1.0734987913640786
Energy: 1.080042871497433
Energy: 1.0734987913640786

minimum gb energy = 0.96033399689609 eV
minimum distance =  2.22650126193651 Angstroms
sigma value = 19


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

Energy: 0.973121944695266
Energy: 1.1318067276363846
Energy: 0.9731219446958654
Energy: 1.1318067276363846
Energy: 0.9731219446964645
Energy: 1.1318067276363846
Energy: 1.0295685170997302
Energy: 0.956772897651359
Energy: 1.0295685170985318
Energy: 0.956772897651359
Energy: 1.029568517099131
Energy: 0.956772897651359
Energy: 1.1514842486017547
Energy: 0.9235979402134717
Energy: 1.151484248602354
Energy: 0.9235979402134717
Energy: 1.1514842486017547
Energy: 0.9235979402128726
Energy: 0.9362347267554942
Energy: 1.0528658311977463
Energy: 0.9362347267560933
Energy: 1.0528658311977463
Energy: 0.9362347267554942
Energy: 1.0528658311977463
Energy: 0.9951466880774021
Energy: 1.028792697271283
Energy: 0.9951466880780014
Energy: 1.0287926972724815
Energy: 0.9951466880780014
Energy: 1.0287926972724815
Energy: 1.031112843308
Energy: 0.9456582062669862
Energy: 1.0311128433085994
Energy: 0.945658206266387
Energy: 1.0311128433097705
Energy: 0.945658206266387
Energy: 0.9190371778350809
Energy: 1.1111166017311829
Energy: 0.9190371778350809
Energy: 1.1111166017317822
Energy: 0.9190371778350809
Energy: 1.1111166017305836
Energy: 0.9654114022848886
Energy: 1.0237230339485373
Energy: 0.9654114022848886
Energy: 1.0237230339485373
Energy: 0.9654114022842893
Energy: 1.0237230339491366
Energy: 1.1077762689459671
Energy: 0.9237037405051373
Energy: 1.1077762689459671
Energy: 0.9237037405051373
Energy: 1.1077762689459671
Energy: 0.9237037405051373
Energy: 0.9490470042183684
Energy: 1.0102660765760116
Energy: 0.9490470042177692
Energy: 1.0102660765760116
Energy: 0.9490470042183684
Energy: 1.0102660765760116
Energy: 0.9277220887744843
Energy: 1.1572835539117443
Energy: 0.9277220887750836
Energy: 1.1572835539117443
Energy: 0.9277220887738851
Energy: 1.1572835539117443
Energy: 1.066052886526165
Energy: 0.9359614374958296
Energy: 1.0660528865255658
Energy: 0.9359614374952303
Energy: 1.066052886526165
Energy: 0.9359614374958296
Energy: 0.9673170726755825
Energy: 0.9639520218378627
Energy: 0.9673170726755825
Energy: 0.9639520218372634
Energy: 0.9673170726755825
Energy: 0.9639520218372634
Energy: 0.9405394096637996
Energy: 1.0310634817423563
Energy: 0.9405394096637996
Energy: 1.0310634817423563
Energy: 0.9405394096637996
Energy: 1.0310634817429554
Energy: 1.0305416744194167
Energy: 0.9186189732762456
Energy: 1.030541674418218
Energy: 0.9186189732750472
Energy: 1.030541674418218
Energy: 0.9186189732768448
Energy: 1.0999745441438535
Energy: 0.9256598421133255
Energy: 1.0999745441438535
Energy: 0.9256598421139249
Energy: 1.0999745441444528
Energy: 0.9256598421139249
Energy: 0.9458971284864883
Energy: 1.050456469725749
Energy: 0.9458971284858891
Energy: 1.050456469725749
Energy: 0.9458971284864883
Energy: 1.0504564697245509
Energy: 1.0217008763146898
Energy: 0.988656557404445
Energy: 1.0217008763140905
Energy: 0.988656557404445
Energy: 1.0217008763158881
Energy: 0.988656557404445
Energy: 1.049755224313261
Energy: 0.9440210206120666
Energy: 1.0497552243150587
Energy: 0.9440210206120666
Energy: 1.049755224313261
Energy: 0.9440210206120666
Energy: 0.937261019314734
Energy: 1.0415220825200788
Energy: 0.937261019314734
Energy: 1.0415220825206781
Energy: 0.937261019314734
Energy: 1.0415220825200788
Energy: 0.9140435329839108
Energy: 1.0288745556486587
Energy: 0.9140435329839108
Energy: 1.0288745556486587
Energy: 0.9140435329833116
Energy: 1.0288745556486587
Energy: 1.1062217274355937
Energy: 0.9355640755444133
Energy: 1.1062217274355937
Energy: 0.9355640755450125
Energy: 1.106221727436193
Energy: 0.9355640755444133
Energy: 0.973462673015387
Energy: 0.9963577760566307
Energy: 0.9734626730147878
Energy: 0.9963577760572297
Energy: 0.9734626730147878
Energy: 0.9963577760572297
Energy: 0.9735111883472416
Energy: 1.069090379629198
Energy: 0.9735111883466425
Energy: 1.0690903796285989
Energy: 0.9735111883466425
Energy: 1.0690903796285989
Energy: 1.0246887178972335
Energy: 0.9369973818341306
Energy: 1.0246887178978328
Energy: 0.9369973818341306
Energy: 1.0246887178984319
Energy: 0.9369973818341306
Energy: 0.9741296436942829
Energy: 0.9555816172746057
Energy: 0.9741296436942829
Energy: 0.9555816172746057
Energy: 0.9741296436936838
Energy: 0.9555816172746057
Energy: 0.9209734561496812
Energy: 1.0221738979080712
Energy: 0.9209734561496812
Energy: 1.0221738979056743
Energy: 0.9209734561496812
Energy: 1.0221738979056743
Energy: 1.0114986527669525
Energy: 0.943288612674692
Energy: 1.0114986527681509
Energy: 0.943288612674692
Energy: 1.0114986527675516
Energy: 0.9432886126740928
Energy: 1.0434747243283948
Energy: 0.9438360628639375
Energy: 1.0434747243289944
Energy: 0.9438360628639375
Energy: 1.0434747243289944
Energy: 0.9438360628633383

minimum gb energy = 0.9140435329833116 eV
minimum distance =  2.3108415902532 Angstroms
sigma value = 101


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

Energy: 0.9127731822889767
Energy: 1.0177728582949328
Energy: 0.91277318228845
Energy: 1.0177728582949328
Energy: 0.91277318228845
Energy: 1.0177728582949328
Energy: 0.9484426043739329
Energy: 0.925041761794026
Energy: 0.9484426043739329
Energy: 0.929109892438004
Energy: 0.9484426043734062
Energy: 0.9188556894454676
Energy: 1.0169772241815584
Energy: 0.8916388346622608
Energy: 1.0169772241826118
Energy: 0.8916388346638411
Energy: 1.0169772241815584
Energy: 0.8916388346643678
Energy: 0.8706690598759118
Energy: 0.9549240431746995
Energy: 0.8706690598759118
Energy: 1.1447510080155572
Energy: 0.8706690598748583
Energy: 1.1447510080134502
Energy: 0.9026205907374897
Energy: 0.9568263783484764
Energy: 0.9026205907364362
Energy: 0.9568263783489793
Energy: 0.9026205907374897
Energy: 0.9568263783484764
Energy: 1.0044526971797398
Energy: 0.8808578955828651
Energy: 1.0044526971797398
Energy: 0.8808578955828651
Energy: 1.004452697179213
Energy: 0.8808578955828651
Energy: 0.9043378384342868
Energy: 0.9039089209494405
Energy: 0.9043378384353403
Energy: 0.9039089209494405
Energy: 0.9043378384348136
Energy: 0.9039089209499673
Energy: 0.869819262365591
Energy: 1.1086020700546007
Energy: 0.8698192623661177
Energy: 1.1086020700546007
Energy: 0.8698192623650642
Energy: 1.1086020700546007
Energy: 1.0144889988117118
Energy: 0.8815841445448838
Energy: 1.0144889988122385
Energy: 0.8815841445448838
Energy: 1.0144889988117118
Energy: 0.8815841445448838
Energy: 0.959548965003666
Energy: 0.9051031853981198
Energy: 0.9595489650041927
Energy: 0.9051031853975932
Energy: 0.9595489650041927
Energy: 0.9051031853981198
Energy: 0.8689557732431277
Energy: 1.1250314503397512
Energy: 0.8689557732431277
Energy: 1.125031450340278
Energy: 0.8689557732441812
Energy: 1.1250314503408048
Energy: 0.983375381383265
Energy: 0.9257265676356033
Energy: 0.9833753813843185
Energy: 0.9257265676356033
Energy: 0.9833753813848451
Energy: 0.9257265676356033
Energy: 0.9932660440159606
Energy: 0.891665101148619
Energy: 0.9932660440149071
Energy: 0.891665101148619
Energy: 0.9932660440159606
Energy: 0.891665101148619
Energy: 0.9129643111250331
Energy: 1.039186182945858
Energy: 0.9129643111250331
Energy: 1.039186182945858
Energy: 0.9129643111245063
Energy: 1.036661479552789
Energy: 0.9326150645635252
Energy: 0.9453673013113024
Energy: 0.9326150645635252
Energy: 0.9453673013107757
Energy: 0.9326150645640519
Energy: 0.9453673013113024
Energy: 1.015499762600492
Energy: 0.8931915785307376
Energy: 1.015499762600492
Energy: 0.8931915785302108
Energy: 1.015499762600492
Energy: 0.8931915785302108
Energy: 0.866598445437268
Energy: 0.9705395910525781
Energy: 0.8665984454377949
Energy: 0.9705395910515247
Energy: 0.8665984454377949
Energy: 0.9705395910520515
Energy: 0.8659732343536843
Energy: 0.9570673026238642
Energy: 0.8659732343552645
Energy: 0.9570673026238642
Energy: 0.8659732343552645
Energy: 0.9570673026238642
Energy: 1.0058044172928813
Energy: 0.8815848873414589
Energy: 1.0058044172939347
Energy: 0.8815848873419856
Energy: 1.0058044172939347
Energy: 0.8815848873419856
Energy: 0.903641071359243
Energy: 0.9032924512333993
Energy: 0.9036410713587162
Energy: 0.9032924512333993
Energy: 0.9036410713587162
Energy: 0.9032924512333993
Energy: 0.8702598101673112
Energy: 1.123493415745224
Energy: 0.8702598101683647
Energy: 1.123493415745224
Energy: 0.870259810167838
Energy: 1.1234934157499648
Energy: 1.0202169197788247
Energy: 0.8802803371941981
Energy: 1.0202169197740838
Energy: 0.8802803371947248
Energy: 1.0202169197798783
Energy: 0.8802803371941981
Energy: 1.0193645363804158
Energy: 0.8802855397271668
Energy: 1.0193645363798887
Energy: 0.8802855397276936
Energy: 1.0193645363798887
Energy: 0.8802855397271668
Energy: 0.8707498706317467
Energy: 1.0250264096343444
Energy: 0.8707498706301665
Energy: 1.070845365940946
Energy: 0.87074987063122
Energy: 1.0451544951210383
Energy: 0.9824635035608293
Energy: 0.9233528248643944
Energy: 0.9824635035608293
Energy: 0.9233528248643944
Energy: 0.9824635035597759
Energy: 0.9233528248643944
Energy: 0.9924051520910633
Energy: 0.8931483280374866
Energy: 0.992405152089507
Energy: 0.8931483280380133
Energy: 0.9924051520931703
Energy: 0.8931483280374866
Energy: 0.9124819096172986
Energy: 1.0017531709618985
Energy: 0.9124819096172986
Energy: 1.0017531709624254
Energy: 0.9124819096167718
Energy: 1.0017531709618985
Energy: 0.9126076722589285
Energy: 0.9443135170660909
Energy: 0.9126076722589285
Energy: 0.9443135170660909
Energy: 0.9126076722573483
Energy: 0.9443135170655642
Energy: 1.0451884534032654
Energy: 0.8914690505033565
Energy: 1.0451884534032654
Energy: 0.8914690505033565
Energy: 1.0451884534032654
Energy: 0.8914690505033565
Energy: 0.8660633888777921
Energy: 0.9547854321851914
Energy: 0.8660633888783188
Energy: 0.9547854321841379
Energy: 0.8660633888767386
Energy: 0.9547854321857182
Energy: 0.866069774172928
Energy: 1.017243668362697
Energy: 0.8660697741734548
Energy: 1.017243668362697
Energy: 0.8660697741734548
Energy: 1.017243668362697
Energy: 1.0191746649650635
Energy: 0.8801474072345445
Energy: 1.0191746649655904
Energy: 0.8801474072345445
Energy: 1.0191746649650635
Energy: 0.8801474072345445
Energy: 1.0191714113059125
Energy: 0.8801761473068488
Energy: 1.0191714113064394
Energy: 0.8801761473073755
Energy: 1.0191714113054098
Energy: 0.8801761473073755

minimum gb energy = 0.8659732343536843 eV
minimum distance =  2.34445544197236 Angstroms
sigma value = 33


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

Energy: 0.014174671946545552
Energy: 0.7230834246054655
Energy: 0.014174671946545552
Energy: 0.723083424606754
Energy: 0.014174671946545552
Energy: 0.7230834246058788
Energy: 0.014970391196052276
Energy: 0.2773423633771965
Energy: 0.014970391195638932
Energy: 0.2773423633771965
Energy: 0.014970391196052276
Energy: 0.2773423633771965
Energy: 0.7813092077179079
Energy: 0.2771300713770156
Energy: 0.7813092077191967
Energy: 0.27713006114585564
Energy: 0.7813092077166193
Energy: 0.2771300641246475
Energy: 0.014970391196489933
Energy: 0.2773423633784851
Energy: 0.014970391196052276
Energy: 0.2773423633784851
Energy: 0.014970391196052276
Energy: 0.27734236337889845

minimum gb energy = 0.014174671946545552 eV
minimum distance =  2.56596162646511 Angstroms
sigma value = 1