Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Cu__MO_127245782811_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614959037303926
cohesive_energy=3.5402730691080047
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.013736077135748771
Energy: 0.014455672863653402
Energy: 0.33485488584097056
Energy: 0.014455672863653402
Energy: 0.014455672863653402
Energy: 0.5725251852912275
Energy: 0.014455672863653402
Energy: 0.5725251852912275
Energy: 0.33485488584097056
Energy: 0.014455672863653402
Energy: 0.013736077135748771
Energy: 0.014455672864245784
Energy: 0.014455672864245784
Energy: 0.5725251852912275
Energy: 0.014455672863653402
Energy: 0.5725251852912275

minimum gb energy = 0.013736077135748771 eV
minimum distance =  2.48315125565588 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.815552192841998
Energy: 0.7930658822792067
Energy: 0.8437687605217746
Energy: 0.7930658822784461
Energy: 0.7706401686739418
Energy: 0.801644748214202
Energy: 0.7709462921363799
Energy: 0.8016447482134414
Energy: 0.7399317584351007
Energy: 0.7857802871815995
Energy: 0.7699116163161519
Energy: 0.7857802871823601
Energy: 0.7690868694821551
Energy: 0.8028982474374949
Energy: 0.7547942601601445
Energy: 0.8028982474382556
Energy: 0.7714062122035987
Energy: 0.7938791277045598
Energy: 0.7707013667651846
Energy: 0.7938791277060813
Energy: 0.7390898156200862
Energy: 0.7919520672906218
Energy: 0.7368396600584373
Energy: 0.7919520672906218
Energy: 0.7719274250397873
Energy: 0.7868767990100349
Energy: 0.7398442414205195
Energy: 0.7868767990107958
Energy: 0.7041951299665264
Energy: 0.7933535064656321
Energy: 0.7403701004410402
Energy: 0.7933535064656321
Energy: 0.7558676122803432
Energy: 0.8027922043381662
Energy: 0.7684115875427043
Energy: 0.8027922043374056
Energy: 0.7332247113235181
Energy: 0.7853670404128404
Energy: 0.7055506497291804
Energy: 0.7853670404113189
Energy: 0.768581708460835
Energy: 0.8054553401699389
Energy: 0.7560754988881916
Energy: 0.8054553401706996
Energy: 0.7859116296762086
Energy: 0.7932285993858581
Energy: 0.7352344621094474
Energy: 0.793228599383576
Energy: 0.7698324649169902
Energy: 0.7858067442899059
Energy: 0.7721704893713621
Energy: 0.7858067442906665
Energy: 0.7742514507973773
Energy: 0.7927079979002847
Energy: 0.7519447261744557
Energy: 0.7927079979010453
Energy: 0.7790646394733315
Energy: 0.7939981293973609
Energy: 0.7691004091394706
Energy: 0.7939981293981216
Energy: 0.7687045168997151
Energy: 0.7943497379024869
Energy: 0.7694191530738259
Energy: 0.7943497379024869
Energy: 0.7699935204796469
Energy: 0.7858574636341088
Energy: 0.7240930387579758
Energy: 0.7858574636356302
Energy: 0.7710554343288769
Energy: 0.7859517409495009
Energy: 0.7699129537014644
Energy: 0.785951740946458
Energy: 0.7730926290571436
Energy: 0.7929705069139533
Energy: 0.7348151903905679
Energy: 0.7929705069139533
Energy: 0.771304251822338
Energy: 0.7739055348019311
Energy: 0.7586581788691011
Energy: 0.7739055348026916
Energy: 0.7342585379459801
Energy: 0.7853171523341185
Energy: 0.7131539620050276
Energy: 0.7853171523348792
Energy: 0.7549946750725494
Energy: 0.8137033920988778
Energy: 0.7690431546659001
Energy: 0.8137033920996385
Energy: 0.7709053647188806
Energy: 0.7938437076502826
Energy: 0.7376350906763552
Energy: 0.7938437076502826
Energy: 0.7371679268971847
Energy: 0.7865549533932082
Energy: 0.7387426871652727
Energy: 0.7865549533932082
Energy: 0.7399148470203383
Energy: 0.7919968163003791
Energy: 0.771733580669087
Energy: 0.7919968162988577
Energy: 0.7734981037049865
Energy: 0.793603753267828
Energy: 0.7362079959037158
Energy: 0.7936037532685887
Energy: 0.7718673259569163
Energy: 0.7916999570816602
Energy: 0.7558289718806609
Energy: 0.7916999570816602
Energy: 0.7426171010618655
Energy: 0.7851472491519802
Energy: 0.8071360958242991
Energy: 0.7851472491519802
Energy: 0.7693789577717803
Energy: 0.7980864667212929
Energy: 0.7684909836561244
Energy: 0.7980864667212929
Energy: 0.8128223517699306
Energy: 0.7930022562516204
Energy: 0.7865599708415868
Energy: 0.7930022562531418
Energy: 0.7742746451736798
Energy: 0.7913784603153386
Energy: 0.7696224793352364
Energy: 0.7913784603153386
Energy: 0.7555061415644178
Energy: 0.7859459024405416
Energy: 0.7743091398641571
Energy: 0.7859459024413022
Energy: 0.7713415817337871
Energy: 0.8035397549994926
Energy: 0.7555416014643295
Energy: 0.8035397549972105

minimum gb energy = 0.7041951299665264 eV
minimum distance =  2.31672081300403 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 0.8737754397527596
Energy: 0.8494534569826648
Energy: 0.9002939317108948
Energy: 0.8494534569817974
Energy: 0.8065089050041714
Energy: 0.842221245692895
Energy: 0.8063241522770938
Energy: 0.8422212456954971
Energy: 0.7759516504258614
Energy: 0.8498400405054409
Energy: 0.8064360568804761
Energy: 0.8498400404985023
Energy: 0.7796765707659682
Energy: 0.8182125457058339
Energy: 0.7723111756951079
Energy: 0.8182125457075686
Energy: 0.7802816031619456
Energy: 0.8391588936615665
Energy: 0.7796849642887257
Energy: 0.8391588936537605
Energy: 0.8355467470659603
Energy: 0.8389304243677123
Energy: 0.7785393317151763
Energy: 0.8389304243668448
Energy: 0.7790234551158616
Energy: 0.8194360632792076
Energy: 0.7834394759637826
Energy: 0.8194360632826768
Energy: 0.7351446780147519
Energy: 0.8496713800778286
Energy: 0.778541025430966
Energy: 0.8496713800743593
Energy: 0.7798763429157081
Energy: 0.8144339800930634
Energy: 0.8062469833272135
Energy: 0.8144339800878597
Energy: 0.7727608122102951
Energy: 0.8496554849701516
Energy: 0.7831666100455452
Energy: 0.8496554849701516
Energy: 0.7793893056975335
Energy: 0.8525116893976425
Energy: 0.80614689075868
Energy: 0.8525116893967752
Energy: 0.7575356712082617
Energy: 0.8436145834363871
Energy: 0.8064980973742403
Energy: 0.8436145834372545
Energy: 0.8128640238785806
Energy: 0.8387956354649583
Energy: 0.7797870800886381
Energy: 0.8387956354727643
Energy: 0.8139335534972146
Energy: 0.8387831629198643
Energy: 0.7938413728519477
Energy: 0.8387831629250683
Energy: 0.7574501266441728
Energy: 0.8435774023694583
Energy: 0.8065233824456862
Energy: 0.8435774023720602
Energy: 0.7762797021764861
Energy: 0.8522546042580111
Energy: 0.7923235425944535
Energy: 0.8522546042640824
Energy: 0.7727491236495246
Energy: 0.849523938054859
Energy: 0.7498896628748373
Energy: 0.8495239380635324
Energy: 0.7795758392722945
Energy: 0.8144708105291922
Energy: 0.8060980460962915
Energy: 0.8144708105300597
Energy: 0.7351384860316199
Energy: 0.8496762533144813
Energy: 0.7785029733960936
Energy: 0.8496762533205526
Energy: 0.7796043279959409
Energy: 0.8194983678683622
Energy: 0.7720442764485566
Energy: 0.8194983678666274
Energy: 0.8354661975974835
Energy: 0.8389383025961967
Energy: 0.7944625580841488
Energy: 0.8389383025987988
Energy: 0.7799998736973932
Energy: 0.83907714878373
Energy: 0.7798844709655642
Energy: 0.839077148781128
Energy: 0.7799555212129295
Energy: 0.8182225868221092
Energy: 0.7922059733170436
Energy: 0.8182225868203745
Energy: 0.7760222423346806
Energy: 0.8497355631651357
Energy: 0.8065490631925124
Energy: 0.8497355631616664
Energy: 0.8063876090403884
Energy: 0.8424223364590548
Energy: 0.8060646135357677
Energy: 0.8424223364599221
Energy: 0.8737754397536269
Energy: 0.8494534569826648
Energy: 0.8563719248931652
Energy: 0.8494534569817974
Energy: 0.806508905005906
Energy: 0.8422212456920278
Energy: 0.8063241522770938
Energy: 0.8422212456954971
Energy: 0.7759516504284635
Energy: 0.8498400405054409
Energy: 0.8064360568796088
Energy: 0.8498400404985023
Energy: 0.7796765707633662
Energy: 0.8182125457058339
Energy: 0.7723111756951079
Energy: 0.8182125457067013

minimum gb energy = 0.7351384860316199 eV
minimum distance =  2.28385749988585 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.8315706434941853
Energy: 0.8940760756026024
Energy: 0.9668875730818708
Energy: 0.8940760756036106
Energy: 0.8219176016811527
Energy: 0.9072089439853094
Energy: 0.8199609267763888
Energy: 0.9072089439853094
Energy: 0.8027307002657551
Energy: 0.9148545754607108
Energy: 0.819731171871158
Energy: 0.9148545754607108
Energy: 0.8279007119811495
Energy: 0.8786096757997224
Energy: 0.798344646456418
Energy: 0.8786096757987142
Energy: 0.8003463416227932
Energy: 0.8947204599130189
Energy: 0.8266700522925475
Energy: 0.8947204599140272
Energy: 0.8869603709332929
Energy: 0.9149709491881941
Energy: 0.8207643436549891
Energy: 0.9149709491881941
Energy: 0.8202780679792759
Energy: 0.824157152604128
Energy: 0.8073871938174125
Energy: 0.824157152604128
Energy: 0.9449813024466818
Energy: 0.8945802927665093
Energy: 0.7672145727183018
Energy: 0.8945802927665093
Energy: 0.807420762855254
Energy: 0.8757091129452472
Energy: 0.822189286462366
Energy: 0.8757091129452472
Energy: 0.8205045158251897
Energy: 0.9148788369507428
Energy: 0.7938713861364755
Energy: 0.9148788369497346
Energy: 0.826764021160818
Energy: 0.894715833926617
Energy: 0.819724089024325
Energy: 0.894715833926617
Energy: 0.7990967836179841
Energy: 0.8942306740601689
Energy: 0.8198168332743294
Energy: 0.8942306740601689
Energy: 0.8196056447648272
Energy: 0.8775485967615297
Energy: 0.7952762524366367
Energy: 0.8775485967615297
Energy: 0.8108324917489452
Energy: 0.8203265633809682
Energy: 0.8217873612113392
Energy: 0.8203265633809682
Energy: 0.8598354957640801
Energy: 0.8944368911251162
Energy: 0.766090286604874
Energy: 0.8944368911251162
Energy: 0.8200681731453812
Energy: 0.8248616161703111
Energy: 0.798000680050201
Energy: 0.8248616161693028
Energy: 0.7661246670224999
Energy: 0.914745479555812
Energy: 0.765935556424264
Energy: 0.914745479555812
Energy: 0.7980954686607178
Energy: 0.8948964108009905
Energy: 0.8281840740222338
Energy: 0.8948964108009905
Energy: 0.8260976165186946
Energy: 0.878680431683408
Energy: 0.8001824776819255
Energy: 0.8786804316823997
Energy: 0.8213941232414751
Energy: 0.9145753903955253
Energy: 0.8213255007612804
Energy: 0.9145753903965335
Energy: 0.8242077922818245
Energy: 0.8713850555742731
Energy: 0.8254815865188181
Energy: 0.8713850555742731
Energy: 0.8296431975835533
Energy: 0.8945439487948953
Energy: 0.8869323082282369
Energy: 0.8945439487948953
Energy: 0.8204243306516689
Energy: 0.8747451689831675
Energy: 0.8201617418592024
Energy: 0.8747451689841758
Energy: 0.8013704878410712
Energy: 0.9148383662289173
Energy: 0.82051586272773
Energy: 0.9148383662289173
Energy: 0.820055496880088
Energy: 0.8805115424533162
Energy: 0.7973399334083201
Energy: 0.8805115424533162

minimum gb energy = 0.765935556424264 eV
minimum distance =  2.29262746963425 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 0.8850485236763638
Energy: 0.8856076126261917
Energy: 1.0514906394316275
Energy: 0.8856076126285971
Energy: 0.8393117931651571
Energy: 0.9357865459180664
Energy: 0.8747347143616834
Energy: 0.9357865459180664
Energy: 0.7915652379967419
Energy: 0.8676507099219457
Energy: 0.8806150077726147
Energy: 0.8676507099195401
Energy: 0.8693412796051174
Energy: 0.9422848776519969
Energy: 0.8010233830444676
Energy: 0.9422848776519969
Energy: 0.9509270410451585
Energy: 0.9354289736251942
Energy: 0.8795425147866823
Energy: 0.9354289736275997
Energy: 0.7917718255036292
Energy: 0.8712098028850389
Energy: 0.7955745638551007
Energy: 0.8712098028862416
Energy: 0.8681231671948434
Energy: 0.8009857398794683
Energy: 0.8009682094478193
Energy: 0.8009857398794683
Energy: 0.9102847990120743
Energy: 0.8718890222984645
Energy: 0.7953381260761698
Energy: 0.8718890222972618
Energy: 0.867977510926916
Energy: 0.9355574605767809
Energy: 0.8781432393606468
Energy: 0.9355574605767809
Energy: 0.8713566831682565
Energy: 0.8683552006634938
Energy: 0.8010324877275959
Energy: 0.8683552006598856
Energy: 0.8287462610524894
Energy: 0.9409078078968275
Energy: 0.8802567468887914
Energy: 0.9409078078992331
Energy: 0.8695976431645207
Energy: 0.9053899428294125
Energy: 0.8021517981816502
Energy: 0.9053899428270069
Energy: 0.7916462943136021
Energy: 0.8860848336691816
Energy: 0.8122521256494
Energy: 0.8860848336691816
Energy: 0.8255225139156795
Energy: 0.8713427244863764
Energy: 0.8749518762548941
Energy: 0.8713427244887819
Energy: 0.7916573410335893
Energy: 0.8860144895804467
Energy: 0.9102173349370912
Energy: 0.8860144895816494
Energy: 0.8695201990765358
Energy: 0.9054183609775833
Energy: 0.8022204397119115
Energy: 0.9054183609751777
Energy: 0.8286379631386676
Energy: 0.9408764034901191
Energy: 0.8802374621558609
Energy: 0.9408764034901191
Energy: 0.871495193190734
Energy: 0.8682638571840869
Energy: 0.8010387724038959
Energy: 0.8682638571840869
Energy: 0.8679052549941374
Energy: 0.935585526331848
Energy: 0.8781757762279652
Energy: 0.9355855263294426
Energy: 0.9104126639209796
Energy: 0.8718624986737854
Energy: 0.7953260785554636
Energy: 0.8718624986725825
Energy: 0.8680138928038711
Energy: 0.8009912676792907
Energy: 0.8009651228691516
Energy: 0.8009912676816963

minimum gb energy = 0.7915652379967419 eV
minimum distance =  2.38405620147355 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.8222813789554331
Energy: 1.0137675375979427
Energy: 1.1467507040813691
Energy: 1.013767537596455
Energy: 0.8149171637118038
Energy: 0.8164889425450895
Energy: 0.8127080701001382
Energy: 0.8164889425450895
Energy: 0.8127889910252515
Energy: 0.9441487561050673
Energy: 0.8125221019984658
Energy: 0.9441487561050673
Energy: 0.824488879937684
Energy: 0.8559072715903556
Energy: 0.964032540458845
Energy: 0.8559072715858933
Energy: 0.9608959404831806
Energy: 0.81718750672434
Energy: 0.812803454120276
Energy: 0.8171875067258274
Energy: 0.816186744864498
Energy: 0.9639182328155518
Energy: 0.8151268002084139
Energy: 0.9639182328140643
Energy: 0.8137364039395225
Energy: 0.9408284295685411
Energy: 0.812567244927431
Energy: 0.9408284295685411
Energy: 0.9618502265880723
Energy: 1.0151417823296645
Energy: 0.824497954016918
Energy: 1.0151417823296645
Energy: 0.8124865399602953
Energy: 0.834431009726166
Energy: 0.8167760763934007
Energy: 0.8344310097276535
Energy: 0.9774833886537373
Energy: 0.9445584555296439
Energy: 0.815836630055624
Energy: 0.9445584555296439
Energy: 0.960249750272815
Energy: 1.0116668210041593
Energy: 1.097593456438917
Energy: 1.0116668210026716
Energy: 0.8133785616563767
Energy: 0.8293091185612675
Energy: 0.9765119431022966
Energy: 0.8293091185627549
Energy: 0.9623661160377276
Energy: 0.8572557068214857
Energy: 0.812450729828627
Energy: 0.8572557068214857
Energy: 0.8126816409497446
Energy: 0.8554954656854372
Energy: 0.8226518003664735
Energy: 0.8554954656839497
Energy: 0.8124866081965791
Energy: 1.012231329551107
Energy: 0.9603159845435734
Energy: 1.0122313295525944
Energy: 0.8166412018258976
Energy: 0.856223553842781
Energy: 0.8161470565991364
Energy: 0.856223553842781
Energy: 0.8126323778760496
Energy: 0.8845394425796765
Energy: 0.9757405962281412
Energy: 0.8845394425796765

minimum gb energy = 0.812450729828627 eV
minimum distance =  2.36480896405041 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 0.9335915079346957
Energy: 0.9045308135699954
Energy: 1.1734301653479553
Energy: 0.9045308135683107
Energy: 0.9685756655170343
Energy: 0.8974322733526983
Energy: 0.8378216444015425
Energy: 0.8974322733526983
Energy: 0.9629923840274053
Energy: 0.8398067062596158
Energy: 0.8377426476891202
Energy: 0.8398067062596158
Energy: 0.8390272190861761
Energy: 0.8416060797428693
Energy: 0.9142336700339708
Energy: 0.8416060797428693
Energy: 0.9745192000066693
Energy: 0.9010031525845468
Energy: 0.83869286982168
Energy: 0.9010031525845468
Energy: 0.8406456947161381
Energy: 0.8617984593803992
Energy: 0.9711431856238797
Energy: 0.8617984593795569
Energy: 0.8417708822852344
Energy: 0.8944885413432281
Energy: 0.8378824972427246
Energy: 0.8944885413440705
Energy: 0.9663496533263516
Energy: 0.8415601301732393
Energy: 0.8466909142790672
Energy: 0.8415601301732393
Energy: 0.8432307716138929
Energy: 0.9300146732727052
Energy: 1.003210617324231
Energy: 0.9300146732743901
Energy: 1.0672622517291348
Energy: 0.8684773914432344
Energy: 0.8437680629227293
Energy: 0.8684773914432344
Energy: 0.8411337927383521
Energy: 0.8417194056938542
Energy: 0.9638088687937705
Energy: 0.8417194056921694
Energy: 0.8456641857306657
Energy: 0.8954031562397976
Energy: 0.844960828315896
Energy: 0.8954031562389552
Energy: 0.9687532607264429
Energy: 0.841613902407522
Energy: 0.840044493989286
Energy: 0.8416139024066794
Energy: 0.843559717192516
Energy: 0.932417181715759
Energy: 0.9660914256612516
Energy: 0.932417181715759
Energy: 0.9162265656437305
Energy: 0.8937980537241735
Energy: 0.8434983941139165
Energy: 0.8937980537250159
Energy: 0.9659189111184824
Energy: 0.8413167515937581
Energy: 0.966276323874286
Energy: 0.841316751595443
Energy: 0.8380473835332805
Energy: 0.9240923100337317
Energy: 0.9719296219737042
Energy: 0.9240923100354166
Energy: 0.9541292579657781
Energy: 0.8417666023343912
Energy: 0.8405945322305588
Energy: 0.8417666023343912
Energy: 0.8636184126089729
Energy: 0.9425078798853849
Energy: 0.8965382384172622
Energy: 0.9425078798862272
Energy: 0.8379936037921412
Energy: 0.8409143176983308
Energy: 0.8391870517188937
Energy: 0.8409143176983308
Energy: 0.9041374092652176
Energy: 0.841991697090066
Energy: 0.9619867041920974
Energy: 0.8419916970883814
Energy: 0.838016383045934
Energy: 0.9888535188794125
Energy: 1.0618573407328844
Energy: 0.9888535188777277
Energy: 1.0063176142615833
Energy: 0.9041142586568374
Energy: 0.8377679730058482
Energy: 0.9041142586585222
Energy: 0.8396524185038885
Energy: 0.8939658989235049
Energy: 0.9673460943084401
Energy: 0.8939658989235049
Energy: 0.8400463944080839
Energy: 0.8424919726832683
Energy: 0.9663746303948137
Energy: 0.8424919726857955
Energy: 1.0046312978577994
Energy: 0.8413301556206786
Energy: 0.8388121532430753
Energy: 0.8413301556206786
Energy: 0.8383292582159952
Energy: 0.9729182025313933
Energy: 1.07868849964807
Energy: 0.9729182025322358
Energy: 0.9711866975163792
Energy: 0.8612112239700238
Energy: 0.9622448115514721
Energy: 0.8612112239691815
Energy: 1.0070722703215336
Energy: 0.916699829694747
Energy: 0.8415456912506927
Energy: 0.9166998296896924
Energy: 0.8466101528538809
Energy: 0.9315899006790408
Energy: 0.9545052024018934
Energy: 0.9315899006807256

minimum gb energy = 0.8377426476891202 eV
minimum distance =  2.33860184671282 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.7937068718758545
Energy: 0.7933740960450617
Energy: 1.218189471019455
Energy: 0.7933740960470012
Energy: 0.9676288100770597
Energy: 0.8698683977118138
Energy: 0.8384388637375464
Energy: 0.8698683977118138
Energy: 0.7948203656941593
Energy: 0.794284924424204
Energy: 0.8989878302962255
Energy: 0.794284924424204
Energy: 0.795131710002778
Energy: 0.7940170125513981
Energy: 0.8379307429146222
Energy: 0.7940170125533376
Energy: 0.9675296273271237
Energy: 0.8698320126330408
Energy: 0.8384416493599794
Energy: 0.8698320126311013
Energy: 0.7937068718758545
Energy: 0.7933740960450617
Energy: 1.1400249455094866
Energy: 0.7933740960470012
Energy: 0.9676288100770597
Energy: 0.8698683977118138
Energy: 0.8384388637394858
Energy: 0.8698683977098745
Energy: 0.7948203656941593
Energy: 0.794284924424204
Energy: 0.9849631787632963
Energy: 0.794284924424204
Energy: 0.795131710002778
Energy: 0.7940170125513981
Energy: 0.8379307429146222
Energy: 0.7940170125533376
Energy: 0.9675296273271237
Energy: 0.8698320126330408
Energy: 0.8384416493599794
Energy: 0.8698320126330408
Energy: 0.7937068718758545
Energy: 0.7933740960450617
Energy: 1.0335395456820033
Energy: 0.7933740960470012
Energy: 0.9676288100770597
Energy: 0.8698683977118138
Energy: 0.8384388637375464
Energy: 0.8698683977118138
Energy: 0.7948203656960985
Energy: 0.794284924424204
Energy: 0.9849631787632963
Energy: 0.794284924424204

minimum gb energy = 0.7933740960450617 eV
minimum distance =  2.33491323338585 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 0.8854846443559745
Energy: 1.0659797688804695
Energy: 1.2131632284911862
Energy: 1.0659797688804695
Energy: 1.0093313128188104
Energy: 0.9215751940925491
Energy: 0.8798854996569492
Energy: 0.9215751940925491
Energy: 0.8737398521195217
Energy: 0.8817627026182817
Energy: 0.8812185272580139
Energy: 0.8817627026182817
Energy: 0.9847667289768366
Energy: 1.0668934663456144
Energy: 0.8794993375322747
Energy: 1.0668934663456144
Energy: 0.99820284965905
Energy: 0.9262715848431188
Energy: 0.8808600930391037
Energy: 0.9262715848438365
Energy: 0.8807789104955329
Energy: 0.8809742419266746
Energy: 0.999246032625619
Energy: 0.8809742419266746
Energy: 1.1567097137959303
Energy: 0.9257795622794283
Energy: 0.8780585358809231
Energy: 0.9257795622794283
Energy: 0.8737148534621239
Energy: 0.9475518515444379
Energy: 0.9941500205977714
Energy: 0.9475518515451556
Energy: 0.875301596196481
Energy: 1.0705012742749422
Energy: 0.8803037655806781
Energy: 1.07050127427566
Energy: 0.8749504186231847
Energy: 0.9224573778380748
Energy: 0.877112133295007
Energy: 0.9224573778366393
Energy: 0.874213060445476
Energy: 1.0671438481973183
Energy: 1.1542995265807654
Energy: 1.0671438481973183
Energy: 1.0017585697464548
Energy: 1.0140149701033196
Energy: 0.8771593562654869
Energy: 1.014014970104755
Energy: 0.8748138465727004
Energy: 0.9541070263858267
Energy: 1.0673134594771487
Energy: 0.954107026384391
Energy: 0.9894268286303755
Energy: 1.06476633108028
Energy: 0.8850074144691767
Energy: 1.0647663310795623
Energy: 0.8753989044154429
Energy: 0.9925824205634128
Energy: 0.9855926339026396
Energy: 0.9925824205619772
Energy: 0.8766406112507964
Energy: 1.0694285149586908
Energy: 0.9927949077433702
Energy: 1.0694285149586908
Energy: 0.9338977263985468
Energy: 0.99187348597657
Energy: 0.8752381675306168
Energy: 0.99187348597657
Energy: 0.8756587960278512
Energy: 0.9257049605645368
Energy: 0.9955017026244232
Energy: 0.9257049605645368
Energy: 1.0062659616781733
Energy: 0.9867077900248323
Energy: 0.8807152479646975
Energy: 0.9867077900255502
Energy: 0.8779499258865671
Energy: 0.9263785000675666
Energy: 0.9397505148571159
Energy: 0.9263785000661309
Energy: 0.9896507875522929
Energy: 1.0652328025003692
Energy: 0.9875927235914489
Energy: 1.0652328025003692
Energy: 0.9398831542283036
Energy: 0.883144728823311
Energy: 0.874795541529811
Energy: 0.8831447288225932
Energy: 0.8803744148050738
Energy: 0.9883483587927571
Energy: 0.8751447886381206
Energy: 0.9883483587934748
Energy: 1.1687681142116242
Energy: 0.9480867799378506
Energy: 0.8730694551243947
Energy: 0.9480867799385685
Energy: 0.8783899669607781
Energy: 1.0176077788145212
Energy: 1.089639516558641
Energy: 1.0176077788166746
Energy: 0.9405508359906473
Energy: 0.881147757004135
Energy: 0.8735935908996729
Energy: 0.8811477570034172
Energy: 0.9367962257041101
Energy: 0.9918130118314056
Energy: 0.9843556139590218
Energy: 0.9918130118306878
Energy: 0.8844504314171663
Energy: 1.068604894409786
Energy: 0.9850270136959395
Energy: 1.0686048944105035
Energy: 0.9365404498739024
Energy: 0.88099986882139
Energy: 0.8732559959730438
Energy: 0.8809998688206723
Energy: 0.879760259554986
Energy: 1.0177777663042946
Energy: 1.081627255327552
Energy: 1.0177777663042946
Energy: 1.1379760937391676
Energy: 0.948812383522017
Energy: 0.8726213462156085
Energy: 0.9488123835169923
Energy: 0.8797894787208755
Energy: 0.9250886028994986
Energy: 0.8742136414610674
Energy: 0.9250886028966274
Energy: 0.8790594812140056
Energy: 0.8808562168095586
Energy: 0.8742919607272894
Energy: 0.8808562168088407
Energy: 0.9934213433758153
Energy: 1.067123806553275
Energy: 0.9851925610727026
Energy: 1.067123806552557
Energy: 0.8798948065387225
Energy: 1.0086117153564478
Energy: 1.1555440026867663
Energy: 1.0086117153578833

minimum gb energy = 0.8726213462156085 eV
minimum distance =  2.30121255147817 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 0.9543462687039498
Energy: 0.9520052671638943
Energy: 1.1894659078435796
Energy: 0.9520052671616166
Energy: 0.9386210573330479
Energy: 0.9552557669196242
Energy: 0.8813773191207905
Energy: 0.9552557669196242
Energy: 0.8781674045395716
Energy: 0.9309181466734038
Energy: 0.8812456075423009
Energy: 0.9309181466734038
Energy: 0.8803098679691558
Energy: 0.8860978348283383
Energy: 0.885453271732949
Energy: 0.8860978348271995
Energy: 0.9354860714752659
Energy: 0.9537801849289075
Energy: 0.936936398495233
Energy: 0.9537801849300463
Energy: 0.885496396712505
Energy: 0.8779346997734645
Energy: 1.075490283812704
Energy: 0.8779346997711869
Energy: 1.130496738793804
Energy: 1.0118262182583142
Energy: 0.8786715740804898
Energy: 1.0118262182583142
Energy: 0.8837120978656838
Energy: 0.8849613215168041
Energy: 1.0627168291134472
Energy: 0.8849613215168041
Energy: 1.1191242030734823
Energy: 0.8835833375201769
Energy: 0.8831365972468473
Energy: 0.8835833375167602
Energy: 0.8780628326501231
Energy: 0.9485515258951567
Energy: 0.878433265802394
Energy: 0.9485515258962955
Energy: 0.8845071593737537
Energy: 0.8831281280588708
Energy: 1.0626718415753869
Energy: 0.8831281280611485
Energy: 1.0004669537073227
Energy: 0.8889669493044944
Energy: 0.8804718110282587
Energy: 0.8889669493044944
Energy: 0.8849725389728224
Energy: 0.9523983964634579
Energy: 1.0550107668932083
Energy: 0.9523983964634579
Energy: 1.102138114578229
Energy: 0.9991137282730322
Energy: 0.8861418255350832
Energy: 0.99911372827531
Energy: 0.8802515078669474
Energy: 1.010572764894312
Energy: 1.048702765145889
Energy: 1.010572764893173
Energy: 1.0609632552359904
Energy: 0.8841912732450736
Energy: 0.8836343720904742
Energy: 0.8841912732439348
Energy: 0.9394582771604214
Energy: 0.9911760664774866
Energy: 0.8781985522254105
Energy: 0.9911760664774866
Energy: 0.9416754399506204
Energy: 0.8852879379353373
Energy: 0.8776204044815853
Energy: 0.8852879379364762
Energy: 0.8885007833892716
Energy: 0.8856884753098788
Energy: 0.8834261247639593
Energy: 0.8856884753110178
Energy: 0.8811111677963004
Energy: 0.9533350566451855
Energy: 1.1070431882848268
Energy: 0.9533350566463243
Energy: 1.0923980844545684
Energy: 0.8781395298197319
Energy: 0.8871175977475433
Energy: 0.8781395298208707
Energy: 0.8855635973589032
Energy: 0.9538232383848536
Energy: 0.9610645897306946
Energy: 0.9538232383859925

minimum gb energy = 0.8776204044815853 eV
minimum distance =  2.29706020385695 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 0.9174401871118553
Energy: 0.9167588132209251
Energy: 1.1986307528132016
Energy: 0.9167588132168987
Energy: 1.120467038020303
Energy: 0.9429108469341071
Energy: 0.8887383143747396
Energy: 0.9429108469316912
Energy: 0.8925755909350033
Energy: 0.9169319421886897
Energy: 0.9103162289918489
Energy: 0.9169319421886897
Energy: 0.9215895472329328
Energy: 0.9667413890059167
Energy: 0.8888938515726004
Energy: 0.966741389012359
Energy: 0.8927291644242851
Energy: 0.9524714989595251
Energy: 0.913232510469696
Energy: 0.9524714989587199
Energy: 0.8900580181134398
Energy: 0.9161006646530837
Energy: 1.0941502231342992
Energy: 0.9161006646563049
Energy: 1.008846993966388
Energy: 0.986828031447806
Energy: 0.9134196910207811
Energy: 0.9868280314486113
Energy: 0.8900612799286802
Energy: 0.9152852845975666
Energy: 1.1153995894736208
Energy: 0.915285284595956
Energy: 1.0168002438199044
Energy: 0.9639635099016134
Energy: 0.8915047748390743
Energy: 0.9639635099016134
Energy: 0.8894958531059738
Energy: 0.9688342974025569
Energy: 0.993131831598897
Energy: 0.9688342974081939
Energy: 0.9227079101821724
Energy: 0.9142937273315372
Energy: 0.9132022041698384
Energy: 0.9142937273291214
Energy: 0.9148283802775904
Energy: 0.9527685594766883
Energy: 0.9154850036315512
Energy: 0.9527685594750775
Energy: 0.9140675833752454
Energy: 0.9146921406660324
Energy: 0.915255106027314
Energy: 0.9146921406724747
Energy: 0.9144479191056792
Energy: 0.9188977555492658
Energy: 0.9155561842455257
Energy: 0.9188977555500711
Energy: 0.8875416464988801
Energy: 1.047152119275385
Energy: 1.013313760377951
Energy: 1.0471521192713587
Energy: 1.2197528955306827
Energy: 0.9175819365406198
Energy: 0.8940481807421553
Energy: 0.9175819365462569
Energy: 0.8875480975499993
Energy: 0.9512815672512901
Energy: 0.9381210164872056
Energy: 0.9512815672488742
Energy: 0.9016309757974025
Energy: 0.9376182261158834
Energy: 0.9152381043138924
Energy: 0.9376182261158834
Energy: 0.8876247332784601
Energy: 0.9142141041514227
Energy: 0.9154024913909148
Energy: 0.9142141041457856
Energy: 0.8891248346795165
Energy: 0.9535889085813419
Energy: 0.9152488849725455
Energy: 0.9535889085853686
Energy: 0.9228719921052664
Energy: 0.9153885539004198
Energy: 0.8914071075198712
Energy: 0.9153885539012252
Energy: 0.8896856553746766
Energy: 0.9158373487288678
Energy: 1.0026634069424576
Energy: 0.9158373487280626
Energy: 1.0944658018684694
Energy: 0.9642037837815374
Energy: 0.9087940772945535
Energy: 0.9642037837823426
Energy: 0.9153856782935827
Energy: 0.9152483568628981
Energy: 1.0994682842889352
Energy: 0.9152483568588717
Energy: 0.912131463313883
Energy: 0.9537224078536772
Energy: 0.9023825805495758
Energy: 0.9537224078488453
Energy: 0.9211542624834427
Energy: 0.9152821921292775
Energy: 0.9139631988993865
Energy: 0.9152821921268617
Energy: 0.8925287664869715
Energy: 0.9674961613026221
Energy: 0.9021983544889184
Energy: 0.9674961613066484
Energy: 0.9217298821307799
Energy: 0.9511988160038536
Energy: 0.8887092955587896
Energy: 0.9511988160062694
Energy: 0.8921707083570728
Energy: 0.9179910271293275
Energy: 1.0091606192310114
Energy: 0.9179910271261063
Energy: 1.1492980442359095
Energy: 0.8993087943268643
Energy: 0.8890009975873979
Energy: 0.8993087943308542
Energy: 0.8921744029582231
Energy: 0.9176280559149781
Energy: 1.1034885323822698
Energy: 0.9176280559093412

minimum gb energy = 0.8875416464988801 eV
minimum distance =  2.2753432427192 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.8802558432963249
Energy: 0.9027897211546142
Energy: 1.2877213997541304
Energy: 0.9027897211551752
Energy: 0.8677985457581323
Energy: 0.8660509734320281
Energy: 0.8826482632679111
Energy: 0.8660509734317474
Energy: 0.9079820674616057
Energy: 0.9345317103850552
Energy: 1.0079884197609588
Energy: 0.9345317103847748
Energy: 0.8819214874231684
Energy: 0.866730779754167
Energy: 0.8702382302372601
Energy: 0.8667307797547281
Energy: 0.8810942000609399
Energy: 0.9243479582797283
Energy: 0.9036724636564724
Energy: 0.9243479582797283
Energy: 0.9024689386772227
Energy: 0.9293765247922513
Energy: 0.9024605899055751
Energy: 0.9293765247930617
Energy: 0.9016074095923385
Energy: 0.9243420928416042
Energy: 0.8811018055757195
Energy: 0.9243420928410744
Energy: 0.870265170732808
Energy: 0.8665748389821195
Energy: 0.8820119724613769
Energy: 0.8665748389837714
Energy: 1.0079588709662521
Energy: 0.9345192039657546
Energy: 0.9080134611619147
Energy: 0.9345192039657546

minimum gb energy = 0.8660509734317474 eV
minimum distance =  2.3292317751462 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.8366882715240529
Energy: 0.8699798624161579
Energy: 1.07772744153737
Energy: 0.8699798624161579
Energy: 0.9783145315143259
Energy: 0.8816672313013318
Energy: 0.8216178228150174
Energy: 0.8816672313020926
Energy: 0.827583516696655
Energy: 0.8712751020309251
Energy: 0.9984714176229763
Energy: 0.8712751020309251
Energy: 0.8291803879539318
Energy: 0.8989377403545828
Energy: 0.8236497023236715
Energy: 0.8989377403561043
Energy: 0.8301976827237568
Energy: 0.899190231844392
Energy: 0.9877951458052655
Energy: 0.8991902318436312
Energy: 0.8804139490474235
Energy: 0.8715069517923772
Energy: 0.8210514680974753
Energy: 0.8715069517916165
Energy: 0.8275070128169013
Energy: 0.8994900992011187
Energy: 0.8343203625236946
Energy: 0.899490099200358
Energy: 0.8242076614635624
Energy: 0.8729900930145924
Energy: 0.8305033250586958
Energy: 0.8729900930130711
Energy: 0.8301118042480847
Energy: 0.899710708549693
Energy: 0.8359275977267819
Energy: 0.899710708549693
Energy: 0.8270221244837842
Energy: 0.8998126269446189
Energy: 0.8300693750005844
Energy: 0.8998126269430975
Energy: 0.8295310143820002
Energy: 0.8734313755407154
Energy: 0.8292495138833567
Energy: 0.8734313755414761
Energy: 0.8290873550692386
Energy: 0.9191245484919269
Energy: 0.9175057125538948
Energy: 0.9191245484919269
Energy: 0.8802177137483442
Energy: 0.8708672469446218
Energy: 0.8726480781712455
Energy: 0.8708672469453824
Energy: 0.8306541849813123
Energy: 0.8722392334219202
Energy: 0.8509380398311921
Energy: 0.8722392334219202
Energy: 0.850195578175675
Energy: 0.9001604511103259
Energy: 0.8302457839494595
Energy: 0.9001604511088046
Energy: 0.8253898566263679
Energy: 0.8700792541065474
Energy: 0.8626207858097249
Energy: 0.8700792541065474
Energy: 0.9637079394499811
Energy: 0.9211626422525953
Energy: 0.8214346179285203
Energy: 0.9211626422518345
Energy: 0.8309603260072366
Energy: 0.8716269462612077
Energy: 0.928183312572871
Energy: 0.8716269462619685
Energy: 0.8228304147789596
Energy: 0.9009191174974432
Energy: 0.8218880201534833
Energy: 0.9009191174974432
Energy: 0.8277706372938185
Energy: 0.8980905686409955
Energy: 0.8565868292892079
Energy: 0.8980905686402347
Energy: 0.8288339363352252
Energy: 0.8986740527413739
Energy: 0.8248769997774784
Energy: 0.8986740527413739
Energy: 0.8307422658684034
Energy: 0.8999909569415308
Energy: 0.8341670192083533
Energy: 0.8999909569422914
Energy: 0.8213122884555543
Energy: 0.8723226191444082
Energy: 0.8282309519676067
Energy: 0.8723226191436476
Energy: 0.8860473479011665
Energy: 0.860218220709479
Energy: 0.827928257248513
Energy: 0.8602182207087182
Energy: 0.8791303048397608
Energy: 0.8535337235752458
Energy: 0.8226974859554862
Energy: 0.8535337235752458
Energy: 0.8564501023198688
Energy: 0.8982819277006012
Energy: 0.8302984093638853
Energy: 0.8982819276960371
Energy: 0.822712396386656
Energy: 0.8958643618897296
Energy: 0.8474682383527209
Energy: 0.8958643618889688
Energy: 0.8982701286388733
Energy: 0.8906051171884461
Energy: 0.8253848692715101
Energy: 0.8906051171884461
Energy: 0.8296143527918687
Energy: 0.8831799177960089
Energy: 0.9671134760681624
Energy: 0.8831799177952482
Energy: 0.9434297135041748
Energy: 0.8706565159843809
Energy: 0.8310383875912363
Energy: 0.8706565159843809
Energy: 0.8230627109609115
Energy: 0.8464215687884041
Energy: 0.9422098043398943
Energy: 0.8464215687876434
Energy: 0.96521593654125
Energy: 0.8893918661176802
Energy: 0.8280325158651143
Energy: 0.8893918661169194
Energy: 0.8237601675071554
Energy: 0.89660481001606
Energy: 0.8296785928866169
Energy: 0.8966048100168206

minimum gb energy = 0.8210514680974753 eV
minimum distance =  2.28229387760734 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 0.8264767193299359
Energy: 0.8262800426117843
Energy: 1.2475993432120265
Energy: 0.826280042612836
Energy: 0.8092102252887798
Energy: 0.8393550824278454
Energy: 0.773836411344286
Energy: 0.8393550824310007
Energy: 0.7775410836637302
Energy: 0.8265359819517103
Energy: 0.9497859783536479
Energy: 0.8265359819506586
Energy: 0.8043521603636782
Energy: 0.8716234577161194
Energy: 0.7739704358407156
Energy: 0.871623457712964
Energy: 0.7769573563979632
Energy: 0.8983705167004737
Energy: 0.9861433278841985
Energy: 0.8983705167015256
Energy: 0.7765235919433777
Energy: 0.8297408287923458
Energy: 0.7740250247030531
Energy: 0.8297408287902421
Energy: 0.776783116520291
Energy: 0.8979523820391111
Energy: 0.8431189237742354
Energy: 0.8979523820422664
Energy: 0.7767251177748842
Energy: 0.8292999278508362
Energy: 0.8358398286528504
Energy: 0.8292999278487325
Energy: 0.8262949913628154
Energy: 0.8099210246208416
Energy: 0.8311748194766128
Energy: 0.8099210246197898
Energy: 0.8263290902250394
Energy: 0.8098076333890084
Energy: 0.852792093262952
Energy: 0.8098076333900602
Energy: 0.7767095376481364
Energy: 0.8293273042886944
Energy: 0.8358757928234414
Energy: 0.829327304290798
Energy: 0.7769573089140186
Energy: 0.8979553528171863
Energy: 0.8432747051202861
Energy: 0.897955352818238
Energy: 0.7764854763265274
Energy: 0.8297620235062012
Energy: 0.7739853014196768
Energy: 0.8297620235062012
Energy: 0.7770869642763613
Energy: 0.8983490192221191
Energy: 0.9964041576806676
Energy: 0.8983490192200155
Energy: 0.8042655849646472
Energy: 0.8716930281296442
Energy: 0.773976006315455
Energy: 0.871693028130696
Energy: 0.7775305320949669
Energy: 0.8265537233450888
Energy: 0.8636788090219224
Energy: 0.8265537233461405
Energy: 0.8091175755202961
Energy: 0.839262770338229
Energy: 0.773709036778447
Energy: 0.8392627703350737
Energy: 0.8264767193309878
Energy: 0.8262800426117843
Energy: 0.853946165778767
Energy: 0.826280042612836
Energy: 0.8092102252866764
Energy: 0.8393550824267936
Energy: 0.773836411344286
Energy: 0.8393550824310007
Energy: 0.7775410836637302
Energy: 0.8265359819517103
Energy: 0.9596024791234016
Energy: 0.8265359819506586
Energy: 0.80435216036473
Energy: 0.8716234577161194
Energy: 0.7739704358407156
Energy: 0.871623457712964
Energy: 0.7769573563979632
Energy: 0.8983705167004737
Energy: 0.9714732255965659
Energy: 0.8983705167015256
Energy: 0.7765235919423259
Energy: 0.8297408287923458
Energy: 0.7740250247020013
Energy: 0.8297408287902421
Energy: 0.776783116520291
Energy: 0.8979523820391111
Energy: 0.8281015415465085
Energy: 0.8979523820422664

minimum gb energy = 0.773709036778447 eV
minimum distance =  2.29964630195967 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.8156672457469488
Energy: 0.8156328325681157
Energy: 1.031837373903226
Energy: 0.8156328325674657
Energy: 0.9202195577241952
Energy: 0.8000861344328182
Energy: 0.7772953776573118
Energy: 0.8000861344347685
Energy: 0.7815516515209191
Energy: 0.810633536762613
Energy: 1.0135062813985045
Energy: 0.8106335367619628
Energy: 0.8282988896571484
Energy: 0.7765033146399869
Energy: 0.7755782449286617
Energy: 0.7765033146367365
Energy: 0.7819881078609854
Energy: 0.864257490780473
Energy: 0.8056797575692739
Energy: 0.8642574907798228
Energy: 0.7824263780169609
Energy: 0.7816213335731979
Energy: 0.7821607787011006
Energy: 0.7816213335731979
Energy: 0.7843026112325212
Energy: 0.8559476891699556
Energy: 0.8241652270385186
Energy: 0.8559476891699556
Energy: 0.7772743861484924
Energy: 0.8418152032168482
Energy: 0.7764112212207939
Energy: 0.8418152032174984
Energy: 0.8230393527622719
Energy: 0.8314380069225636
Energy: 0.8146759320337303
Energy: 0.8314380069238638
Energy: 0.8222453549862995
Energy: 0.8310782010954948
Energy: 0.7844799536945675
Energy: 0.8310782010935445
Energy: 0.7813661316453376
Energy: 0.8217345588202654
Energy: 0.7757008769354528
Energy: 0.8217345588189652
Energy: 0.7846638082074768
Energy: 0.8421264450771571
Energy: 0.7832630296711104
Energy: 0.8421264450771571
Energy: 0.7813790614054105
Energy: 0.8260003581081483
Energy: 0.7760265298575647
Energy: 0.8260003581100984
Energy: 0.7863308481827586
Energy: 0.8628620046564136
Energy: 0.8331810781797329
Energy: 0.8628620046544635
Energy: 0.775995098076424
Energy: 0.7853742313072878
Energy: 0.8219809353646689
Energy: 0.7853742313066377
Energy: 0.781826043932592
Energy: 0.8110829643143375
Energy: 0.9229784488864429
Energy: 0.8110829643143375
Energy: 0.7941363426202384
Energy: 0.7863090746528973
Energy: 0.7758684033038739
Energy: 0.7863090746502971
Energy: 0.7763110637232924
Energy: 0.8157940160871909
Energy: 0.7976991467751962
Energy: 0.8157940160852407
Energy: 0.9062176741789245
Energy: 0.8451358093789847
Energy: 0.783926464965015
Energy: 0.8451358093731339
Energy: 0.7826673946364332
Energy: 0.8110182825822094
Energy: 0.8395923220996531
Energy: 0.8110182825828595
Energy: 0.7798920852528008
Energy: 0.796331042868277
Energy: 0.7758994415404197
Energy: 0.7963310428663268
Energy: 0.7765678387443576
Energy: 0.8174159117750733
Energy: 0.9172826960804831
Energy: 0.8174159117763735
Energy: 0.8122334904397102
Energy: 0.7817431781102611
Energy: 0.7834330702667511
Energy: 0.7817431781109111
Energy: 0.7818147520489225
Energy: 0.8574247624864061
Energy: 0.9207502064230457
Energy: 0.8574247624870562
Energy: 0.8190678131193859
Energy: 0.8165399267042595
Energy: 0.7757613985499638
Energy: 0.8165399267029593
Energy: 0.7756567622908332
Energy: 0.8649118739700564
Energy: 0.7939855156129649
Energy: 0.8649118739733069
Energy: 0.905401530190896
Energy: 0.8281525214757162
Energy: 0.7829113858591106
Energy: 0.8281525214770165
Energy: 0.8256791469857085
Energy: 0.9319117108350715
Energy: 0.7754651913793518
Energy: 0.9319117108331212
Energy: 0.8299048705331776
Energy: 0.8625693556260093
Energy: 0.7828126466876225
Energy: 0.862569355624709
Energy: 0.7756387852757649
Energy: 0.8256012577401138
Energy: 0.8124785310657265
Energy: 0.825601257740764
Energy: 0.7898541034467754
Energy: 0.8627564455711755
Energy: 0.7894825915808628
Energy: 0.8627564455698753
Energy: 0.7757953098944887
Energy: 0.82261764518743
Energy: 0.7788634526235337
Energy: 0.82261764518743
Energy: 0.7827050768397766
Energy: 0.8314132412804306
Energy: 0.9269851443587875
Energy: 0.8314132412823808
Energy: 0.8130594483461091
Energy: 0.940695375038241
Energy: 0.7852161610109453
Energy: 0.940695375038891
Energy: 0.7840500349544879
Energy: 0.8181646972323701
Energy: 0.8105591643480687
Energy: 0.8181646972317199
Energy: 0.8133818285725436
Energy: 0.8570814661510623
Energy: 0.7826775782366633
Energy: 0.8570814661510623
Energy: 0.7831440901292751
Energy: 0.7826616910275038
Energy: 0.7837979602873689
Energy: 0.7826616910255535
Energy: 0.7822023379862857
Energy: 0.865194487570916
Energy: 0.7768548106743685
Energy: 0.8651944875722163

minimum gb energy = 0.7754651913793518 eV
minimum distance =  2.29400075290109 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.717094891303025
Energy: 0.7173115135002445
Energy: 1.041942768294715
Energy: 0.7173115135002445
Energy: 0.7188074627842688
Energy: 0.7305361217488531
Energy: 0.7268930801498327
Energy: 0.7305361217471521
Energy: 0.7250182930191019
Energy: 0.8293611261180502
Energy: 1.0999168040951806
Energy: 0.8293611261163493
Energy: 0.7314177753541542
Energy: 0.7305241060995527
Energy: 0.7268649124057184
Energy: 0.7305241060995527
Energy: 0.7176368448741266
Energy: 0.7936707577535307
Energy: 0.7341445610251592
Energy: 0.7936707577535307
Energy: 0.7189798088140987
Energy: 0.7182255553822535
Energy: 0.7212356035824559
Energy: 0.7182255553822535
Energy: 0.7252858508966754
Energy: 0.8305961223638442
Energy: 0.7282040811597287
Energy: 0.8305961223638442
Energy: 0.7476098621957469
Energy: 0.9188109892487306
Energy: 0.7268564511499439
Energy: 0.9188109892487306
Energy: 0.7177460232734241
Energy: 0.7929620337792797
Energy: 0.7259386608813571
Energy: 0.7929620337792797
Energy: 0.7317845882052137
Energy: 0.7179935945647542
Energy: 0.7199592818637712
Energy: 0.7179935945647542
Energy: 0.717188690785337
Energy: 0.7314817306344532
Energy: 0.7280944152113141
Energy: 0.7314817306344532
Energy: 0.7172995869351927
Energy: 0.828047242561598
Energy: 0.7268240498289112
Energy: 0.828047242561598
Energy: 0.7178869334760646
Energy: 0.7195813592611137
Energy: 0.7457729373317968
Energy: 0.7195813592611137
Energy: 0.7201573067784768
Energy: 0.7906276864939403
Energy: 0.7201547357769036
Energy: 0.7906276864939403
Energy: 0.7265823492794555
Energy: 0.7195720145279975
Energy: 0.7178312044191174
Energy: 0.7195720145279975

minimum gb energy = 0.717094891303025 eV
minimum distance =  2.31346936413722 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.703967416402927
Energy: 0.6815112849053917
Energy: 1.1524114124311364
Energy: 0.6815112849018271
Energy: 0.8324548570507422
Energy: 0.6926356515803797
Energy: 0.684362117092733
Energy: 0.6926356515689727
Energy: 0.682039142682685
Energy: 0.6815215027720112
Energy: 0.8344109776706787
Energy: 0.6815215027691595
Energy: 0.6924114482918358
Energy: 0.6928808847214267
Energy: 0.6807439145282773
Energy: 0.692880884717862
Energy: 0.6827535498817694
Energy: 0.7385177835838548
Energy: 0.6938295715165902
Energy: 0.7385177835838548
Energy: 0.6935744210600383
Energy: 0.6937869952097712
Energy: 0.6943010631322484
Energy: 0.6937869952047807
Energy: 0.6825686859522285
Energy: 0.7346013298235672
Energy: 0.7652972070151652
Energy: 0.734601329824993
Energy: 0.6863768884757345
Energy: 0.6925114344895329
Energy: 0.6943119143629513
Energy: 0.6925114344923846
Energy: 0.6827179238981644
Energy: 0.7345838823786499
Energy: 0.9529919182702544
Energy: 0.7345838823836405
Energy: 0.8571348611673623
Energy: 0.7467721343438133
Energy: 0.6811742417291101
Energy: 0.7467721343402486
Energy: 0.6827901043992542
Energy: 0.7478002571887387
Energy: 0.6940956723161777
Energy: 0.7478002571873127
Energy: 0.7010447764227427
Energy: 0.7468525735571844
Energy: 0.6792686471307278
Energy: 0.7468525735557585
Energy: 0.7121211227109611
Energy: 0.6923212727454867
Energy: 0.691259736060524
Energy: 0.6923212727433479
Energy: 0.9546177468911488
Energy: 0.7469565692262469
Energy: 0.6795328117566145
Energy: 0.746956569224821
Energy: 0.682840190559215
Energy: 0.6813540361602232
Energy: 0.691829816297868
Energy: 0.6813540361609363
Energy: 0.69825458487601
Energy: 0.7475519943276466
Energy: 0.6832836395436792
Energy: 0.7475519943283596
Energy: 0.6894765949173277
Energy: 0.7347141664139683
Energy: 0.6831971518602548
Energy: 0.7347141664146812
Energy: 0.6982615610876102
Energy: 0.7326655689377165
Energy: 0.7027775995801083
Energy: 0.7326655689391424
Energy: 0.701544193241181
Energy: 0.6940309493467076
Energy: 0.7029020508431676
Energy: 0.6940309493431429
Energy: 0.7014083879325885
Energy: 0.6939213909557317
Energy: 0.702877245227454
Energy: 0.6939213909578705
Energy: 0.6982837911516514
Energy: 0.7326990568576789
Energy: 0.7029326979589231
Energy: 0.73269905685554
Energy: 0.6892461442477009
Energy: 0.7348548328797384
Energy: 0.6832916112036074
Energy: 0.7348548328768867
Energy: 0.6981784805326807
Energy: 0.747403154426206
Energy: 0.6833489493645326
Energy: 0.7474031544297707
Energy: 0.6828010830081933
Energy: 0.6813800836615322
Energy: 0.6944531219712742
Energy: 0.6813800836608193
Energy: 0.9546603422337919
Energy: 0.7471575791179944
Energy: 0.679190110685586
Energy: 0.7471575791172815
Energy: 0.7121005975672395
Energy: 0.6926157024045946
Energy: 0.6941448640418717
Energy: 0.6926157024060204
Energy: 0.7009063128862748
Energy: 0.7466982382736429
Energy: 0.67937921071725
Energy: 0.7466982382722169
Energy: 0.6828521445141678
Energy: 0.7477441663599284
Energy: 0.694176262059333
Energy: 0.7477441663592154
Energy: 0.8574529442272283
Energy: 0.7466970253369455
Energy: 0.6808865427722557
Energy: 0.7466970253369455
Energy: 0.6827628294201717
Energy: 0.7348387791288222
Energy: 0.9528860978243228
Energy: 0.7348387791373774
Energy: 0.6814944125914869
Energy: 0.6925285073523442
Energy: 0.6943178082348741
Energy: 0.6925285073601865
Energy: 0.6828717186307618
Energy: 0.7347676359332774
Energy: 0.8278595690673484
Energy: 0.7347676359339903
Energy: 0.6932853267482325
Energy: 0.6935087219798963
Energy: 0.6942878580711479
Energy: 0.6935087219833962
Energy: 0.6828965755929578
Energy: 0.738632475670312
Energy: 0.6945714855287287
Energy: 0.7386324756717378
Energy: 0.6925374360302147
Energy: 0.6928208526053762
Energy: 0.6807769220952877
Energy: 0.6928208526053762

minimum gb energy = 0.679190110685586 eV
minimum distance =  2.33332225894539 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.6348899608652631
Energy: 0.6349070255140289
Energy: 0.6952074899017637
Energy: 0.6349070255140289
Energy: 0.6343804674643778
Energy: 0.7134336118519314
Energy: 0.6244201380259616
Energy: 0.7134336118519314
Energy: 0.618846090003978
Energy: 0.6527875563776518
Energy: 0.628711178837011
Energy: 0.6527875563776518
Energy: 0.6199845659960546
Energy: 0.7132914902356978
Energy: 0.6244639278765688
Energy: 0.7132914902356978
Energy: 0.6235919496311648
Energy: 0.6350052873438883
Energy: 0.6402041628769095
Energy: 0.6350052873451149
Energy: 0.6270669106144964
Energy: 0.7137744320721349
Energy: 0.6209233072702776
Energy: 0.7137744320721349
Energy: 0.6200349142961035
Energy: 0.7384131002101297
Energy: 0.6346406369799975
Energy: 0.7384131002101297
Energy: 0.6198059910529047
Energy: 0.635668802307115
Energy: 0.6372252563618074
Energy: 0.635668802307115
Energy: 0.6235828427134751
Energy: 0.6366712929578877
Energy: 0.7604631073128459
Energy: 0.6366712929578877
Energy: 0.9463971600900309
Energy: 0.6362823126537234
Energy: 0.6209443387877506
Energy: 0.6362823126537234
Energy: 0.6248787960342241
Energy: 0.6580707985913572
Energy: 0.6216224252798019
Energy: 0.6580707985901306
Energy: 0.914162552658406
Energy: 0.635122484668415
Energy: 0.6245746918542763
Energy: 0.635122484668415
Energy: 0.623910658314259
Energy: 0.7129738212943613
Energy: 0.6272098214643871
Energy: 0.7129738212919081
Energy: 0.8697040950935193
Energy: 0.7372904583887766
Energy: 0.6202232269090501
Energy: 0.7372904583887766
Energy: 0.6396984427584502
Energy: 0.6565224875357736
Energy: 0.6213476432169288
Energy: 0.6565224875357736
Energy: 0.6410276897987324
Energy: 0.6353808635922622
Energy: 0.6247499832877166
Energy: 0.6353808635922622
Energy: 0.6235683804836266
Energy: 0.7140336592965312
Energy: 0.6472520142734339
Energy: 0.7140336592965312
Energy: 0.6202329972626073
Energy: 0.6571080393213354
Energy: 0.6202934043371708
Energy: 0.6571080393213354
Energy: 0.6259040073848517
Energy: 0.6364113566374655
Energy: 0.6192284951575563
Energy: 0.6364113566374655
Energy: 0.6194458439420346
Energy: 0.6355869523272603
Energy: 0.6191634438089331
Energy: 0.6355869523260335

minimum gb energy = 0.618846090003978 eV
minimum distance =  2.33252016055822 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.5821164091911485
Energy: 0.5610594690511036
Energy: 0.5975727806203247
Energy: 0.5610594690520614
Energy: 0.7590700887173444
Energy: 0.5693299265400615
Energy: 0.5639396248851611
Energy: 0.5693299265391036
Energy: 0.5587290964914869
Energy: 0.558920801197675
Energy: 0.5597382786440107
Energy: 0.558920801197675
Energy: 0.5678480338951886
Energy: 0.5695755553250108
Energy: 0.5641498936852422
Energy: 0.569575555324053
Energy: 0.5631389213826953
Energy: 0.5695220171177132
Energy: 0.57446539287206
Energy: 0.5695220171167553
Energy: 0.5542477767371885
Energy: 0.5695580603694725
Energy: 0.5641297738243908
Energy: 0.5695580603685146
Energy: 0.563925300480956
Energy: 0.5588000510910964
Energy: 0.5683198508185819
Energy: 0.5588000510901385
Energy: 0.5594119158608142
Energy: 0.5822839043369767
Energy: 0.559898959628656
Energy: 0.5822839043360191
Energy: 0.5629855377540751
Energy: 0.5693462094114339
Energy: 0.857747141155525
Energy: 0.5693462094114339
Energy: 0.5541427274545879
Energy: 0.5613022716472027
Energy: 0.5838163018990308
Energy: 0.5613022716462449
Energy: 0.5638024697843501
Energy: 0.5592737702568845
Energy: 0.9431233970148566
Energy: 0.5592737702588002
Energy: 0.8201125698618634
Energy: 0.7616417017556171
Energy: 0.5599392341700976
Energy: 0.7616417017565749
Energy: 0.5631364176151434
Energy: 0.5695569870780038
Energy: 0.8546485551953429
Energy: 0.5695569870780038
Energy: 0.8052765744386482
Energy: 0.7374914238197299
Energy: 0.5640926787359581
Energy: 0.7374914238187721
Energy: 0.5637780656286936
Energy: 0.5590250385199629
Energy: 0.5625026752467256
Energy: 0.559025038519005
Energy: 0.5701902669383925
Energy: 0.6484780717110772
Energy: 0.5600800913977239
Energy: 0.6484780717110772
Energy: 0.5631272377628013
Energy: 0.5822349897903785
Energy: 0.5593389299712197
Energy: 0.5822349897894206
Energy: 0.7574744952485184
Energy: 0.5691055053628762
Energy: 0.5641072276534761
Energy: 0.5691055053619184
Energy: 0.5867405540303079
Energy: 0.559402710752119
Energy: 0.5541037264197248
Energy: 0.559402710752119
Energy: 0.9407702338939771
Energy: 0.6472249996462041
Energy: 0.5664882102231197
Energy: 0.6472249996452463
Energy: 0.5631574370103558
Energy: 0.5819468683995025
Energy: 0.5768386963659792
Energy: 0.5819468684129115
Energy: 0.5626954931600601
Energy: 0.5695213274621994
Energy: 0.5642352918096446
Energy: 0.5695213274621994
Energy: 0.564093607206066
Energy: 0.559838137464888
Energy: 0.8023149833962617
Energy: 0.559838137464888
Energy: 0.5583870433285274
Energy: 0.6466451035226431
Energy: 0.5662652524672084
Energy: 0.6466451035226431
Energy: 0.5618427422582478
Energy: 0.6477584770540711
Energy: 0.7868044503721168
Energy: 0.647758477055029
Energy: 0.5542448020976066
Energy: 0.5822601323549909
Energy: 0.5643151732203855
Energy: 0.5822601323540331

minimum gb energy = 0.5541037264197248 eV
minimum distance =  2.33838389803756 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.8451516661705148
Energy: 0.519266861428914
Energy: 0.5316338556940959
Energy: 0.519266861428914
Energy: 0.8414209906747971
Energy: 0.5110739979699057
Energy: 0.5085874081479388
Energy: 0.5110739979691203
Energy: 0.5178628687668726
Energy: 0.5069346847474576
Energy: 0.5155109673158716
Energy: 0.5069346847466725
Energy: 0.6794546367911372
Energy: 0.511394144585131
Energy: 0.5087056014434774
Energy: 0.5113941445859163
Energy: 0.5054429600761889
Energy: 0.5290823885251067
Energy: 0.520902603135015
Energy: 0.5290823885266771
Energy: 0.5178582424505381
Energy: 0.5116210359503802
Energy: 0.5086855207005598
Energy: 0.5116210359503802
Energy: 0.5079745351503145
Energy: 0.5111336052104019
Energy: 0.5182171083306625
Energy: 0.5111336052111871
Energy: 0.5049580007454468
Energy: 0.5184854044579181
Energy: 0.5060399252356544
Energy: 0.5184854044563475
Energy: 0.510738017735599
Energy: 0.5199771387755049
Energy: 0.7617819749196788
Energy: 0.519977138785713
Energy: 0.5210987827925566
Energy: 0.5072279175598828
Energy: 0.5185611865935673
Energy: 0.5072279175614534
Energy: 0.5079052578195778
Energy: 0.5114660309965101
Energy: 0.8413909360956915
Energy: 0.5114660309965101
Energy: 0.5181214313675138
Energy: 0.5193255834279771
Energy: 0.8457145397343846
Energy: 0.5193255834287622
Energy: 0.5106614273634119
Energy: 0.5220123219200737
Energy: 0.9121510490990887
Energy: 0.5220123219106508
Energy: 0.6866717819122954
Energy: 0.5298783454504844
Energy: 0.5185556248970391
Energy: 0.5298783454496991
Energy: 0.5080909695911084
Energy: 0.5110675411313155
Energy: 0.8365065634941388
Energy: 0.5110675411321007
Energy: 0.7184445590966111
Energy: 0.5201556867174156
Energy: 0.5060703202363478
Energy: 0.5201556867158451
Energy: 0.510415629700978
Energy: 0.6837366215208811
Energy: 0.761187637991899
Energy: 0.6837366215193107
Energy: 0.5196547187061559
Energy: 0.5220692434964919
Energy: 0.5085445057935024
Energy: 0.5220692434980624
Energy: 0.5080231023187285
Energy: 0.5187166263027783
Energy: 0.5147406791959835
Energy: 0.5187166263035636
Energy: 0.7033548760602711
Energy: 0.519590694216478
Energy: 0.5153972483087159
Energy: 0.519590694216478
Energy: 0.5204517169067853
Energy: 0.6837601467350826
Energy: 0.5222710639041843
Energy: 0.683760146736653
Energy: 0.974309803423805
Energy: 0.5283024460360212
Energy: 0.508636111716384
Energy: 0.5283024460658602
Energy: 0.8467743710411587
Energy: 0.5186094241381595
Energy: 0.5149468337353675
Energy: 0.51860942413973
Energy: 0.8427564261090356
Energy: 0.5182363345623769
Energy: 0.5135859771863991
Energy: 0.5182363345529541
Energy: 0.5206324861301442
Energy: 0.5711827920032613
Energy: 0.5247641392229011
Energy: 0.5711827920009056
Energy: 0.8350999128032968
Energy: 0.8279911135395951
Energy: 0.5087877504502916
Energy: 0.8279911135380247
Energy: 0.5079959563458685
Energy: 0.518383339595873
Energy: 0.7158926697476877
Energy: 0.5183833395935173
Energy: 0.5146691533981783
Energy: 0.5184513274550465
Energy: 0.5134988769010422
Energy: 0.5184513274503351
Energy: 0.510478963556928
Energy: 0.5761044816489452
Energy: 0.7052648613311286
Energy: 0.5761044816473748
Energy: 0.5137593373024575
Energy: 0.5419634916035495
Energy: 0.5110962078916355
Energy: 0.5419634916043348
Energy: 0.5079202059488761
Energy: 0.5183242211606881
Energy: 0.6995602900216431
Energy: 0.5183242211622585
Energy: 0.5093916453981968
Energy: 0.6818457177892498
Energy: 0.5235297310718671
Energy: 0.6818457177892498

minimum gb energy = 0.5049580007454468 eV
minimum distance =  2.33290398878257 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.7576234547354348
Energy: 0.47588051723348423
Energy: 0.736959424858005
Energy: 0.47588051723348423
Energy: 0.8804865084151805
Energy: 0.47368819745629726
Energy: 0.47436084294936387
Energy: 0.47368819745629726
Energy: 0.4857380866524717
Energy: 0.47328830485841467
Energy: 0.4755153731894938
Energy: 0.47328830485974505
Energy: 0.7591192511054804
Energy: 0.4744950576784311
Energy: 0.47455508550844644
Energy: 0.4744950576810919
Energy: 0.4724299041066452
Energy: 0.5257103778420972
Energy: 0.48223198632900416
Energy: 0.5257103778327843
Energy: 0.6185667146507209
Energy: 0.47321733374264763
Energy: 0.4743302783244606
Energy: 0.47321733374264763
Energy: 0.4740479510812432
Energy: 0.4801607948935329
Energy: 0.4797103212376992
Energy: 0.48016079488688085
Energy: 0.47954829466050586
Energy: 0.4794849870403976
Energy: 0.47456272068713673
Energy: 0.4794849870384019
Energy: 0.47585491715591177
Energy: 0.4811064545302995
Energy: 0.6904355690412318
Energy: 0.48110645453296025
Energy: 0.4801015242781831
Energy: 0.4738712958978491
Energy: 0.47278022218419863
Energy: 0.4738712958991795
Energy: 0.4740327583386039
Energy: 0.4740181809693199
Energy: 0.7598915215104873
Energy: 0.4740181809786329
Energy: 0.48435250923893947
Energy: 0.47349253054833446
Energy: 0.4863007080186863
Energy: 0.47349253054766927
Energy: 0.47564324694332233
Energy: 0.48088499340335206
Energy: 0.9406519790229309
Energy: 0.48088499340335206
Energy: 0.4793075318738307
Energy: 0.47695937351312834
Energy: 0.7580987092878652
Energy: 0.4769593735184499
Energy: 0.4739481109967117
Energy: 0.4740142913190007
Energy: 0.9979206691567037
Energy: 0.4740142913183355
Energy: 0.6122697670638297
Energy: 0.47341854455489984
Energy: 0.48619149351624014
Energy: 0.47341854455356946
Energy: 0.47550307634159833
Energy: 0.482775010382802
Energy: 0.9388453914346176
Energy: 0.4827750103808064
Energy: 0.638759848712495
Energy: 0.5276987919894689
Energy: 0.4727455100728599
Energy: 0.5276987919894689
Energy: 0.473877244770998
Energy: 0.4734580070257291
Energy: 0.7567783777428331
Energy: 0.4734580070263943
Energy: 0.6446597192279651
Energy: 0.4739423056105389
Energy: 0.47432009773034034
Energy: 0.473942305604552
Energy: 0.4755950068396432
Energy: 0.4864900650946088
Energy: 0.6894496127277719
Energy: 0.4864900650959392
Energy: 0.6411111571132979
Energy: 0.4791314679793047
Energy: 0.4776420528373673
Energy: 0.4791314679813004
Energy: 0.4741705754228027
Energy: 0.4734502220201396
Energy: 0.4785828741788256
Energy: 0.4734502220174787
Energy: 0.7598182937344297
Energy: 0.4747798843697033
Energy: 0.47446382311400687
Energy: 0.4747798843690381
Energy: 0.4874196529233714
Energy: 0.48688108998112595
Energy: 0.47701718507172725
Energy: 0.48688108998245644
Energy: 0.8806736073743076
Energy: 0.4805345377492627
Energy: 0.4774971578570291
Energy: 0.480534537747267
Energy: 0.7590819436331464
Energy: 0.4743494869825039
Energy: 0.47891654629165553
Energy: 0.4743494869844996
Energy: 0.9956820791616179
Energy: 0.47494877406467184
Energy: 0.47440121970999305
Energy: 0.47494877406533703
Energy: 0.4872896702118981
Energy: 0.5333922998569849
Energy: 0.4853951354123346
Energy: 0.5333922998543239
Energy: 0.7588370183114418
Energy: 0.4825936868125016
Energy: 0.47768479092223004
Energy: 0.4825936868144972
Energy: 0.47417035605655444
Energy: 0.5200202551549645
Energy: 0.6491308254782326
Energy: 0.5200202551542993
Energy: 0.7546121446175276
Energy: 0.47342648674604854
Energy: 0.4744960730796569
Energy: 0.4734264867866263
Energy: 0.47558297240377445
Energy: 0.4893181510427635
Energy: 0.6430001480922675
Energy: 0.4893181510427635
Energy: 0.4796220515475849
Energy: 0.48620908674189517
Energy: 0.4777152591898333
Energy: 0.48620908674256036
Energy: 0.4728931240946399
Energy: 0.6280857470428797
Energy: 0.6388099987803744
Energy: 0.6280857470428797
Energy: 0.47603281042097095
Energy: 0.4738584818350415
Energy: 0.4761757987498485
Energy: 0.4738584818317155
Energy: 0.4758133529650298
Energy: 0.5330108283438044
Energy: 0.9061593690844527
Energy: 0.5330108283398132

minimum gb energy = 0.4724299041066452 eV
minimum distance =  2.33407072615654 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.6889749325446308
Energy: 0.4455970992248987
Energy: 0.5829848144744003
Energy: 0.4455970992254757
Energy: 0.8923031330664738
Energy: 0.4434836857846363
Energy: 0.4268174971169651
Energy: 0.44348368578636715
Energy: 0.6711496542185807
Energy: 0.442932392480327
Energy: 0.4233719683030635
Energy: 0.442932392480327
Energy: 0.7876699366304917
Energy: 0.4439128788882672
Energy: 0.42677827578173666
Energy: 0.4439128788871133
Energy: 0.44175137576827067
Energy: 0.4260772509196578
Energy: 0.42835036583122116
Energy: 0.42607725092023485
Energy: 0.6826667111184738
Energy: 0.44351182942094547
Energy: 0.4268340379647813
Energy: 0.44351182941921463
Energy: 0.424770781650248
Energy: 0.4537196864611426
Energy: 0.4402165400652915
Energy: 0.4537196864605656
Energy: 0.561191389867554
Energy: 0.4426502895522865
Energy: 0.42675278898321695
Energy: 0.4426502895545943
Energy: 0.4263072586490262
Energy: 0.4337977417843615
Energy: 0.5612003297567768
Energy: 0.4337977417860924
Energy: 0.5392547183132226
Energy: 0.4532451619017857
Energy: 0.4251006746170958
Energy: 0.45324516190063185
Energy: 0.4278624867046611
Energy: 0.4434362743204851
Energy: 0.6825574475120967
Energy: 0.443436274322216
Energy: 0.4180612709685699
Energy: 0.4424767479720414
Energy: 0.4421458203917991
Energy: 0.44247674797031056
Energy: 0.4264024036320897
Energy: 0.4330999619886834
Energy: 0.8387297515395505
Energy: 0.4330999619886834
Energy: 0.42313484543676216
Energy: 0.44296120766406305
Energy: 0.671566092961403
Energy: 0.44296120766406305
Energy: 0.42783222098587187
Energy: 0.44329742015276996
Energy: 0.8930357370563884
Energy: 0.4432974201539238
Energy: 0.41869029591754514
Energy: 0.44584678041001025
Energy: 0.6894434312244342
Energy: 0.4458467804094333
Energy: 0.4264518266590432
Energy: 0.4330365194681044
Energy: 0.9445671823056903
Energy: 0.43303651946752747
Energy: 0.5383720035814011
Energy: 0.44307338463651047
Energy: 0.6715954359935717
Energy: 0.44307338463651047
Energy: 0.42783591084256006
Energy: 0.4433286472621112
Energy: 0.8778989665002148
Energy: 0.4433286472621112
Energy: 0.565742878877575
Energy: 0.44591241356710376
Energy: 0.4421536187175883
Energy: 0.4459124135665268
Energy: 0.4263948425186874
Energy: 0.4330242311234527
Energy: 0.770328385168312
Energy: 0.43302423112576044
Energy: 0.5634939707736534
Energy: 0.44299317043557357
Energy: 0.42514025088886004
Energy: 0.4429931704349966
Energy: 0.42780542769790114
Energy: 0.44358765299621056
Energy: 0.6615880304885817
Energy: 0.44358765299563363
Energy: 0.5600743523467636
Energy: 0.45489120337616606
Energy: 0.4267986015825643
Energy: 0.4548912033773199
Energy: 0.4265934493029846
Energy: 0.4424746567708339
Energy: 0.5394073388002254
Energy: 0.4424746567708339
Energy: 0.6830451810290055
Energy: 0.44317852216365833
Energy: 0.429228710951006
Energy: 0.44317852216019665
Energy: 0.44350833915688165
Energy: 0.4421626605898708
Energy: 0.4175620490656563
Energy: 0.4421626605898708
Energy: 0.8022758541750705
Energy: 0.45507618157668955
Energy: 0.4267929002651916
Energy: 0.45507618157495877
Energy: 0.6727519348400591
Energy: 0.443223912255116
Energy: 0.42194506666531983
Energy: 0.44322391225453905
Energy: 0.9902273232664276
Energy: 0.4431929748677957
Energy: 0.42924998091001987
Energy: 0.4431929748666417
Energy: 0.6906547958484132
Energy: 0.4423498648270385
Energy: 0.4181317934566221
Energy: 0.4423498648287692
Energy: 0.8842391421669549
Energy: 0.45308953294772125
Energy: 0.42679147294961267
Energy: 0.4530895329471443
Energy: 0.6728566662324145
Energy: 0.44332729471372945
Energy: 0.43029383268998295
Energy: 0.4433272947143064
Energy: 0.8776814584429894
Energy: 0.44299730590255987
Energy: 0.4295562487705064
Energy: 0.4429973059054445
Energy: 0.4435629537559481
Energy: 0.4424671577653258
Energy: 0.5644285681726412
Energy: 0.4424671577664797
Energy: 0.6650413757543656
Energy: 0.45373572771442877
Energy: 0.42685241964851944
Energy: 0.45373572771442877
Energy: 0.42646380134826706
Energy: 0.4433565313356358
Energy: 0.5634438250967352
Energy: 0.44335653133736663
Energy: 0.6615720077156014
Energy: 0.4428479981721343
Energy: 0.4291052517327806
Energy: 0.44284799816982656
Energy: 0.42797049927055636
Energy: 0.4425653877138518
Energy: 0.5600653884019017
Energy: 0.4425653877126978
Energy: 0.41636165916376344
Energy: 0.4662331629572665
Energy: 0.4283712769777334
Energy: 0.4662331629566896
Energy: 0.4295515280275137
Energy: 0.44367442960590703
Energy: 0.8020417551410195
Energy: 0.44367442960590703
Energy: 0.41662018838282133
Energy: 0.44220760421695415
Energy: 0.4456905049751085
Energy: 0.44220760421695415
Energy: 0.4279288813955502
Energy: 0.4433014577714972
Energy: 0.8011117428230996
Energy: 0.44330145777207414

minimum gb energy = 0.41636165916376344 eV
minimum distance =  2.34582258007735 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.015605407412543869
Energy: 0.0170495524589107
Energy: 0.8559771913010014
Energy: 0.017049552460216617
Energy: 0.5818191793361981
Energy: 0.21548300111374305
Energy: 0.21555598185862335
Energy: 0.21548300111504895
Energy: 0.015605407412543869
Energy: 0.0170495524589107
Energy: 0.8559771912927717
Energy: 0.017049552459773097
Energy: 0.5818191793357546
Energy: 0.21548300111329952
Energy: 0.2155559818568739
Energy: 0.21548300111460544
Energy: 0.015605407412543869
Energy: 0.017049552459329577
Energy: 1.425772305475062
Energy: 0.017049552459773097
Energy: 0.5818191793353358
Energy: 0.21548300111374305
Energy: 0.21555598189329175
Energy: 0.21548300111460544

minimum gb energy = 0.015605407412543869 eV
minimum distance =  2.5457593034423 Angstroms
sigma value = 1