Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8667457550764093
cohesive_energy=4.280654192612446
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01317335595051254
Energy: 0.013641521495509772
Energy: 0.01354267992162465
Energy: 0.013641521495980753
Energy: 0.01317335595098352
Energy: 0.013641521495509772
Energy: 0.013641521495980753
Energy: 2.7052368850456583
Energy: 0.013641521495980753
Energy: 2.7052368850451596
Energy: 0.013641521495980753
Energy: 2.7052368850456583
Energy: 0.01354267992209563
Energy: 0.013641521495509772
Energy: 0.01317335595098352
Energy: 0.013641521495011088
Energy: 0.01354267992162465
Energy: 0.013641521496479438
Energy: 0.013641521495980753
Energy: 2.7052368850456583
Energy: 0.013641521495509772
Energy: 2.70523688504419
Energy: 0.013641521495980753
Energy: 2.705236885046628
Energy: 0.01317335595098352
Energy: 0.013641521495509772
Energy: 0.013542679922594314
Energy: 0.013641521495011088
Energy: 0.01317335595098352
Energy: 0.013641521495980753
Energy: 0.013641521495509772
Energy: 2.70523688504419
Energy: 0.013641521495509772
Energy: 2.705236885046628
Energy: 0.013641521495011088
Energy: 2.705236885046628

minimum gb energy = 0.01317335595051254 eV
minimum distance =  2.40433545847764 Angstroms
sigma value = 1


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

Energy: 1.826434984041188
Energy: 1.8115914206901507
Energy: 1.5813465940981006
Energy: 1.811591420691351
Energy: 1.8264349840423886
Energy: 1.811591420691351
Energy: 1.7096245562156893
Energy: 1.7456612272401926
Energy: 1.5517078714069572
Energy: 1.7456612272401926
Energy: 1.7096245562144892
Energy: 1.7456612272389922
Energy: 1.5815248202161545
Energy: 1.7442339472240014
Energy: 1.826241667779516
Energy: 1.7442339472240014
Energy: 1.5815248202161545
Energy: 1.7442339472240014
Energy: 1.8947371847078296
Energy: 1.6433255915625258
Energy: 1.5509901485335873
Energy: 1.643325591563726
Energy: 1.894737184706629
Energy: 1.6433255915625258
Energy: 1.8596070264885352
Energy: 1.8119640590925836
Energy: 1.7000464345641288
Energy: 1.8119640590913833
Energy: 1.8596070264897353
Energy: 1.8119640590913833
Energy: 1.8272145351553275
Energy: 1.7449586907128598
Energy: 1.581235225209614
Energy: 1.7449586907128598
Energy: 1.8272145351553275
Energy: 1.7449586907128598
Energy: 1.826231348378624
Energy: 1.7440148569337077
Energy: 1.580047021076329
Energy: 1.7440148569337077
Energy: 1.826231348378624
Energy: 1.7440148569337077
Energy: 1.8824844379895607
Energy: 1.8131330723012855
Energy: 1.5575072820840576
Energy: 1.813133072300085
Energy: 1.88248443798836
Energy: 1.813133072300085
Energy: 1.7381315529030794
Energy: 1.6436442003091882
Energy: 1.5523025621909166
Energy: 1.6436442003103886
Energy: 1.7381315529102819
Energy: 1.6436442003103886
Energy: 1.8301419036756672
Energy: 1.7433549051830581
Energy: 1.5794821095007714
Energy: 1.7433549051830581
Energy: 1.8301419036768676
Energy: 1.7433549051830581
Energy: 1.7034601763767832
Energy: 1.6639453199164635
Energy: 1.5535432851112194
Energy: 1.663945319917664
Energy: 1.7034595584230772
Energy: 1.663945319917664
Energy: 1.5574591220518046
Energy: 1.8131434105040587
Energy: 1.557471456956644
Energy: 1.8131434105040587
Energy: 1.5574591220530052
Energy: 1.8131434105040587
Energy: 1.5534028633815193
Energy: 1.6639453199188643
Energy: 1.6828147180905362
Energy: 1.6639453199188643
Energy: 1.5534028460327147
Energy: 1.6639453199188643
Energy: 1.5797370822442804
Energy: 1.7437439407449749
Energy: 1.8301405959038264
Energy: 1.7437439407437745
Energy: 1.5797370822442804
Energy: 1.7437439407437745
Energy: 1.5521766995594422
Energy: 1.6435785238305618
Energy: 1.7381161722431417
Energy: 1.6435785238305618
Energy: 1.5521766995582418
Energy: 1.6435785238305618
Energy: 1.5573797992776919
Energy: 1.8131401003127292
Energy: 1.88239350339019
Energy: 1.8131401003127292
Energy: 1.5573797992776919
Energy: 1.8131401003127292
Energy: 1.579985033757972
Energy: 1.7439991658792509
Energy: 1.826302109275991
Energy: 1.743999165878051
Energy: 1.5799850380942322
Energy: 1.743999165878051
Energy: 1.5812818179136705
Energy: 1.744823460622682
Energy: 1.827429296717405
Energy: 1.744823460622682
Energy: 1.5812818179220731
Energy: 1.744823460622682
Energy: 1.6999712846310742
Energy: 1.812054399851928
Energy: 1.8595760951387303
Energy: 1.812054399851928
Energy: 1.6999712846322743
Energy: 1.812054399851928
Energy: 1.5509087516939741
Energy: 1.6433283480634644
Energy: 1.8947323293533618
Energy: 1.6433283480634644
Energy: 1.5509087516255518
Energy: 1.643328348062264
Energy: 1.8262208401315723
Energy: 1.744353201513479
Energy: 1.5815213686824054
Energy: 1.7443532015146797
Energy: 1.8262208401315723
Energy: 1.7443532015146797
Energy: 1.5517708885265904
Energy: 1.7458025498135965
Energy: 1.7096666447490236
Energy: 1.7458025498147969
Energy: 1.5517708885313921
Energy: 1.7458025498135965
Energy: 1.5812853353162075
Energy: 1.8115914206889503
Energy: 1.8264349840423886
Energy: 1.8115914206901507
Energy: 1.581339354069999
Energy: 1.8115914206901507

minimum gb energy = 1.5509087516255518 eV
minimum distance =  2.29786823481426 Angstroms
sigma value = 33


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

Energy: 2.3682710621350394
Energy: 1.888728563136599
Energy: 1.6694182076292305
Energy: 1.8887285631352337
Energy: 2.3682710621364045
Energy: 1.8887285631359163
Energy: 1.7219156563924811
Energy: 1.822881409688373
Energy: 1.7871942454879428
Energy: 1.8228814096876904
Energy: 1.721915656398626
Energy: 1.8228814096876904
Energy: 1.6503014164095056
Energy: 1.876520446109527
Energy: 1.9638433554492882
Energy: 1.876520446109527
Energy: 1.6503014164081402
Energy: 1.8765204461088445
Energy: 1.7868843758558197
Energy: 1.7518852818515072
Energy: 1.7870828927222273
Energy: 1.7518852818508246
Energy: 1.7868843758605992
Energy: 1.7518852818508246
Energy: 1.7867773154792843
Energy: 1.842708857478934
Energy: 1.9324727775340036
Energy: 1.842708857478934
Energy: 1.7867773154813325
Energy: 1.842708857478934
Energy: 1.772141478474906
Energy: 1.842678705488233
Energy: 1.6696908061937805
Energy: 1.84267870548755
Energy: 1.7721417479938621
Energy: 1.842678705488233
Energy: 1.7721882746796143
Energy: 1.8428248650344385
Energy: 1.790478028486518
Energy: 1.842824865033756
Energy: 1.7721882429062341
Energy: 1.842824865033756
Energy: 1.6709348174790273
Energy: 1.8429793968718464
Energy: 1.8667914425763568
Energy: 1.8429793968725297
Energy: 1.6709348174797098
Energy: 1.8429793968725297
Energy: 1.7882193572563683
Energy: 1.751684331556193
Energy: 1.7719270459336514
Energy: 1.7516843315555102
Energy: 1.7882193572556857
Energy: 1.7516843315555102
Energy: 1.7709622350045067
Energy: 1.8765355673104318
Energy: 1.7882541503258937
Energy: 1.8765355673104318
Energy: 1.7709622350038237
Energy: 1.8765355673104318
Energy: 1.7230493462443202
Energy: 1.81019907117683
Energy: 1.7871680811646369
Energy: 1.8101990711761473
Energy: 1.7230493462395406
Energy: 1.8101990711761473
Energy: 1.9698449841679304
Energy: 1.8435013477899032
Energy: 1.7727264535505027
Energy: 1.8435013477885378
Energy: 1.9698449841679304
Energy: 1.8435013477892204
Energy: 1.7872940244079594
Energy: 1.772298512751244
Energy: 1.7208926110415395
Energy: 1.772298512751244
Energy: 1.7872939312628457
Energy: 1.772298512751244
Energy: 1.83580866876287
Energy: 1.876300056954041
Energy: 1.776607181053062
Energy: 1.8763000569554065
Energy: 1.835808668760822
Energy: 1.8763000569554065
Energy: 2.002096002123747
Energy: 1.8422031224422233
Energy: 1.8783448864283019
Energy: 1.8422031224415405
Energy: 2.002096002123747
Energy: 1.8422031224415405
Energy: 1.9896530315286485
Energy: 1.842648492267785
Energy: 1.7737830728388393
Energy: 1.8426484922671023
Energy: 1.9896530315286485
Energy: 1.8426484922671023
Energy: 2.0211052032346
Energy: 1.8427119792723552
Energy: 1.7876073438338613
Energy: 1.842711979273038
Energy: 2.0211052032352828
Energy: 1.8427119792737208
Energy: 2.022088926851379
Energy: 1.8218903999339675
Energy: 1.8863831680380305
Energy: 1.821890399933285
Energy: 2.0220889268506963
Energy: 1.821890399933285
Energy: 1.6714942686683456
Energy: 1.8432086269364207
Energy: 1.8665748006428233
Energy: 1.8432086269371033
Energy: 1.6714942686669798
Energy: 1.8432086269371033
Energy: 1.7877331189572505
Energy: 1.7519172803390795
Energy: 1.773272925615273
Energy: 1.7519172803397625
Energy: 1.7877331189572505
Energy: 1.7519172803390795
Energy: 1.9593756946242027
Energy: 1.876477309137764
Energy: 1.6699580733862944
Energy: 1.8764773091391298
Energy: 1.9593756946235197
Energy: 1.8764773091384468
Energy: 1.7197268743432172
Energy: 1.813000194942461
Energy: 1.7871797089532997
Energy: 1.8130001949417782
Energy: 1.7196967044770899
Energy: 1.813000194942461
Energy: 1.7839127716150274
Energy: 1.8433901349326178
Energy: 1.9327211735635406
Energy: 1.843390134931935
Energy: 1.783912771612979
Energy: 1.843390134931935
Energy: 2.0405677316781135
Energy: 1.8220495663496072
Energy: 1.7865438135442149
Energy: 1.82204956635029
Energy: 2.0405677316787965
Energy: 1.82204956635029
Energy: 1.8128357359195209
Energy: 1.8452104367338018
Energy: 1.9637991094063805
Energy: 1.8452104367338018
Energy: 1.8128357359413698
Energy: 1.845210436733119
Energy: 1.7760261540336952
Energy: 1.8760649018841897
Energy: 1.7666340903489617
Energy: 1.876064901883507
Energy: 1.7760401440403
Energy: 1.876064901883507
Energy: 1.7760095600950385
Energy: 1.8760503908632313
Energy: 1.7047679702883398
Energy: 1.8760503908639143
Energy: 1.7760135064555225
Energy: 1.8760503908639143
Energy: 1.812827718460934
Energy: 1.8452183554687154
Energy: 1.9639053814629002
Energy: 1.8452183554687154
Energy: 1.8128277184725412
Energy: 1.8452183554680321
Energy: 2.040825314992162
Energy: 1.8220476519115116
Energy: 1.7871170627491642
Energy: 1.822047651910146
Energy: 2.040825314990796
Energy: 1.822047651910146
Energy: 1.7838954873510984
Energy: 1.8434012976727199
Energy: 1.8764514497938365
Energy: 1.8434012976740854
Energy: 1.783895487352464
Energy: 1.8434012976734027
Energy: 1.7202522382852758
Energy: 1.8130001949465577
Energy: 1.788050444762007
Energy: 1.8130001949472403
Energy: 1.7200613963211915
Energy: 1.8130001949472403
Energy: 1.959341636019125
Energy: 1.8765105784598266
Energy: 1.6699629984375628
Energy: 1.8765105784598266
Energy: 1.9593416360184424
Energy: 1.8765105784598266
Energy: 1.7878990317096295
Energy: 1.7519382906005927
Energy: 1.773025172170355
Energy: 1.7519382906005927
Energy: 1.7878990317068986
Energy: 1.7519382906005927
Energy: 1.6714670204743391
Energy: 1.8432226970630572
Energy: 1.7725242255305491
Energy: 1.8432226970623744
Energy: 1.6714670204757047
Energy: 1.8432226970623744
Energy: 2.022085470605454
Energy: 1.821835883849648
Energy: 1.815493144529822
Energy: 1.8218358838489654
Energy: 2.022085470605454
Energy: 1.8218358838489654
Energy: 2.0211184902785155
Energy: 1.8427094268542776
Energy: 1.787981420418729
Energy: 1.8427094268535948
Energy: 2.0211184902778325
Energy: 1.8427094268535948
Energy: 1.9895167216092988
Energy: 1.8419432584901103
Energy: 1.727690570688332
Energy: 1.841943258490793
Energy: 1.9895167216092988
Energy: 1.841943258490793
Energy: 2.0021949949444893
Energy: 1.8422791937150378
Energy: 1.878212261199656
Energy: 1.8422791937143548
Energy: 2.002194994945172
Energy: 1.8422791937143548
Energy: 1.835799511523033
Energy: 1.8763215926940158
Energy: 1.7762625089919286
Energy: 1.876321592693333
Energy: 1.835799511523033
Energy: 1.8763215926940158
Energy: 1.7867752560804049
Energy: 1.772177437977064
Energy: 1.7209543042644406
Energy: 1.7721774379784296
Energy: 1.7868030653938283
Energy: 1.7721774379784296
Energy: 1.9698505443272842
Energy: 1.8434928553582084
Energy: 1.728185302532945
Energy: 1.8434928553588912
Energy: 1.9698505443272842
Energy: 1.8434928553588912

minimum gb energy = 1.6503014164081402 eV
minimum distance =  2.28917816687178 Angstroms
sigma value = 51


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

Energy: 2.0670912899462373
Energy: 1.911615609497677
Energy: 1.8313561812733625
Energy: 1.9116156095008408
Energy: 2.0670912899462373
Energy: 1.9116156095008408
Energy: 1.7998060373215605
Energy: 1.9870134491512486
Energy: 2.269195853407967
Energy: 1.9870134491528306
Energy: 1.7998060373231426
Energy: 1.9870134491528306
Energy: 1.6981959830232929
Energy: 1.911695896793268
Energy: 1.8940852406112025
Energy: 1.911695896793268
Energy: 1.6981959830232929
Energy: 1.9116958967916862
Energy: 1.7067739132706676
Energy: 1.8288495914594998
Energy: 2.1711600322177294
Energy: 1.8288495914610816
Energy: 1.7067739132690856
Energy: 1.8288495914610816
Energy: 1.6987437198694488
Energy: 1.833524616563678
Energy: 1.893701928860572
Energy: 1.8335246165652601
Energy: 1.6987437262088103
Energy: 1.8335246165652601
Energy: 2.0670067837377
Energy: 1.82876968642777
Energy: 2.2359097690048526
Energy: 1.8287696864293521
Energy: 2.067006783739281
Energy: 1.8287696864293521
Energy: 2.067998661466717
Energy: 1.8317955427389683
Energy: 1.8946858997589102
Energy: 1.8317955427373862
Energy: 2.067998661466717
Energy: 1.8317955427373862
Energy: 1.7053612680468946
Energy: 1.8294102931980465
Energy: 1.6830235726572778
Energy: 1.8294102931964646
Energy: 1.7053612680484764
Energy: 1.8294102931964646
Energy: 2.0678881358111436
Energy: 1.8230657601589428
Energy: 1.68361676857951
Energy: 1.8230657601573608
Energy: 2.06788813580798
Energy: 1.8230657601573608
Energy: 1.703693834484394
Energy: 1.910873136474152
Energy: 1.6831781941347346
Energy: 1.9108731364725697
Energy: 1.703693834484394
Energy: 1.9108731364725697
Energy: 2.167591647776279
Energy: 1.8316892613412041
Energy: 2.2813535386644554
Energy: 1.831689261342786
Energy: 2.167591647776279
Energy: 1.831689261342786
Energy: 2.0673549540914014
Energy: 1.9107828904708297
Energy: 2.235289810646526
Energy: 1.9107828904724118
Energy: 2.0673549540914014
Energy: 1.9107828904724118
Energy: 1.889921258380662
Energy: 1.829936554080632
Energy: 2.1711166545871596
Energy: 1.829936554080632
Energy: 1.8899166500184863
Energy: 1.829936554080632
Energy: 1.7034592720736468
Energy: 1.9109029232291617
Energy: 2.1712274175530717
Energy: 1.9109029232291617
Energy: 1.7034592720736468
Energy: 1.9109029232291617
Energy: 1.705826273110181
Energy: 1.9117817185138113
Energy: 2.171064208536526
Energy: 1.9117817185138113
Energy: 1.7058262751263205
Energy: 1.9117817185138113
Energy: 1.6981170417095373
Energy: 1.8336047482968427
Energy: 2.1710541646337247
Energy: 1.8336047482968427
Energy: 1.6981170094891982
Energy: 1.8336047482968427
Energy: 2.067212610819115
Energy: 1.9122931568582386
Energy: 2.2300876152227045
Energy: 1.9122931568566566
Energy: 2.067212610819115
Energy: 1.9122931568566566
Energy: 2.0672590541288205
Energy: 1.8442872628082192
Energy: 2.171128717082425
Energy: 1.8442872628098015
Energy: 2.0672590541256564
Energy: 1.8442872628098015

minimum gb energy = 1.6830235726572778 eV
minimum distance =  2.28514239513274 Angstroms
sigma value = 19


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

Energy: 2.186502858169897
Energy: 1.9776064931407356
Energy: 1.8194151007426695
Energy: 1.9776064931407356
Energy: 2.186502858169897
Energy: 1.9776064931407356
Energy: 1.8056718306001815
Energy: 1.9100919627954256
Energy: 1.7964654641782447
Energy: 1.910091962794487
Energy: 1.805671830599243
Energy: 1.910091962794487
Energy: 1.7954033800975737
Energy: 1.9675788928150284
Energy: 1.9846140017237328
Energy: 1.9675788928159454
Energy: 1.7954033800975737
Energy: 1.9675788928159454
Energy: 1.868483050098596
Energy: 1.9145844751469894
Energy: 1.798331895601992
Energy: 1.9145844751469894
Energy: 1.868483050098596
Energy: 1.9145844751469894
Energy: 1.8286719029361576
Energy: 1.9752530160776507
Energy: 1.922032684232795
Energy: 1.9752530160776507
Energy: 1.8286719029398897
Energy: 1.9752530160776507
Energy: 2.064670103010541
Energy: 1.9752355785736733
Energy: 1.8286576972245805
Energy: 1.9752355785727351
Energy: 2.064670103010541
Energy: 1.9752355785727351
Energy: 1.7981943261038948
Energy: 1.9148028288581382
Energy: 1.9264350175696865
Energy: 1.9148028288581382
Energy: 1.7981943261198474
Energy: 1.9148028288581382
Energy: 1.9845204541883248
Energy: 1.9676632174563282
Energy: 1.7953746987056638
Energy: 1.9676632174563282
Energy: 1.9845204541873867
Energy: 1.9676632174563282
Energy: 1.7972558528797915
Energy: 1.9099411152520112
Energy: 1.7980830133924568
Energy: 1.9099411152520112
Energy: 1.7972559310974936
Energy: 1.9099411152520112
Energy: 1.8194151007361006
Energy: 1.9776064931407356
Energy: 2.186502858169897
Energy: 1.9776064931407356
Energy: 1.819415100752032
Energy: 1.9776064931407356
Energy: 1.7964654656414738
Energy: 1.910091962794487
Energy: 1.805671830599243
Energy: 1.9100919627954256
Energy: 1.796465464830128
Energy: 1.9100919627954256
Energy: 1.9846140017227942
Energy: 1.9675788928159454
Energy: 1.7954033800975737
Energy: 1.9675788928159454
Energy: 1.9846140017237328
Energy: 1.9675788928159454
Energy: 1.7983318960681591
Energy: 1.914584475146051
Energy: 1.8277817523998636
Energy: 1.914584475146051
Energy: 1.7983318961281949
Energy: 1.914584475146051
Energy: 1.7893630083503367
Energy: 1.9752530160776507
Energy: 1.828671902938013
Energy: 1.9752530160776507
Energy: 1.7893619553969482
Energy: 1.9752530160776507
Energy: 1.8286576972227035
Energy: 1.9752355785736733
Energy: 2.064670103010541
Energy: 1.9752355785727351
Energy: 1.8286576972292723
Energy: 1.9752355785727351
Energy: 1.9264350175706246
Energy: 1.9148028288581382
Energy: 1.7981943261667455
Energy: 1.9148028288581382
Energy: 1.9264350175706246
Energy: 1.9148028288581382
Energy: 1.7953746987075405
Energy: 1.9676632174563282
Energy: 1.9845204541883248
Energy: 1.9676632174563282
Energy: 1.7953746987056638
Energy: 1.9676632174563282
Energy: 1.7980830121271432
Energy: 1.9099411152510728
Energy: 1.7972557611665099
Energy: 1.9099411152520112
Energy: 1.7980830115362127
Energy: 1.9099411152520112
Energy: 2.186502858169897
Energy: 1.9776064931407356
Energy: 1.8771523536043808
Energy: 1.9776064931397974
Energy: 2.186502858169897
Energy: 1.9776064931407356
Energy: 1.8056718306001815
Energy: 1.910091962794487
Energy: 1.796465465982899
Energy: 1.9100919627954256
Energy: 1.8056718306001815
Energy: 1.9100919627954256
Energy: 1.7954033800975737
Energy: 1.9675788928159454
Energy: 1.9846140017227942
Energy: 1.9675788928150284
Energy: 1.7954033800985123
Energy: 1.9675788928159454
Energy: 1.8277817523998636
Energy: 1.9145844751469894
Energy: 1.7983318948150444
Energy: 1.9145844751469894
Energy: 1.8277817523998636
Energy: 1.9145844751469894
Energy: 1.828671902938013
Energy: 1.9752530160776507
Energy: 1.7893638681766486
Energy: 1.9752530160776507
Energy: 1.8286719029361576
Energy: 1.9752530160776507
Energy: 2.0646701030114794
Energy: 1.9752355785727351
Energy: 1.8286576972273956
Energy: 1.9752355785727351
Energy: 2.064670103010541
Energy: 1.9752355785727351
Energy: 1.7981943261385938
Energy: 1.9148028288581382
Energy: 1.9264350175706246
Energy: 1.9148028288590764
Energy: 1.798194326118909
Energy: 1.9148028288590764
Energy: 1.9845204541873867
Energy: 1.9676632174563282
Energy: 1.7953746987066024
Energy: 1.9676632174563282
Energy: 1.9845204541873867
Energy: 1.9676632174563282
Energy: 1.797255793063259
Energy: 1.9099411152520112
Energy: 1.7980830126674003
Energy: 1.9099411152520112
Energy: 1.7972557936823201
Energy: 1.9099411152520112
Energy: 1.8488228726759393
Energy: 1.9776064931397974
Energy: 2.186502858169897
Energy: 1.9776064931407356
Energy: 1.848913720723264
Energy: 1.9776064931407356
Energy: 1.796465465020536
Energy: 1.910091962796364
Energy: 1.8056718306001815
Energy: 1.9100919627954256
Energy: 1.7964654643367475
Energy: 1.9100919627954256
Energy: 1.9846140017246714
Energy: 1.9675788928159454
Energy: 1.7954033800975737
Energy: 1.9675788928159454
Energy: 1.9846140017237328
Energy: 1.9675788928159454

minimum gb energy = 1.7893619553969482 eV
minimum distance =  2.26828598468952 Angstroms
sigma value = 27


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

Energy: 1.6921764408283022
Energy: 1.831146401001221
Energy: 1.786388720239985
Energy: 1.83114640100143
Energy: 1.692176440828067
Energy: 1.8311464010016651
Energy: 1.7205161763508694
Energy: 1.868444963570015
Energy: 1.7894589875763018
Energy: 1.8684449635698064
Energy: 1.7205161763511045
Energy: 1.868444963570015
Energy: 1.787191506974579
Energy: 1.8944270891555965
Energy: 1.7893746301977234
Energy: 1.8944270891528279
Energy: 1.787191506974579
Energy: 1.894427089149615
Energy: 1.6901365279856988
Energy: 1.831494382329061
Energy: 1.7874256182540704
Energy: 1.8314943823302103
Energy: 1.690136527985934
Energy: 1.8314943823299752
Energy: 1.7905616151081143
Energy: 1.8315728570077638
Energy: 1.7372092411276392
Energy: 1.8315728570075285
Energy: 1.7905616151078791
Energy: 1.8315728570075285
Energy: 1.7822278097912225
Energy: 1.9841864565224259
Energy: 1.7868605882094735
Energy: 1.984186456519448
Energy: 1.7822278097919015
Energy: 1.984186456527937
Energy: 1.7816113283385633
Energy: 1.8504472447563491
Energy: 1.7867786057247632
Energy: 1.8504472447567932
Energy: 1.7816113283387984
Energy: 1.8504472447565838
Energy: 1.6904740431286092
Energy: 1.843065711269994
Energy: 1.7902166894475382
Energy: 1.8430657112697588
Energy: 1.6904740431290792
Energy: 1.8430657112706732
Energy: 1.78041287285629
Energy: 1.83213413169123
Energy: 1.7248793255530026
Energy: 1.8321341316917004
Energy: 1.78041287285629
Energy: 1.8321341316919355
Energy: 1.7820739663932987
Energy: 2.034094284156776
Energy: 1.7820770409984559
Energy: 2.0340942841570113
Energy: 1.7820739663935337
Energy: 2.0340942841570113
Energy: 1.7240739367465088
Energy: 1.8321322748675717
Energy: 1.7804271874395041
Energy: 1.832132274866893
Energy: 1.7240739367462738
Energy: 1.832132274867337
Energy: 1.790226286295377
Energy: 1.8431032184652707
Energy: 1.6903882339330012
Energy: 1.843103218465741
Energy: 1.790226286295377
Energy: 1.843103218465741

minimum gb energy = 1.6901365279856988 eV
minimum distance =  2.27913296112154 Angstroms
sigma value = 9


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

Energy: 2.1085434028959287
Energy: 2.0714125957640563
Energy: 1.8356293557676686
Energy: 2.071412595764702
Energy: 2.1085434028946373
Energy: 2.071412595764702
Energy: 1.8532401212837346
Energy: 1.9971963512095492
Energy: 1.8392637978680957
Energy: 1.9971963512101951
Energy: 1.8532401212850265
Energy: 1.9971963512101951
Energy: 1.7978966865509989
Energy: 2.070810958621423
Energy: 1.8353374612745224
Energy: 2.0708109586207772
Energy: 1.7978966865497072
Energy: 2.070810958621423
Energy: 1.7907924201175855
Energy: 2.0324877594383004
Energy: 1.7332410137687848
Energy: 2.0324877594408837
Energy: 1.7907924201188772
Energy: 2.0324877594383004
Energy: 1.7895353911714718
Energy: 2.03232927673823
Energy: 1.748923316082109
Energy: 2.0323292767388756
Energy: 1.7895353911714718
Energy: 2.0323292767388756
Energy: 1.7569808930204962
Energy: 2.0222340750529337
Energy: 1.817974552475998
Energy: 2.0222340750529337
Energy: 1.7569808930211421
Energy: 2.0222340750529337
Energy: 1.864385931633112
Energy: 2.0465033346371833
Energy: 1.799259366378836
Energy: 2.0465033346365376
Energy: 1.864385931633112
Energy: 2.0465033346365376
Energy: 1.9437016015478608
Energy: 2.0517497346059637
Energy: 1.8639144962586724
Energy: 2.0517497346059637
Energy: 1.9437016015465691
Energy: 2.0517497346059637
Energy: 1.8561678390039396
Energy: 2.004758566337128
Energy: 1.8481059797594135
Energy: 2.004758566337128
Energy: 1.8561678390039396
Energy: 2.004758566337128
Energy: 1.9299469609456148
Energy: 2.0674539294635776
Energy: 1.7912328099428012
Energy: 2.0674539294635776
Energy: 1.9299469609456148
Energy: 2.067453929462932
Energy: 1.8319838579767487
Energy: 1.9999796200974598
Energy: 1.8390030215456423
Energy: 1.999979620096814
Energy: 1.8319838579773946
Energy: 1.999979620096814
Energy: 1.8252766319452254
Energy: 2.032181476447927
Energy: 1.8090077350241414
Energy: 2.032181476447281
Energy: 1.8252766319445795
Energy: 2.032181476447927
Energy: 1.7525105321261587
Energy: 1.9920312107557767
Energy: 1.7341797887072914
Energy: 1.9920312107551308
Energy: 1.752510532135846
Energy: 1.9920312107557767
Energy: 1.9568136705553258
Energy: 2.062184114920872
Energy: 1.7355259176484161
Energy: 2.0621841149202265
Energy: 1.9568136705553258
Energy: 2.062184114920872
Energy: 1.8285083741155377
Energy: 2.01957703784658
Energy: 1.842569877703681
Energy: 2.01957703784658
Energy: 1.828508374114246
Energy: 2.019577037847226
Energy: 1.8644221987517051
Energy: 1.9991178841949577
Energy: 1.8092339141423148
Energy: 1.999117884193666
Energy: 1.864422198752351
Energy: 1.999117884193666
Energy: 1.925642256476985
Energy: 2.067856829747886
Energy: 1.7912729780409877
Energy: 2.067856829747886
Energy: 1.9256422564782767
Energy: 2.067856829747886
Energy: 1.7329914421076678
Energy: 1.9919869589855828
Energy: 1.8358556095421046
Energy: 1.9919869589855828
Energy: 1.7329914421044383
Energy: 1.9919869589855828
Energy: 1.940035361880132
Energy: 2.0705102840022045
Energy: 1.752045522147377
Energy: 2.070510284000913
Energy: 1.940035361880778
Energy: 2.070510284000267
Energy: 1.7534412854883952
Energy: 2.0814128898328588
Energy: 1.753168450246866
Energy: 2.081412889832213
Energy: 1.753441285485166
Energy: 2.081412889832213
Energy: 1.7518546685324579
Energy: 2.0706157543038386
Energy: 1.940043272903832
Energy: 2.070615754302547
Energy: 1.7518546685266454
Energy: 2.070615754301901
Energy: 1.8358033763552304
Energy: 1.991790243439683
Energy: 1.7331196662406507
Energy: 1.9917902434383914
Energy: 1.8358033763552304
Energy: 1.9917902434383914
Energy: 1.7913281587041625
Energy: 2.0679092655871645
Energy: 1.9256450704130919
Energy: 2.0679092655865188
Energy: 1.791328158771301
Energy: 2.0679092655871645
Energy: 1.8092319033086095
Energy: 1.9994355967637312
Energy: 1.8645570083781913
Energy: 1.9994355967637312
Energy: 1.8092319033079638
Energy: 1.9994355967637312
Energy: 1.8426678002986228
Energy: 2.02664669843551
Energy: 1.8285388845020454
Energy: 2.02664669843551
Energy: 1.8426678002999144
Energy: 2.0266466984361555
Energy: 1.735512105317233
Energy: 2.0619791567847163
Energy: 1.9563683902541287
Energy: 2.061979156783425
Energy: 1.735512105317233
Energy: 2.0619791567840706
Energy: 1.7342633994889574
Energy: 1.9920590728132281
Energy: 1.7523059026553929
Energy: 1.9920590728132281
Energy: 1.73426339948702
Energy: 1.9920590728125822
Energy: 1.8089771740394254
Energy: 2.0321502073572892
Energy: 1.8253086698623242
Energy: 2.032150207357935
Energy: 1.808977174040717
Energy: 2.032150207357935
Energy: 1.8391693868874555
Energy: 1.999964466892414
Energy: 1.796914906679936
Energy: 1.999964466891768
Energy: 1.8391693868881014
Energy: 1.999964466891768
Energy: 1.791065087365461
Energy: 2.0673758743929387
Energy: 1.9298158614477874
Energy: 2.0673758743929387
Energy: 1.7910650873667526
Energy: 2.0673758743929387
Energy: 1.8389713705978674
Energy: 2.004758566337128
Energy: 1.8564880306525047
Energy: 2.0047585663364824
Energy: 1.8389713705985133
Energy: 2.0047585663364824
Energy: 1.8639176120811118
Energy: 2.0518488574740483
Energy: 1.9437048508033425
Energy: 2.0518488574740483
Energy: 1.863917612080466
Energy: 2.0518488574740483
Energy: 1.8084499433798578
Energy: 2.0464700624640972
Energy: 1.8193863783591473
Energy: 2.0464700624634515
Energy: 1.8084499433798578
Energy: 2.0464700624640972
Energy: 1.8178108377007423
Energy: 1.9905880647735228
Energy: 1.7542707233570005
Energy: 1.9905880647735228
Energy: 1.8178108377013882
Energy: 1.9905880647735228
Energy: 1.7633678219390874
Energy: 2.0322642897590497
Energy: 1.7895802281261446
Energy: 2.032264289757758
Energy: 1.7633678219403794
Energy: 2.032264289757758
Energy: 1.733415308093754
Energy: 2.0326121000288624
Energy: 1.7911911863615406
Energy: 2.0326121000282162
Energy: 1.7334153080924621
Energy: 2.0326121000282162
Energy: 1.8418761167434141
Energy: 2.070813582850504
Energy: 1.797883988164367
Energy: 2.070813582850504
Energy: 1.8418761167447057
Energy: 2.070813582850504
Energy: 1.8393624374847632
Energy: 1.9899547834075657
Energy: 1.8534233233132325
Energy: 1.989954783406274
Energy: 1.8393624374847632
Energy: 1.989954783406274
Energy: 1.8567594332443742
Energy: 2.071412595765348
Energy: 2.1085434028939916
Energy: 2.071412595765348
Energy: 1.85675943324822
Energy: 2.071412595765348
Energy: 1.8392637978661581
Energy: 1.9971963512089035
Energy: 1.8532401212856722
Energy: 1.9971963512089035
Energy: 1.839263797866804
Energy: 1.9971963512089035
Energy: 1.8353374612745224
Energy: 2.070810958621423
Energy: 1.7978966865477697
Energy: 2.070810958621423
Energy: 1.8353374612751683
Energy: 2.070810958621423
Energy: 1.7332410137662015
Energy: 2.0324877594376547
Energy: 1.7907924201169396
Energy: 2.032487759436363
Energy: 1.7332410137655556
Energy: 2.0324877594370085
Energy: 1.733959216261142
Energy: 2.032329276737584
Energy: 1.7895353911721177
Energy: 2.032329276737584
Energy: 1.7339592162585586
Energy: 2.032329276737584

minimum gb energy = 1.7329914421044383 eV
minimum distance =  2.2553217145454 Angstroms
sigma value = 57


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

Energy: 1.7683884904819465
Energy: 1.7627531870708888
Energy: 1.5911254807903634
Energy: 1.762753187072359
Energy: 1.7683884904834168
Energy: 1.7627531870708888
Energy: 1.5557005716568528
Energy: 1.992810455236373
Energy: 1.600425514905112
Energy: 1.992810455236373
Energy: 1.5557005716568528
Energy: 1.9928104552378427
Energy: 1.5464319900166275
Energy: 1.94857377730577
Energy: 1.5917982536524173
Energy: 1.94857377730577
Energy: 1.5464319900166275
Energy: 1.94857377730577
Energy: 1.5923053877243756
Energy: 1.9654168969394232
Energy: 1.600683597013937
Energy: 1.9654168969394232
Energy: 1.5923053877243756
Energy: 1.9654168969394232
Energy: 1.5933513225361369
Energy: 1.89262809663274
Energy: 1.6437026226767086
Energy: 1.89262809663274
Energy: 1.5933513225361369
Energy: 1.89262809663274
Energy: 1.5908432538357886
Energy: 1.9487940626254008
Energy: 1.5459754868300195
Energy: 1.9487940626254008
Energy: 1.5908432538372586
Energy: 1.9487940626254008
Energy: 1.5908487709497081
Energy: 1.9487466366229635
Energy: 1.5461615532114414
Energy: 1.9487466366244335
Energy: 1.5908487709497081
Energy: 1.9487466366244335
Energy: 1.5933465136871274
Energy: 1.8925173903693886
Energy: 1.600704471052456
Energy: 1.8925173903693886
Energy: 1.5933465136871274
Energy: 1.8925173903693886
Energy: 1.592470546798755
Energy: 1.9654521132728313
Energy: 1.6005536989597153
Energy: 1.9654521132728313
Energy: 1.592470546798755
Energy: 1.9654521132728313
Energy: 1.5464278666784061
Energy: 1.948620110433666
Energy: 1.5918708098398218
Energy: 1.948620110433666
Energy: 1.5464278666784061
Energy: 1.948620110433666
Energy: 1.5556218893011358
Energy: 1.9928104552378427
Energy: 1.6005675067887803
Energy: 1.992810455239313
Energy: 1.5556218893011358
Energy: 1.992810455239313
Energy: 1.7683884904819465
Energy: 1.7627531870708888
Energy: 1.5911254807800723
Energy: 1.7627531870708888
Energy: 1.7683884904834168
Energy: 1.7627531870708888
Energy: 1.5557005716568528
Energy: 1.992810455236373
Energy: 1.6649914389580123
Energy: 1.992810455236373
Energy: 1.5557005716568528
Energy: 1.992810455236373
Energy: 1.5464319900180976
Energy: 1.94857377730577
Energy: 1.59178457035228
Energy: 1.94857377730577
Energy: 1.5464319900166275
Energy: 1.94857377730577
Energy: 1.5923053877243756
Energy: 1.9654168969394232
Energy: 1.6006835970124669
Energy: 1.9654168969394232
Energy: 1.5923053877243756
Energy: 1.9654168969394232
Energy: 1.5933513225361369
Energy: 1.89262809663274
Energy: 1.6653725620145405
Energy: 1.89262809663274
Energy: 1.5933513225361369
Energy: 1.89262809663274
Energy: 1.5908432538357886
Energy: 1.9487940626254008
Energy: 1.5459754868300195
Energy: 1.9487940626254008
Energy: 1.5908432538357886
Energy: 1.9487940626254008
Energy: 1.5908487709497081
Energy: 1.9487466366244335
Energy: 1.5461615532114414
Energy: 1.9487466366229635
Energy: 1.5908487709497081
Energy: 1.9487466366229635
Energy: 1.5933465136871274
Energy: 1.8925173903693886
Energy: 1.6007044710509857
Energy: 1.8925173903693886
Energy: 1.593346513685657
Energy: 1.8925173903693886

minimum gb energy = 1.5459754868300195 eV
minimum distance =  2.22903839710435 Angstroms
sigma value = 11


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

Energy: 1.5420076250504948
Energy: 1.9168612265057852
Energy: 1.4659423525830064
Energy: 1.9168612265057852
Energy: 1.5420076250504948
Energy: 1.9168612265057852
Energy: 1.3926897081018688
Energy: 1.8318368969855325
Energy: 1.3905526891666633
Energy: 1.8318368969855325
Energy: 1.3926897081018688
Energy: 1.8318368969866097
Energy: 1.5382270881082596
Energy: 1.532134818078664
Energy: 1.4664247953608285
Energy: 1.5321348180797412
Energy: 1.5382270881093367
Energy: 1.5321348180797412
Energy: 1.4053345170168952
Energy: 1.4285351433261047
Energy: 1.391168848613541
Energy: 1.4285351433271816
Energy: 1.4053345170168952
Energy: 1.4285351433261047
Energy: 1.3905220126633921
Energy: 1.9160395266276815
Energy: 1.5049619365016589
Energy: 1.9160395266298356
Energy: 1.390522012664469
Energy: 1.9160395266298356
Energy: 1.4301226012178188
Energy: 1.9073183988979034
Energy: 1.390547636037547
Energy: 1.9073183988979034
Energy: 1.4301226012167418
Energy: 1.9073183988968265
Energy: 1.4293341067423362
Energy: 1.3920146996537464
Energy: 1.3904867286771503
Energy: 1.3920146996548233
Energy: 1.429334106743413
Energy: 1.3920146996548233
Energy: 1.4321049116699331
Energy: 1.9173619446237913
Energy: 1.4013908163764632
Energy: 1.917361944624868
Energy: 1.4321049116699331
Energy: 1.917361944624868
Energy: 1.4311805834455134
Energy: 1.920575359470732
Energy: 1.392650957568167
Energy: 1.9205753594728858
Energy: 1.43118058344659
Energy: 1.9205753594728858
Energy: 1.4307485601804986
Energy: 1.3928302947909263
Energy: 1.390378726701168
Energy: 1.392830294792003
Energy: 1.4307485601815755
Energy: 1.392830294792003
Energy: 1.429302759454538
Energy: 1.9030432152246335
Energy: 1.39051937011618
Energy: 1.9030432152235568
Energy: 1.4293027594534613
Energy: 1.9030432152235568
Energy: 1.3924819262602086
Energy: 1.9169992271173728
Energy: 1.3909345846942263
Energy: 1.9169992271162957
Energy: 1.3924819262591317
Energy: 1.9169992271162957
Energy: 1.4299427888234604
Energy: 1.4375796837288222
Energy: 1.4305606130898427
Energy: 1.437579683727745
Energy: 1.4299427888234604
Energy: 1.437579683727745
Energy: 1.5294048449762414
Energy: 1.3922383478565556
Energy: 1.4282660479957323
Energy: 1.3922383478565556
Energy: 1.5294048449762414
Energy: 1.3922383478565556
Energy: 1.394853083234077
Energy: 1.5033561353567186
Energy: 1.39055976178522
Energy: 1.5033561353577956
Energy: 1.3948530832351538
Energy: 1.5033561353577956
Energy: 1.4021926371799658
Energy: 1.9176030368783894
Energy: 1.4349296375214629
Energy: 1.9176030368773125
Energy: 1.4021926371788886
Energy: 1.9176030368783894
Energy: 1.4070063232257732
Energy: 1.828290326189227
Energy: 1.4301665449952654
Energy: 1.828290326185996
Energy: 1.4070063232225425
Energy: 1.8282903261946115
Energy: 1.5295436266229339
Energy: 1.5043305294202707
Energy: 1.4621370866514196
Energy: 1.5043305294202707
Energy: 1.529543626624011
Energy: 1.5043305294191938
Energy: 1.4066842759556992
Energy: 1.6478817779023902
Energy: 1.3906982041999159
Energy: 1.6478817779013135
Energy: 1.406684275958881
Energy: 1.6478817779034673
Energy: 1.3925720348848576
Energy: 1.9235461315216833
Energy: 1.4376227975801454
Energy: 1.9235461315216833
Energy: 1.3925720348859343
Energy: 1.9235461315216833
Energy: 1.5069954408367883
Energy: 1.8995288998708948
Energy: 1.3908811421771965
Energy: 1.8995288998708948
Energy: 1.5069954408378652
Energy: 1.8995288998708948
Energy: 1.4309936442394933
Energy: 1.6367299798148034
Energy: 1.3904312844375366
Energy: 1.6367299798148034
Energy: 1.4309936442384166
Energy: 1.6367299798158803
Energy: 1.4345390749199325
Energy: 1.9211869069791692
Energy: 1.401040035039925
Energy: 1.9211869069791692
Energy: 1.4345390749199325
Energy: 1.9211869069791692
Energy: 1.392941027638381
Energy: 1.920399738066964
Energy: 1.399976602354912
Energy: 1.920399738066964
Energy: 1.392941027638381
Energy: 1.920399738065887
Energy: 1.4346312867435242
Energy: 1.3937007329157465
Energy: 1.39083885483797
Energy: 1.3937007329168234
Energy: 1.4346312867435242
Energy: 1.3937007329179
Energy: 1.430938122407898
Energy: 1.9026533738492861
Energy: 1.3906112461513191
Energy: 1.9026533738492861
Energy: 1.430938122408975
Energy: 1.9026533738492861

minimum gb energy = 1.390378726701168 eV
minimum distance =  2.2803546790971 Angstroms
sigma value = 41


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

Energy: 1.972307309446429
Energy: 1.7932455850427487
Energy: 1.347389186147942
Energy: 1.7932455850435975
Energy: 1.9723073094472776
Energy: 1.7932455850435975
Energy: 1.7751955959409476
Energy: 1.6449923127674748
Energy: 1.2622953962755665
Energy: 1.6449923127683241
Energy: 1.7751955959409476
Energy: 1.6449923127683241
Energy: 1.363384513803279
Energy: 1.7388081968911906
Energy: 1.3562011810611905
Energy: 1.7388081968920395
Energy: 1.363384513803279
Energy: 1.7388081968920395
Energy: 1.7747061767194083
Energy: 1.5000227650899092
Energy: 1.2622420700439596
Energy: 1.5000227650899092
Energy: 1.7747061767185597
Energy: 1.5000227650899092
Energy: 1.3681802616026153
Energy: 1.3649786457380806
Energy: 1.3065303291663186
Energy: 1.3649786457380806
Energy: 1.3681802616026153
Energy: 1.3649786457380806
Energy: 1.2999782731174605
Energy: 1.7168159451120204
Energy: 1.26227591552141
Energy: 1.7168159451120204
Energy: 1.2999782731174605
Energy: 1.7168159451120204
Energy: 1.262172308436342
Energy: 1.7411509349086638
Energy: 1.2620359021831045
Energy: 1.741150934907815
Energy: 1.262172308437191
Energy: 1.7411509349086638
Energy: 1.375262205458507
Energy: 1.720347526638546
Energy: 1.266297661566441
Energy: 1.720347526637697
Energy: 1.375262205458507
Energy: 1.720347526637697
Energy: 1.3004962990648317
Energy: 1.3654070252572663
Energy: 1.5117402922098166
Energy: 1.3654070252572663
Energy: 1.3004962990648317
Energy: 1.3654070252572663
Energy: 1.543404449342864
Energy: 1.7362023863464233
Energy: 1.7622197132179565
Energy: 1.7362023863455744
Energy: 1.5434044493420152
Energy: 1.7362023863455744
Energy: 1.7861599679908098
Energy: 1.7414338258296387
Energy: 1.762169356682065
Energy: 1.7414338258287898
Energy: 1.7861599679908098
Energy: 1.7414338258287898
Energy: 1.2998528297813157
Energy: 1.7604702163235382
Energy: 1.2663846932260046
Energy: 1.7604702163235382
Energy: 1.2998528297813157
Energy: 1.7604702163235382
Energy: 1.3007093252218505
Energy: 1.7337950445568941
Energy: 1.5119498297747693
Energy: 1.7337950445577428
Energy: 1.3007093252210016
Energy: 1.7337950445577428
Energy: 1.2655842071903431
Energy: 1.737994642015715
Energy: 1.2619890999162462
Energy: 1.737994642015715
Energy: 1.2655842071903431
Energy: 1.737994642015715
Energy: 1.782840249294051
Energy: 1.3001176672796475
Energy: 1.262125854561962
Energy: 1.3001176672796475
Energy: 1.7828402492948996
Energy: 1.3001176672796475
Energy: 1.3565432163942444
Energy: 1.760401976274094
Energy: 1.2623450678570152
Energy: 1.7604019762749428
Energy: 1.3565432163942444
Energy: 1.7604019762749428
Energy: 1.7719343698822227
Energy: 1.3736345211541723
Energy: 1.3090025234442286
Energy: 1.3736345211558698
Energy: 1.7719343698830714
Energy: 1.3736345211550212
Energy: 1.2674441418771876
Energy: 1.733745308462541
Energy: 1.2998526695485457
Energy: 1.7337453084633896
Energy: 1.2674441418771876
Energy: 1.7337453084633896
Energy: 1.7737336917410267
Energy: 1.6445862220968839
Energy: 1.2621766863170756
Energy: 1.6445862220985816
Energy: 1.7737336917410267
Energy: 1.6445862220977328
Energy: 1.7622440079432715
Energy: 1.7616597603548825
Energy: 1.5425715697886613
Energy: 1.7616597603557314
Energy: 1.7622440079432715
Energy: 1.7616597603557314
Energy: 1.7636213461385015
Energy: 1.6452876901116884
Energy: 1.3089281668953392
Energy: 1.6452876901108398
Energy: 1.7636213461393506
Energy: 1.6452876901108398
Energy: 1.267785096024569
Energy: 1.7377932113193437
Energy: 1.3516736049480853
Energy: 1.7377932113193437
Energy: 1.267785096024569
Energy: 1.7377932113193437
Energy: 1.5192469221444975
Energy: 1.5177502145782416
Energy: 1.262300473564572
Energy: 1.5177502145782416
Energy: 1.5192469221444975
Energy: 1.5177502145782416
Energy: 1.3564228585548346
Energy: 1.4532716122525007
Energy: 1.299467650597756
Energy: 1.4532716122533493
Energy: 1.3564228585556837
Energy: 1.4532716122525007
Energy: 1.300271067633035
Energy: 1.72217633504719
Energy: 1.262340317003979
Energy: 1.72217633504719
Energy: 1.300271067633035
Energy: 1.72217633504719
Energy: 1.265390108396548
Energy: 1.6748810607699463
Energy: 1.2624541900005692
Energy: 1.6748810607699463
Energy: 1.2653901083973966
Energy: 1.674881060770795
Energy: 1.3778408355004919
Energy: 1.7243369911076434
Energy: 1.2661957453776589
Energy: 1.7243369911067947
Energy: 1.377840835499643
Energy: 1.7243369911076434
Energy: 1.299771388725277
Energy: 1.5938286742664352
Energy: 1.7723182156367996
Energy: 1.593828674267284
Energy: 1.2997713887244282
Energy: 1.593828674267284
Energy: 1.5481955755653323
Energy: 1.7336791771882722
Energy: 1.763199217135554
Energy: 1.7336791771882722
Energy: 1.5481955755661814
Energy: 1.7336791771874236
Energy: 1.2621044139897728
Energy: 1.5857168040891843
Energy: 1.7625180092757333
Energy: 1.5857168040891843
Energy: 1.2621044139889241
Energy: 1.5857168040891843
Energy: 1.2998702840478324
Energy: 1.7233911668537452
Energy: 1.2661544610912654
Energy: 1.7233911668537452
Energy: 1.2998702840478324
Energy: 1.7233911668537452
Energy: 1.299932093218044
Energy: 1.747108831547319
Energy: 1.772199427163757
Energy: 1.747108831547319
Energy: 1.299932093218044
Energy: 1.747108831547319
Energy: 1.2622388487717866
Energy: 1.7337277683103185
Energy: 1.2625027278106429
Energy: 1.7337277683103185
Energy: 1.2622388487717866
Energy: 1.7337277683094698

minimum gb energy = 1.2619890999162462 eV
minimum distance =  2.28830838982503 Angstroms
sigma value = 33


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

Energy: 1.6252296259245271
Energy: 1.4950495034885058
Energy: 1.1343596382965926
Energy: 1.4950495034867186
Energy: 1.62522962592274
Energy: 1.4950495034867186
Energy: 1.8856902560495101
Energy: 1.158796467456476
Energy: 1.1108965009025566
Energy: 1.1587964674570717
Energy: 1.8856902560507018
Energy: 1.1587964674576674
Energy: 1.5927258272028975
Energy: 1.5143739276748065
Energy: 1.1698884563854794
Energy: 1.5143739276730195
Energy: 1.5927258272028975
Energy: 1.5143739276730195
Energy: 1.8876411757251081
Energy: 1.1285943039795676
Energy: 1.1110961317019012
Energy: 1.1285943039801634
Energy: 1.8876411757239164
Energy: 1.1285943039795676
Energy: 1.1798888260555145
Energy: 1.5135584844563803
Energy: 1.1436946616422288
Energy: 1.5135584844563803
Energy: 1.179888826054919
Energy: 1.5135584844557846
Energy: 1.8929097441751128
Energy: 1.1275298848953044
Energy: 1.1107099793315967
Energy: 1.1275298848947086
Energy: 1.8929097441757088
Energy: 1.1275298848959
Energy: 1.168675156743526
Energy: 1.4779294388461903
Energy: 1.1158814038710199
Energy: 1.4779294388461903
Energy: 1.168675156743526
Energy: 1.4779294388461903
Energy: 1.3038038455592433
Energy: 1.111246352099771
Energy: 1.1089905419092796
Energy: 1.111246352099771
Energy: 1.3038038455592433
Energy: 1.1112463520991755
Energy: 1.1087674873713176
Energy: 1.5140879132584593
Energy: 1.3693808342116067
Energy: 1.5140879132566722
Energy: 1.108767487372509
Energy: 1.5140879132566722
Energy: 1.4570483838215653
Energy: 1.4900869140670017
Energy: 1.4480133442203647
Energy: 1.4900869140681932
Energy: 1.4570483838233523
Energy: 1.4900869140675976
Energy: 1.1099424909179323
Energy: 1.478005032330674
Energy: 1.447321830594542
Energy: 1.478005032330674
Energy: 1.1099424909179323
Energy: 1.478005032330674
Energy: 1.5161523512529043
Energy: 1.5127202240474693
Energy: 1.4578826280544195
Energy: 1.5127202240492563
Energy: 1.516152351254096
Energy: 1.5127202240486608
Energy: 1.4590633783005393
Energy: 1.4957378668770367
Energy: 1.7760464552157347
Energy: 1.4957378668776327
Energy: 1.4590633783005393
Energy: 1.4957378668776327
Energy: 1.4663682529874758
Energy: 1.51448580027021
Energy: 1.8819344498036819
Energy: 1.51448580027021
Energy: 1.4663682529886672
Energy: 1.5144858002708057
Energy: 1.4588522479369486
Energy: 1.4739514457094192
Energy: 1.8818308648378177
Energy: 1.4739514457106107
Energy: 1.4588522479381398
Energy: 1.4739514457106107
Energy: 1.4608422322299133
Energy: 1.5128293999716544
Energy: 1.4579022194377271
Energy: 1.512829399972846
Energy: 1.4608422322311048
Energy: 1.5128293999722502
Energy: 1.4591718443160038
Energy: 1.4953918872290706
Energy: 1.7764919806558703
Energy: 1.4953918872296665
Energy: 1.4591718443154083
Energy: 1.4953918872302618
Energy: 1.1157770382525947
Energy: 1.5141187924485615
Energy: 1.4480970335168941
Energy: 1.5141187924491575
Energy: 1.1157770382519991
Energy: 1.5141187924485615
Energy: 1.4588604312364772
Energy: 1.4959099738485397
Energy: 1.4472646689858326
Energy: 1.4959099738503268
Energy: 1.4588604312382643
Energy: 1.4959099738503268
Energy: 1.1144579469321518
Energy: 1.5132473708463663
Energy: 1.108905621215789
Energy: 1.5132473708457708
Energy: 1.1144579469327474
Energy: 1.5132473708463663
Energy: 1.459045352264782
Energy: 1.4837589269891072
Energy: 1.3700270124061418
Energy: 1.4837589269897027
Energy: 1.459045352264782
Energy: 1.4837589269897027
Energy: 1.1579119253501942
Energy: 1.5228702928999107
Energy: 1.1106578567799892
Energy: 1.5228702928981237
Energy: 1.15791192535079
Energy: 1.5228702928981237
Energy: 1.4438054788378463
Energy: 1.5014237779740538
Energy: 1.116040786399044
Energy: 1.501423777973458
Energy: 1.443805478836655
Energy: 1.501423777973458
Energy: 1.1246781932232799
Energy: 1.5140911001491326
Energy: 1.1106157569412987
Energy: 1.5140911001479411
Energy: 1.1246781932226841
Energy: 1.5140911001479411
Energy: 1.8828142137322057
Energy: 1.4803769873804755
Energy: 1.375026841211098
Energy: 1.4803769873810708
Energy: 1.8828142137322057
Energy: 1.4803769873810708
Energy: 1.459129436201876
Energy: 1.5149647366130905
Energy: 1.1279639824456817
Energy: 1.5149647366136862
Energy: 1.4591294362000888
Energy: 1.514964736614282
Energy: 1.892713595851333
Energy: 1.1882119583121533
Energy: 1.1160068592163817
Energy: 1.1882119583127488
Energy: 1.8927135958507373
Energy: 1.1882119583121533
Energy: 1.488634132745246
Energy: 1.5170056506235756
Energy: 1.2967152564081987
Energy: 1.5170056506241716
Energy: 1.4886341327434587
Energy: 1.5170056506241716
Energy: 1.8835499639706217
Energy: 1.4797139997600548
Energy: 1.4613886982041089
Energy: 1.4797139997612463
Energy: 1.883549963971813
Energy: 1.4797139997600548
Energy: 1.4587774415893413
Energy: 1.5153321660312666
Energy: 1.160093461813456
Energy: 1.5153321660312666
Energy: 1.4587774415881498
Energy: 1.5153321660312666
Energy: 1.293610800550554
Energy: 1.374522239389478
Energy: 1.1157361282766878
Energy: 1.3745222393900736
Energy: 1.2936108005493623
Energy: 1.3745222393900736
Energy: 1.1246008273132446
Energy: 1.4919417822831007
Energy: 1.1273516585892016
Energy: 1.491941782282505
Energy: 1.124600827312053
Energy: 1.491941782282505
Energy: 1.458315305703903
Energy: 1.4692970865186008
Energy: 1.1143073009768834
Energy: 1.469297086520388
Energy: 1.4583153057044989
Energy: 1.469297086519792
Energy: 1.1571299740412546
Energy: 1.468713924058637
Energy: 1.458670772008621
Energy: 1.4687139240580418
Energy: 1.1571299740412546
Energy: 1.4687139240580418
Energy: 1.458563017515523
Energy: 1.4682621106705918
Energy: 1.1572595258514333
Energy: 1.4682621106688047
Energy: 1.4585630175167146
Energy: 1.4682621106694007
Energy: 1.1143194972770571
Energy: 1.4690723202891445
Energy: 1.458036163615501
Energy: 1.4690723202903357
Energy: 1.114319497277653
Energy: 1.4690723202903357
Energy: 1.1273545635447706
Energy: 1.4919193009522098
Energy: 1.1248065965403844
Energy: 1.4919193009534015
Energy: 1.127354563544175
Energy: 1.4919193009534015
Energy: 1.1157438724042312
Energy: 1.3746925044784113
Energy: 1.2932716423343709
Energy: 1.3746925044778158
Energy: 1.1157438724054225
Energy: 1.37469250447722
Energy: 1.160093461813456
Energy: 1.5152959892586577
Energy: 1.458865841023134
Energy: 1.515295989259849
Energy: 1.160093461814052
Energy: 1.515295989259849
Energy: 1.280783376348429
Energy: 1.479924373116466
Energy: 1.8832686181532985
Energy: 1.4799243731146787
Energy: 1.2807833763472378
Energy: 1.4799243731152742
Energy: 1.296811017408002
Energy: 1.5167928405099849
Energy: 1.4893025200644496
Energy: 1.516792840511772
Energy: 1.2968110174085978
Energy: 1.516792840511772
Energy: 1.1160385444151175
Energy: 1.1881972743110354
Energy: 1.8914913786268819
Energy: 1.1881972743104394
Energy: 1.1160385444151175
Energy: 1.188197274309844
Energy: 1.1277813435682384
Energy: 1.5149662178212693
Energy: 1.4590019649986203
Energy: 1.514966217821865
Energy: 1.1277813435670472
Energy: 1.5149662178224605
Energy: 1.281130012863022
Energy: 1.4802710403514194
Energy: 1.8828176265874768
Energy: 1.480271040350824
Energy: 1.281130012863022
Energy: 1.480271040350824
Energy: 1.1108261239146096
Energy: 1.5140651719510363
Energy: 1.1248132327020255
Energy: 1.5140651719504408
Energy: 1.1108261239134183
Energy: 1.5140651719504408
Energy: 1.1160206776848942
Energy: 1.5014237779692883
Energy: 1.4384558943121057
Energy: 1.5014237779686923
Energy: 1.1160206776860857
Energy: 1.5014237779692883
Energy: 1.110449876672807
Energy: 1.5228957834728951
Energy: 1.157693886952766
Energy: 1.5228957834717038
Energy: 1.1104498766722113
Energy: 1.5228957834717038

minimum gb energy = 1.1087674873713176 eV
minimum distance =  2.31163367845246 Angstroms
sigma value = 67


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

Energy: 0.3110145331672613
Energy: 0.31152303652588026
Energy: 0.445414457342329
Energy: 0.3115230365254731
Energy: 0.3110145331672613
Energy: 0.3115230365251112
Energy: 0.3256835886758559
Energy: 0.8722367213888208
Energy: 0.8570241516563952
Energy: 0.872236721389228
Energy: 0.325683588676263
Energy: 0.8722367213888208
Energy: 0.3110145331672613
Energy: 0.3115230365251112
Energy: 0.44541445734269086
Energy: 0.3115230365251112
Energy: 0.3110145331672613
Energy: 0.3115230365251112
Energy: 0.3256835886774846
Energy: 0.8722367213884589
Energy: 0.8570241516563952
Energy: 0.872236721389228
Energy: 0.3256835886758559
Energy: 0.8722367213888208
Energy: 0.3110145331672613
Energy: 0.31152303652588026
Energy: 0.445414457342329
Energy: 0.3115230365254731
Energy: 0.31101453316766847
Energy: 0.3115230365254731
Energy: 0.32568358867784647
Energy: 0.8722367213888208
Energy: 0.857024151657187
Energy: 0.872236721389228
Energy: 0.3256835886774846
Energy: 0.8722367213888208
Energy: 0.31101453316685407
Energy: 0.3115230365254731
Energy: 0.445414457342329
Energy: 0.3115230365251112
Energy: 0.3110145331672613
Energy: 0.3115230365251112

minimum gb energy = 0.31101453316685407 eV
minimum distance =  2.43663492602798 Angstroms
sigma value = 3


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

Energy: 2.062855133720609
Energy: 1.4691710015361144
Energy: 1.2489223558458005
Energy: 1.4691710015404484
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Energy: 1.2547088543949283
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Energy: 1.186877607346971
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Energy: 1.547897220323845
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Energy: 1.5675059850664939
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Energy: 1.7511677080590802
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Energy: 1.7511677080590802
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Energy: 1.8211969673696318
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Energy: 1.1172675760724848
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Energy: 1.821196967371799
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Energy: 1.9095943641861595
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Energy: 1.1127198639389944
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Energy: 1.5454201655664053
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Energy: 1.190939883530132
Energy: 1.4221087999452937
Energy: 1.5454201655664053
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Energy: 1.2047186156016607
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Energy: 1.580258497799967
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Energy: 1.5047338558775925
Energy: 1.4039924246052344
Energy: 1.517218160853591
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Energy: 1.216086854815206
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Energy: 1.2020999970597557
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Energy: 1.2020999970575885
Energy: 1.4080545408018186
Energy: 1.3678371785352852
Energy: 1.4280530882304936
Energy: 1.5121781351948351
Energy: 1.428053088232661
Energy: 1.3678371785352852
Energy: 1.428053088232119
Energy: 1.1808920894144306
Energy: 1.2036047000596148
Energy: 1.5412599026401728
Energy: 1.2036047000547387
Energy: 1.1808920894111798
Energy: 1.203604700054197
Energy: 1.180430544052353
Energy: 1.4172173383698434
Energy: 1.540800206336261
Energy: 1.4172173383665927
Energy: 1.180430544051811
Energy: 1.4172173383665927
Energy: 1.1219330304410216
Energy: 1.2133817569006045
Energy: 1.736366738821796
Energy: 1.2133817568984375
Energy: 1.1219330304410216
Energy: 1.2133817568984375
Energy: 1.1810631092889927
Energy: 1.428280638362988
Energy: 1.5745194374297518
Energy: 1.428280638362988
Energy: 1.1810631092895345
Energy: 1.42828063836353
Energy: 1.102344173821369
Energy: 1.1190467035744383
Energy: 1.794724768971318
Energy: 1.1190467035717293
Energy: 1.102344173819202
Energy: 1.119046703572271
Energy: 1.121547132671848
Energy: 1.4414285524450108
Energy: 1.8546618798201377
Energy: 1.441428552443927
Energy: 1.1215471326702227
Energy: 1.4414285524433854
Energy: 1.1231866812123077
Energy: 1.1200711239121792
Energy: 1.834666227038217
Energy: 1.1200711239159717
Energy: 1.1231866812123077
Energy: 1.1200711239165135
Energy: 1.2162316536115538
Energy: 1.431121927613221
Energy: 1.5698607495229955
Energy: 1.4311219276143046
Energy: 1.2162316536110118
Energy: 1.4311219276137626
Energy: 1.1108726524633585
Energy: 1.1150663125257807
Energy: 1.7683627307368708
Energy: 1.1150663125241553
Energy: 1.1108726524606496
Energy: 1.1150663125246971
Energy: 1.20670867997538
Energy: 1.4171484766182547
Energy: 1.5409631445170762
Energy: 1.4171484766177127
Energy: 1.2067086799732127
Energy: 1.4171484766177127
Energy: 1.2092804168987619
Energy: 1.2006024064702467
Energy: 1.5367097608766647
Energy: 1.2006024064729555
Energy: 1.2092804169003872
Energy: 1.2006024064729555
Energy: 1.493914479753295
Energy: 1.406963004385258
Energy: 1.5120830583470264
Energy: 1.406963004387425
Energy: 1.4939144797473356
Energy: 1.4069630043868833

minimum gb energy = 1.102344173819202 eV
minimum distance =  2.3020421850369 Angstroms
sigma value = 81


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

Energy: 2.0091990017128074
Energy: 1.6716284798216177
Energy: 1.5985960363783982
Energy: 1.6716284798216177
Energy: 2.009199001713551
Energy: 1.6716284798216177
Energy: 1.7572573388116688
Energy: 1.2776261148781667
Energy: 1.2576368605971981
Energy: 1.2776261148803973
Energy: 1.757257338814643
Energy: 1.2776261148803973
Energy: 2.0433633622129688
Energy: 1.636001016103939
Energy: 1.2547636080469178
Energy: 1.6360010161031955
Energy: 2.0433633622144565
Energy: 1.6360010161031955
Energy: 1.6232870028724793
Energy: 1.251516476995284
Energy: 1.262629241431541
Energy: 1.2515164769960274
Energy: 1.623287002870992
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Energy: 1.4481074246586112
Energy: 1.2640440040681424
Energy: 1.2642077775632394
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Energy: 1.4481074246571235
Energy: 1.2640440040666554
Energy: 1.3763646227379682
Energy: 1.3749981089900025
Energy: 1.366403820521675
Energy: 1.3749981089900025
Energy: 1.376364622750609
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Energy: 1.4193589879907176
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Energy: 1.3997405240937804
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Energy: 1.419358987989974
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Energy: 1.6369296036999867
Energy: 1.2521165999048456
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Energy: 1.6020848442467837
Energy: 1.4720022101645027
Energy: 1.2521165999041022
Energy: 1.4720022101645027
Energy: 1.3595009727817922
Energy: 1.623133694141379
Energy: 1.6469945111116702
Energy: 1.623133694141379
Energy: 1.359500972782536
Energy: 1.623133694141379
Energy: 1.3598556789753515
Energy: 1.4030473362538745
Energy: 1.4022995174610084
Energy: 1.4030473362531308
Energy: 1.359855678977582
Energy: 1.4030473362531308
Energy: 1.3667078754553703
Energy: 1.6369273875245827
Energy: 1.4147267563295485
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Energy: 1.3667078754561142
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Energy: 1.366374583021887
Energy: 1.3755029796006764
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Energy: 1.3663745830211431
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Energy: 1.610551789225454
Energy: 1.6098915773757019
Energy: 1.6499296441474143
Energy: 1.362034733973905
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Energy: 1.6098915773734712
Energy: 1.649929644148158
Energy: 1.6469443713490488
Energy: 1.63411098323678
Energy: 1.2626626242238195
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Energy: 1.6469443713490488
Energy: 1.6341109832375234
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Energy: 1.6307800559324905
Energy: 1.8662612326999375
Energy: 1.5404776536977558
Energy: 1.2584892636505218
Energy: 1.5404776536992433
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Energy: 1.6974883730210666
Energy: 1.378540801699849
Energy: 1.25893005951119
Energy: 1.378540801703567
Energy: 1.6974883730210666
Energy: 1.378540801703567
Energy: 1.6474196911579426
Energy: 1.6317351183525213
Energy: 1.4988088636745907
Energy: 1.6317351183554953
Energy: 1.6474196911609167
Energy: 1.6317351183554953
Energy: 1.640935727071526
Energy: 1.635121890611227
Energy: 1.2631252994963076
Energy: 1.6351218906134577
Energy: 1.6409357270707823
Energy: 1.6351218906127143
Energy: 1.6118934105001574
Energy: 1.6440740054905985
Energy: 1.3620841006442133
Energy: 1.644074005493573
Energy: 1.6118934105016447
Energy: 1.644074005493573
Energy: 1.5996891813846916
Energy: 1.6106876427242007
Energy: 1.3669427215114094
Energy: 1.6106876427279189
Energy: 1.5996891813854353
Energy: 1.6106876427279189
Energy: 1.3663778380358154
Energy: 1.380132330122309
Energy: 1.5698518503423882
Energy: 1.3801323301237962
Energy: 1.3663778380358154
Energy: 1.3801323301230528
Energy: 1.3666559947399626
Energy: 1.634263800147597
Energy: 1.4144155618015297
Energy: 1.6342638001490843
Energy: 1.366655994740706
Energy: 1.6342638001498278
Energy: 1.3599883328870856
Energy: 1.4030473362561051
Energy: 1.5978798573595092
Energy: 1.4030473362561051
Energy: 1.3599883328878293
Energy: 1.4030473362561051
Energy: 1.3595950046294634
Energy: 1.622857518518385
Energy: 1.6474292142577867
Energy: 1.622857518518385
Energy: 1.3595950046294634
Energy: 1.622857518518385
Energy: 1.245050849883712
Energy: 1.253935853188127
Energy: 1.5967406537800675
Energy: 1.2539358531888707
Energy: 1.2450508498844555
Energy: 1.253935853190358
Energy: 1.268202729469232
Energy: 1.636991898613707
Energy: 1.7734184205835255
Energy: 1.6369918986151941
Energy: 1.268202729470719
Energy: 1.6369918986144507
Energy: 1.2548418167651567
Energy: 1.2474503058643975
Energy: 1.7362541643631104
Energy: 1.2474503058666284
Energy: 1.2548418167651567
Energy: 1.2474503058666284
Energy: 1.4101330058880714
Energy: 1.6227663243185764
Energy: 1.6474166362911458
Energy: 1.6227663243193196
Energy: 1.4101330058880714
Energy: 1.6227663243193196
Energy: 1.2603339538889666
Energy: 1.2429172494306953
Energy: 1.5934405801402145
Energy: 1.242917249431439
Energy: 1.2603339538882232
Energy: 1.242917249431439
Energy: 1.3591911352506205
Energy: 1.2615718565750387
Energy: 1.414035071097361
Energy: 1.2615718565750387
Energy: 1.3591911352498767
Energy: 1.2615718565750387
Energy: 1.4193851065527332
Energy: 1.2497050280606312
Energy: 1.602572660541749
Energy: 1.2497050280598876
Energy: 1.4193851065519894
Energy: 1.2497050280606312

minimum gb energy = 1.2429172494306953 eV
minimum distance =  2.3053770524566 Angstroms
sigma value = 43


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

Energy: 2.2480275647202688
Energy: 1.794575846730865
Energy: 1.533513127634924
Energy: 1.794575846730865
Energy: 2.248027564719355
Energy: 1.794575846730865
Energy: 1.5326052765183142
Energy: 1.3901127417945234
Energy: 1.353724073583457
Energy: 1.390112741795437
Energy: 1.5326052765183142
Energy: 1.3901127417945234
Energy: 1.615527805983233
Energy: 1.3663339903002165
Energy: 1.501696423389557
Energy: 1.3663339903002165
Energy: 1.6155278059841465
Energy: 1.3663339902993028
Energy: 1.4893668070827397
Energy: 1.3483858283161663
Energy: 1.3617770324206449
Energy: 1.348385828315253
Energy: 1.4893668070836534
Energy: 1.348385828315253
Energy: 1.5538261612186723
Energy: 1.3421457912731967
Energy: 1.4906269077560905
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Energy: 1.3421457912704564
Energy: 1.5105732570282007
Energy: 1.502438717726041
Energy: 1.5030994366847976
Energy: 1.5024387177269543
Energy: 1.5105732570282007
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Energy: 1.3609165853471927
Energy: 1.3433766327237586
Energy: 1.5227594139698977
Energy: 1.343376632724672
Energy: 1.3609165853471927
Energy: 1.343376632724672
Energy: 1.5541118261331295
Energy: 1.3664088027768593
Energy: 1.5811315680967333
Energy: 1.366408802778686
Energy: 1.5541118261331295
Energy: 1.366408802778686
Energy: 1.3506061083728396
Energy: 1.3463778444532242
Energy: 1.3762999606116197
Energy: 1.346377844452311
Energy: 1.3506061083719263
Energy: 1.346377844452311
Energy: 1.363277734767631
Energy: 1.7646253114298605
Energy: 1.4069808568581141
Energy: 1.7646253114316872
Energy: 1.363277734767631
Energy: 1.7646253114316872
Energy: 1.3496848867248477
Energy: 1.6175008857865278
Energy: 1.5319447351151754
Energy: 1.617500885783788
Energy: 1.3496848867248477
Energy: 1.6175008857847013
Energy: 1.4924139319559273
Energy: 1.3657112868104357
Energy: 1.58123443805959
Energy: 1.3657112868113488
Energy: 1.4924139319577538
Energy: 1.3657112868122625
Energy: 1.4925524704882696
Energy: 1.3549725778228816
Energy: 1.4804587245417373
Energy: 1.3549725778247084
Energy: 1.4925524704873558
Energy: 1.3549725778237949
Energy: 1.5039568815214703
Energy: 1.7647396804494502
Energy: 1.5031567572147502
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Energy: 1.5039568815214703
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Energy: 1.504395864573455
Energy: 1.7793279937579254
Energy: 1.4924512301653854
Energy: 1.7793279937579254
Energy: 1.504395864573455
Energy: 1.7793279937579254
Energy: 1.5345526428490952
Energy: 1.3497687369952924
Energy: 1.3620369144269102
Energy: 1.3497687369952924
Energy: 1.5345526428500085
Energy: 1.3497687369952924
Energy: 1.5272979321936118
Energy: 1.360270592713196
Energy: 1.344005423664419
Energy: 1.3602705927122827
Energy: 1.527297932194525
Energy: 1.3602705927122827
Energy: 1.5939237105402435
Energy: 1.7079854730329547
Energy: 1.352544466120806
Energy: 1.707985473032041
Energy: 1.5939237105411568
Energy: 1.7079854730329547
Energy: 1.5969376587297772
Energy: 1.3637384618956838
Energy: 1.3526924445343926
Energy: 1.3637384618911168
Energy: 1.5969376587297772
Energy: 1.3637384618801565
Energy: 1.5010773755694407
Energy: 1.62345654216472
Energy: 1.3537555632883922
Energy: 1.62345654216472
Energy: 1.5010773755685272
Energy: 1.62345654216472
Energy: 1.501329667529695
Energy: 1.8081451437279852
Energy: 1.3609625812281458
Energy: 1.8081451437279852
Energy: 1.5013296675461354
Energy: 1.8081451437279852
Energy: 1.503841338489753
Energy: 1.7729474943238595
Energy: 1.4922809600500673
Energy: 1.7729474943247725
Energy: 1.503841338489753
Energy: 1.7729474943247725
Energy: 1.5050506393512562
Energy: 1.764356978485225
Energy: 1.5018392834953818
Energy: 1.7643569784843116
Energy: 1.5050506393512562
Energy: 1.7643569784843116
Energy: 1.4927467763050362
Energy: 1.3441196784011518
Energy: 1.507908103918094
Energy: 1.3441196785855682
Energy: 1.4927467763041227
Energy: 1.3441196784897063
Energy: 1.4925881997547907
Energy: 1.8087634719212917
Energy: 1.5798833647021027
Energy: 1.8087634719203785
Energy: 1.4925881997538777
Energy: 1.8087634719203785
Energy: 1.3483347449454584
Energy: 1.3489473892801147
Energy: 1.5303984692702846
Energy: 1.3489473892801147
Energy: 1.3483347449454584
Energy: 1.3489473892801147
Energy: 1.3626077400518093
Energy: 1.7649146667357858
Energy: 1.4050568079951624
Energy: 1.7649146667366993
Energy: 1.3626077400518093
Energy: 1.7649146667366993
Energy: 1.3511933387700963
Energy: 1.7687789299944627
Energy: 1.408793026124591
Energy: 1.7687789299935492
Energy: 1.3511933387710098
Energy: 1.7687789299935492
Energy: 1.5235344753654174
Energy: 1.3655327715601906
Energy: 1.5797706704125156
Energy: 1.3655327715583638
Energy: 1.5235344753645041
Energy: 1.3655327715583638
Energy: 1.3580715240703243
Energy: 1.347635530723024
Energy: 1.525315622589648
Energy: 1.3476355307248506
Energy: 1.3580715240694108
Energy: 1.3476355307239372
Energy: 1.3785593795231215
Energy: 1.5023297629749235
Energy: 1.501592297079511
Energy: 1.5023297629749235
Energy: 1.3785593795231215
Energy: 1.5023297629758368

minimum gb energy = 1.3421457912704564 eV
minimum distance =  2.29213334719915 Angstroms
sigma value = 57


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

Energy: 1.564725292711347
Energy: 1.4823866839424906
Energy: 1.6945264336628374
Energy: 1.4823866839436732
Energy: 1.564725292711347
Energy: 1.4823866839436732
Energy: 1.503259806802778
Energy: 1.604836314995312
Energy: 1.4842194907705317
Energy: 1.604836314995312
Energy: 1.503259806802778
Energy: 1.604836314995312
Energy: 1.4869763750273086
Energy: 2.001166692404393
Energy: 1.4917361694792566
Energy: 2.001166692404393
Energy: 1.4869763750273086
Energy: 2.001166692404393
Energy: 1.5014053463162766
Energy: 1.4918156566853806
Energy: 1.4841937790747461
Energy: 1.4918156566865632
Energy: 1.5014053463162766
Energy: 1.4918156566865632
Energy: 1.4811590858371935
Energy: 1.4972895012653296
Energy: 1.4794178712379957
Energy: 1.497289501264147
Energy: 1.4811590858371935
Energy: 1.4972895012653296
Energy: 1.5122612179786896
Energy: 1.982340286679595
Energy: 1.4827688163498056
Energy: 1.982340286679595
Energy: 1.5122612179798722
Energy: 1.982340286679595
Energy: 1.4913662338333074
Energy: 1.4926160008434326
Energy: 1.4835993202431865
Energy: 1.4926160008446154
Energy: 1.4913662338333074
Energy: 1.4926160008446154
Energy: 1.4990824540150565
Energy: 1.483602698990405
Energy: 1.5648445924301257
Energy: 1.483602698990405
Energy: 1.4990824540150565
Energy: 1.4836026989880395
Energy: 1.4814114689619864
Energy: 1.6034528935094443
Energy: 1.4798330736783958
Energy: 1.6034528935082617
Energy: 1.4814114689619864
Energy: 1.6034528935082617
Energy: 1.498296553290381
Energy: 1.969126297783754
Energy: 1.4830398315343611
Energy: 1.969126297783754
Energy: 1.498296553290381
Energy: 1.969126297783754
Energy: 1.4971219573911139
Energy: 1.487838607829334
Energy: 1.5000128246449944
Energy: 1.487838607829334
Energy: 1.4971219573899313
Energy: 1.487838607829334
Energy: 1.4863308233043404
Energy: 1.4853243200501356
Energy: 1.4841781840097523
Energy: 1.4853243200501356
Energy: 1.4863308233043404
Energy: 1.4853243200501356
Energy: 1.4816201512055132
Energy: 1.994546330464884
Energy: 1.5370693223201959
Energy: 1.994546330464884
Energy: 1.4816201512055132
Energy: 1.994546330464884
Energy: 1.4837235771583508
Energy: 1.9692433535114438
Energy: 1.4962967709284165
Energy: 1.9692433535114438
Energy: 1.4837235771583508
Energy: 1.9692433535114438
Energy: 1.4829167758865198
Energy: 1.9615541889154258
Energy: 1.4972057474684837
Energy: 1.9615541889154258
Energy: 1.4829167758865198
Energy: 1.9615541889154258
Energy: 1.4861008485581186
Energy: 1.9940759333000662
Energy: 1.484249693198009
Energy: 1.9940759333000662
Energy: 1.4861008485581186
Energy: 1.9940759333000662
Energy: 1.4818547138755414
Energy: 1.7692613699626691
Energy: 1.4963503321575502
Energy: 1.7692613699626691
Energy: 1.4818547138755414
Energy: 1.7692613699626691
Energy: 1.498293924703427
Energy: 1.815075826286027
Energy: 1.4982997595915815
Energy: 1.815075826286027
Energy: 1.4982939247046094
Energy: 1.815075826286027
Energy: 1.4963535720275776
Energy: 1.7695413553511976
Energy: 1.4819111869533699
Energy: 1.7695413553511976
Energy: 1.4963535720263947
Energy: 1.7695413553511976
Energy: 1.4842934320833177
Energy: 1.9940802970758615
Energy: 1.486123968069229
Energy: 1.994080297074679
Energy: 1.4842934320833177
Energy: 1.994080297074679
Energy: 1.4970564377596678
Energy: 1.961561555896122
Energy: 1.4829985267724874
Energy: 1.9615615558949395
Energy: 1.4970564377596678
Energy: 1.9615615558949395
Energy: 1.4963607831492405
Energy: 1.7677871485311591
Energy: 1.4834657045457198
Energy: 1.7677871485299765
Energy: 1.4963607831480579
Energy: 1.7677871485299765
Energy: 1.6239435300273957
Energy: 1.9942410155283523
Energy: 1.481618610393914
Energy: 1.9942410155283523
Energy: 1.6239435300273957
Energy: 1.9942410155283523
Energy: 1.4842382192493588
Energy: 1.4852887335862535
Energy: 1.4863295747264562
Energy: 1.485288733587436
Energy: 1.4842382192481762
Energy: 1.4852887335886187

minimum gb energy = 1.4794178712379957 eV
minimum distance =  2.31176995612475 Angstroms
sigma value = 17


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

Energy: 1.6546069574531204
Energy: 1.6547992158480582
Energy: 1.6961003603622766
Energy: 1.6547992158480582
Energy: 1.6546069574531204
Energy: 1.6547992158463858
Energy: 1.6902660373130343
Energy: 1.6709062557928247
Energy: 1.67530425209972
Energy: 1.6709062557928247
Energy: 1.6902660373130343
Energy: 1.6709062557928247
Energy: 1.6605693851230916
Energy: 1.6612129809958884
Energy: 1.8926919573662166
Energy: 1.6612129809958884
Energy: 1.6605693851230916
Energy: 1.6612129809958884
Energy: 1.6885571607023453
Energy: 1.6619715559970767
Energy: 1.6715920026085482
Energy: 1.6619715559970767
Energy: 1.6885571607023453
Energy: 1.6619715559970767
Energy: 1.6745927303798744
Energy: 1.6725864756441362
Energy: 1.6685887910568982
Energy: 1.6725864756441362
Energy: 1.6745927303782018
Energy: 1.6725864756441362
Energy: 1.6691994264162562
Energy: 1.653551907295473
Energy: 1.6531795921195362
Energy: 1.653551907295473
Energy: 1.6691994264162562
Energy: 1.653551907295473
Energy: 1.67102564290872
Energy: 1.8887519410474505
Energy: 1.694886924186141
Energy: 1.8887519410441054
Energy: 1.67102564290872
Energy: 1.888751941045778
Energy: 1.6718579638762399
Energy: 1.8687399610118174
Energy: 1.6711313583403544
Energy: 1.8687399610118174
Energy: 1.6718579638762399
Energy: 1.8687399610101447
Energy: 1.674989704272613
Energy: 1.6724023141557018
Energy: 1.7464140796971763
Energy: 1.6724023141557018
Energy: 1.6749897042709407
Energy: 1.6724023141557018
Energy: 1.6523973491747144
Energy: 1.6370182094400096
Energy: 1.669849115415315
Energy: 1.6370182094416823
Energy: 1.6523973491763868
Energy: 1.6370182094416823
Energy: 1.6547731095973643
Energy: 1.6614073351574479
Energy: 1.6673431741184652
Energy: 1.6614073351557754
Energy: 1.6547731095973643
Energy: 1.6614073351557754
Energy: 1.676502862600885
Energy: 1.6603245788764713
Energy: 1.6928995812717078
Energy: 1.6603245788781438
Energy: 1.6765028625992124
Energy: 1.6603245788781438
Energy: 1.6745753586296526
Energy: 1.87066944429262
Energy: 1.6772253801097143
Energy: 1.8706694442942924
Energy: 1.6745753586296526
Energy: 1.87066944429262
Energy: 1.6672975349549124
Energy: 1.676168421391342
Energy: 1.6787019234337561
Energy: 1.676168421391342
Energy: 1.6672975349565846
Energy: 1.676168421391342
Energy: 1.6707579794189795
Energy: 1.826203921858931
Energy: 1.6521781188273634
Energy: 1.826203921858931
Energy: 1.6707579794189795
Energy: 1.826203921858931
Energy: 1.6699772940255888
Energy: 1.6606727909517032
Energy: 1.6526113659645538
Energy: 1.6606727909517032
Energy: 1.6699772940255888
Energy: 1.6606727909517032
Energy: 1.671392441924044
Energy: 1.6718719500895514
Energy: 1.676274621161996
Energy: 1.671871950087879
Energy: 1.671392441924044
Energy: 1.6718719500895514

minimum gb energy = 1.6370182094400096 eV
minimum distance =  2.28972118386004 Angstroms
sigma value = 17


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

Energy: 2.387186407602497
Energy: 2.3212066310913393
Energy: 2.0503083337700856
Energy: 2.3212066310906936
Energy: 2.387186407602497
Energy: 2.3212066310906936
Energy: 2.0250526861192033
Energy: 1.637597827617158
Energy: 1.6163974815398143
Energy: 1.637597827617804
Energy: 2.025052686119849
Energy: 1.637597827617804
Energy: 1.6170756904529349
Energy: 1.7481916130078956
Energy: 1.6142686491390283
Energy: 1.7481916130085413
Energy: 1.6170756904529349
Energy: 1.7481916130085413
Energy: 1.6383482002066292
Energy: 1.6212173679061423
Energy: 1.7755517887702978
Energy: 1.621217367906788
Energy: 1.6383482002059833
Energy: 1.6212173679061423
Energy: 1.619035308813803
Energy: 1.6925417563989908
Energy: 2.077960115384235
Energy: 1.6925417563989908
Energy: 1.619035308814449
Energy: 1.6925417563989908
Energy: 1.771071705910529
Energy: 1.618437285345001
Energy: 1.7903513975122467
Energy: 1.618437285345001
Energy: 1.771071705909883
Energy: 1.6184372853443552
Energy: 1.6138238388882615
Energy: 1.7707865309049033
Energy: 1.8120094172442367
Energy: 1.770786530906195
Energy: 1.6138238388876158
Energy: 1.7707865309055493
Energy: 1.999606051131138
Energy: 1.6104739187401107
Energy: 1.6111530424933869
Energy: 1.6104739187388193
Energy: 1.999606051131138
Energy: 1.6104739187394652
Energy: 1.7996081165003612
Energy: 1.6224984417345671
Energy: 1.6409316868573718
Energy: 1.622498441735213
Energy: 1.7996081165010072
Energy: 1.622498441735213
Energy: 1.9879338821589334
Energy: 1.7300559482186333
Energy: 1.6143139828360304
Energy: 1.7300559482186333
Energy: 1.9879338821582877
Energy: 1.730055948219279
Energy: 1.756904405808486
Energy: 1.9258910277870596
Energy: 1.7548520880565912
Energy: 1.9258910277864139
Energy: 1.7569044058071943
Energy: 1.9258910277864139
Energy: 1.64138158878534
Energy: 1.915785816763755
Energy: 1.6257650754921804
Energy: 1.9157858167644006
Energy: 1.64138158878534
Energy: 1.915785816763755
Energy: 1.6191798891705211
Energy: 1.613578001314074
Energy: 2.0342919093268392
Energy: 1.613578001314074
Energy: 1.6191798891711668
Energy: 1.613578001314074
Energy: 1.6364276806210132
Energy: 1.9931894953976315
Energy: 2.318429164808632
Energy: 1.9931894953976315
Energy: 1.6364276806203673
Energy: 1.9931894953976315
Energy: 1.6457660848532971
Energy: 2.1332856316048154
Energy: 1.7550845182709427
Energy: 2.1332856316061073
Energy: 1.6457660848545888
Energy: 2.133285631605461
Energy: 1.7554464165589472
Energy: 1.9067209693835434
Energy: 1.6257190341573182
Energy: 1.9067209693816058
Energy: 1.7554464165589472
Energy: 1.9067209693822518
Energy: 1.7668666257545942
Energy: 1.894424403518509
Energy: 1.62518016143413
Energy: 1.8944244035204465
Energy: 1.7668666257552401
Energy: 1.8944244035204465
Energy: 2.3057164884684562
Energy: 1.996695135924721
Energy: 1.6521454668648698
Energy: 1.9966951359253666
Energy: 2.3057164884684562
Energy: 1.9966951359253666
Energy: 2.174978734229481
Energy: 1.6248332372419652
Energy: 1.625590499949068
Energy: 1.6248332372419652
Energy: 2.1749787342281897
Energy: 1.6248332372419652
Energy: 1.6139510649246942
Energy: 2.0157312845875386
Energy: 1.6140339268540986
Energy: 2.0157312845868924
Energy: 1.6139510649240483
Energy: 2.0157312845862467
Energy: 1.6257375083161079
Energy: 1.6244136383729446
Energy: 2.0463763957822465
Energy: 1.6244136383735903
Energy: 1.625737508316754
Energy: 1.6244136383729446
Energy: 1.651906175557167
Energy: 1.9966499176593544
Energy: 2.305713630144411
Energy: 1.9966499176600003
Energy: 1.651906175557167
Energy: 1.9966499176600003
Energy: 1.6389163899449766
Energy: 1.8946036717604786
Energy: 1.766772831518477
Energy: 1.894603671758541
Energy: 1.6389163899449766
Energy: 1.8946036717591868
Energy: 1.6257340095323125
Energy: 1.6244087512112344
Energy: 1.7556862405349662
Energy: 1.624408751212526
Energy: 1.6257340095316668
Energy: 1.62440875121188
Energy: 1.7554030146567126
Energy: 2.1335096581240167
Energy: 1.6264249378782205
Energy: 2.133509658122725
Energy: 1.7554030146580042
Energy: 2.133509658122725
Energy: 2.3184265250603326
Energy: 1.993203025924508
Energy: 1.6366146311886067
Energy: 1.993203025923862
Energy: 2.3184265250590412
Energy: 1.9932030259232163
Energy: 2.0345308939555693
Energy: 1.6136797911007221
Energy: 1.61915962754832
Energy: 1.6136797911007221
Energy: 2.0345308939200772
Energy: 1.6136797911013678
Energy: 1.6258945147229182
Energy: 1.9161827199274593
Energy: 1.6412934351685995
Energy: 1.9161827199274593
Energy: 1.6258945147222723
Energy: 1.9161827199268133
Energy: 1.7547391135763475
Energy: 1.9257219909374248
Energy: 1.7570133869206672
Energy: 1.9257219909380707
Energy: 1.7547391135769934
Energy: 1.9257219909374248
Energy: 1.6144312060549355
Energy: 1.6963038367733076
Energy: 1.9878656140866022
Energy: 1.6963038367733076
Energy: 1.6144312060549355
Energy: 1.6963038367733076
Energy: 1.6417168958163224
Energy: 1.6213305571074927
Energy: 1.7996054280072236
Energy: 1.621330557110076
Energy: 1.6417168958163224
Energy: 1.6213305571113676
Energy: 1.6110191480569578
Energy: 1.6105450626065683
Energy: 1.9995948775437595
Energy: 1.610545062603985
Energy: 1.6110191480569578
Energy: 1.6105450626052766
Energy: 1.8121111439198088
Energy: 1.7774914757882343
Energy: 1.613826051823671
Energy: 1.7774914757882343
Energy: 1.8121111439579136
Energy: 1.7774914757882343
Energy: 1.7902575703222925
Energy: 1.6182676235625837
Energy: 1.7709741129112297
Energy: 1.6182676235632296
Energy: 1.7902575703210009
Energy: 1.6182676235625837
Energy: 2.0779437003714194
Energy: 1.6925417563996366
Energy: 1.6190142838562336
Energy: 1.6925417563996366
Energy: 2.0779437003707737
Energy: 1.6925417563996366
Energy: 1.7754951129002878
Energy: 1.6212804766590345
Energy: 1.6379941812550785
Energy: 1.6212804766596804
Energy: 1.7754951129015795
Energy: 1.6212804766603262
Energy: 1.6138954154892748
Energy: 1.748171393002252
Energy: 1.617084975381777
Energy: 1.7481713930035436
Energy: 1.6138954154879832
Energy: 1.748171393002898
Energy: 1.6163878548775508
Energy: 1.6375802412437779
Energy: 2.0250626192932537
Energy: 1.6375802412450695
Energy: 1.6163878548775508
Energy: 1.6375802412450695
Energy: 2.0037127337596687
Energy: 2.3212066310900474
Energy: 2.387186407601205
Energy: 2.3212066310913393
Energy: 2.003712733759023
Energy: 2.3212066310913393
Energy: 1.6163974815385225
Energy: 1.6375978276158665
Energy: 2.025052686118557
Energy: 1.637597827617158
Energy: 1.6163974815398143
Energy: 1.637597827617158
Energy: 1.6142686491383824
Energy: 1.7481916130091872
Energy: 1.6170756904529349
Energy: 1.748191613010479
Energy: 1.6142686491377367
Energy: 1.748191613010479
Energy: 1.7755517887709436
Energy: 1.6212173679048505
Energy: 1.6383482002066292
Energy: 1.621217367906788
Energy: 1.775551788769652
Energy: 1.621217367906788
Energy: 2.0779601153829432
Energy: 1.6925417563996366
Energy: 1.6190353088118654
Energy: 1.6925417563989908
Energy: 2.0779601153835894
Energy: 1.6925417563996366

minimum gb energy = 1.6104739187388193 eV
minimum distance =  2.28658312500508 Angstroms
sigma value = 57


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

Energy: 1.8579162723632108
Energy: 2.2854186395580403
Energy: 2.0471889373097665
Energy: 2.285418639559092
Energy: 1.857916272362159
Energy: 2.285418639559092
Energy: 1.7576150234569015
Energy: 1.578753835124462
Energy: 1.5779195497887755
Energy: 1.578753835122359
Energy: 1.7576150234590047
Energy: 1.5787538351234105
Energy: 1.5696254488865893
Energy: 1.8001358712529412
Energy: 1.7282671788624753
Energy: 1.8001358712539925
Energy: 1.5696254488865893
Energy: 1.8001358712550442
Energy: 1.8703471225694364
Energy: 1.7749467978842115
Energy: 1.7722190768120425
Energy: 1.774946797888418
Energy: 1.8703471225704877
Energy: 1.7749467978842115
Energy: 1.5701084030332693
Energy: 1.6557165924445425
Energy: 1.8792065936577453
Energy: 1.6557165924498005
Energy: 1.5701084030332693
Energy: 1.6557165924498005
Energy: 1.7970439417339619
Energy: 1.7722692421731299
Energy: 1.772016614057401
Energy: 1.7722692421762845
Energy: 1.7970439417339619
Energy: 1.7722692421762845
Energy: 1.570079326975987
Energy: 1.7968751133018115
Energy: 1.5842900122810983
Energy: 1.7968751133039147
Energy: 1.5700793269770386
Energy: 1.7968751133039147
Energy: 1.5713017865047298
Energy: 1.6705408473380192
Energy: 1.5778843741966428
Energy: 1.670540847333813
Energy: 1.5713017865026266
Energy: 1.670540847333813
Energy: 1.8509799170947476
Energy: 1.5702028543310704
Energy: 1.583523153981027
Energy: 1.5702028543321218
Energy: 1.8509799170947476
Energy: 1.5702028543321218
Energy: 1.7190172620939257
Energy: 1.5789840316338992
Energy: 1.5817407952840126
Energy: 1.5789840316307446
Energy: 1.7190172620939257
Energy: 1.5789840316317962
Energy: 1.5701121740301516
Energy: 1.5687351925805832
Energy: 1.7779453354727646
Energy: 1.5687351925795316
Energy: 1.570112174031203
Energy: 1.5687351925805832
Energy: 1.6620785763395771
Energy: 1.7751882412569493
Energy: 1.7795968194344052
Energy: 1.7751882412590525
Energy: 1.6620785763406287
Energy: 1.7751882412590525
Energy: 1.5747043136170913
Energy: 1.799502170306942
Energy: 1.7758027659091717
Energy: 1.7995021703090452
Energy: 1.57470431361604
Energy: 1.7995021703079939
Energy: 1.804149577827639
Energy: 1.8651246362030454
Energy: 1.779512867182324
Energy: 1.8651246362040972
Energy: 1.804149577827639
Energy: 1.8651246362030454
Energy: 1.5762038720904727
Energy: 1.800255433257411
Energy: 1.5852461770373165
Energy: 1.800255433257411
Energy: 1.5762038720936278
Energy: 1.8002554332563594
Energy: 1.5718366394979864
Energy: 1.7026170863437875
Energy: 1.5815057264095613
Energy: 1.7026170863406325
Energy: 1.5718366394969345
Energy: 1.7026170863406325
Energy: 1.8460431070117003
Energy: 1.804992975689001
Energy: 1.582744761759974
Energy: 1.804992975696362
Energy: 1.8460431070106487
Energy: 1.8049929756953107
Energy: 1.8043264946831723
Energy: 1.8010796665775224
Energy: 1.5814947490384639
Energy: 1.8010796665754194
Energy: 1.8043264946873785
Energy: 1.8010796665754194
Energy: 1.5762593805044895
Energy: 1.569391645421814
Energy: 1.7822581922200031
Energy: 1.5693916454249688
Energy: 1.5762593805034382
Energy: 1.5693916454228656
Energy: 1.8077926242606626
Energy: 1.802919018870238
Energy: 1.7842398611779118
Energy: 1.8029190188754958
Energy: 1.807792624261714
Energy: 1.8029190188754958
Energy: 1.5732249639308484
Energy: 1.8014057395525664
Energy: 1.7721531411450475
Energy: 1.801405739553618
Energy: 1.5732249639308484
Energy: 1.801405739553618
Energy: 1.5701312291293843
Energy: 1.5695911155155007
Energy: 1.7722710356714455
Energy: 1.5695911155112943
Energy: 1.5701312291293843
Energy: 1.5695911155112943
Energy: 1.5726240845229396
Energy: 1.8033191371389237
Energy: 1.5842339991186805
Energy: 1.803319137137872
Energy: 1.5726240845229396
Energy: 1.8033191371389237
Energy: 1.8270205054065065
Energy: 1.8048781721929512
Energy: 1.5900349774107496
Energy: 1.8048781721950544
Energy: 1.8270205054075581
Energy: 1.8048781721940028
Energy: 1.8276783713402747
Energy: 1.8159664123094936
Energy: 1.585330694066399
Energy: 1.8159664123168548
Energy: 1.827678371339223
Energy: 1.8159664123168548
Energy: 1.5704322436964542
Energy: 1.7987055604114446
Energy: 1.5821095490188337
Energy: 1.798705560412496
Energy: 1.5704322436964542
Energy: 1.7987055604103928
Energy: 1.5722558680047058
Energy: 1.5688855233768348
Energy: 1.7835287914992881
Energy: 1.5688855233757832
Energy: 1.5722558680036542
Energy: 1.5688855233810413

minimum gb energy = 1.5687351925795316 eV
minimum distance =  2.34269058836363 Angstroms
sigma value = 43


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

Energy: 1.9395465370364136
Energy: 1.7301232899019852
Energy: 2.009966276498837
Energy: 1.7301232899019852
Energy: 1.9395465370379457
Energy: 1.7301232899012189
Energy: 1.7674227523408357
Energy: 1.7139539828277768
Energy: 1.6899710937129002
Energy: 1.7139539828270105
Energy: 1.7674227523416017
Energy: 1.7139539828270105
Energy: 1.7028905496336961
Energy: 1.8726935109878111
Energy: 1.9444247301320456
Energy: 1.8726935109885774
Energy: 1.7028905496344622
Energy: 1.8726935109885774
Energy: 1.969485832233799
Energy: 1.7041395378864987
Energy: 1.861128079891216
Energy: 1.7041395378864987
Energy: 1.969485832234565
Energy: 1.7041395378872648
Energy: 1.69969640696362
Energy: 1.7883950995395035
Energy: 1.86073645741432
Energy: 1.7883950995387374
Energy: 1.6996964069628537
Energy: 1.7883950995387374
Energy: 1.8384392644658645
Energy: 1.8608665813726086
Energy: 1.7209433022421488
Energy: 1.8608665813726086
Energy: 1.8384392644658645
Energy: 1.8608665813726086
Energy: 1.7223749397096955
Energy: 1.8416875022556134
Energy: 1.7123375032990922
Energy: 1.8416875022548473
Energy: 1.7223749397104615
Energy: 1.8416875022548473
Energy: 1.8946900281834147
Energy: 1.7903876302016666
Energy: 1.6903199146286905
Energy: 1.7903876302016666
Energy: 1.8946900281826484
Energy: 1.7903876302024326
Energy: 1.8551299728887263
Energy: 1.6981020673475493
Energy: 1.8728989514754948
Energy: 1.6981020673490819
Energy: 1.8551299728887263
Energy: 1.6981020673490819
Energy: 1.9701736054471937
Energy: 1.8666629447657739
Energy: 1.6992694651116218
Energy: 1.86666294476654
Energy: 1.9701736054464625
Energy: 1.86666294476654
Energy: 1.6985528260714993
Energy: 1.7837836241955138
Energy: 1.799700126989495
Energy: 1.7837836241955138
Energy: 1.698552826070733
Energy: 1.78378362419628
Energy: 1.7129136347737335
Energy: 1.725667288344518
Energy: 1.9320904423919543
Energy: 1.7256672883452844
Energy: 1.7129136347745
Energy: 1.7256672883452844
Energy: 1.7024777539384024
Energy: 1.7111602041464022
Energy: 1.8656816684593853
Energy: 1.711160204145636
Energy: 1.7024777539376361
Energy: 1.711160204145636
Energy: 1.8586585099689026
Energy: 1.6968121250561226
Energy: 1.697986116818787
Energy: 1.6968121250553563
Energy: 1.8586585099681365
Energy: 1.69681212505459
Energy: 1.8546501611363928
Energy: 2.0138820414521206
Energy: 1.7170053705978332
Energy: 2.0138820414528866
Energy: 1.8546501611371586
Energy: 2.0138820414528866
Energy: 1.83589785584557
Energy: 1.880150713701395
Energy: 1.703906501595792
Energy: 1.880150713701395
Energy: 1.835897855844804
Energy: 1.880150713701395
Energy: 1.7204000414577165
Energy: 1.7302062750083387
Energy: 1.8473553633766837
Energy: 1.7302062750083387
Energy: 1.7204000414584828
Energy: 1.7302062750083387
Energy: 1.711056877209488
Energy: 1.845815721194599
Energy: 1.7213106442747006
Energy: 1.845815721194599
Energy: 1.711056877208722
Energy: 1.845815721194599
Energy: 1.7030354911058225
Energy: 1.7204978272356575
Energy: 1.8546485692801906
Energy: 1.720497827237956
Energy: 1.7030354911058225
Energy: 1.720497827237956
Energy: 1.6972327756221268
Energy: 2.06335213279693
Energy: 1.8548778918200226
Energy: 2.063352132796164
Energy: 1.6972327756228929
Energy: 2.063352132796164
Energy: 1.7046008344543218
Energy: 1.873392490598468
Energy: 1.711301240492857
Energy: 1.8733924905977022
Energy: 1.7046008344543218
Energy: 1.8733924905977022
Energy: 1.8891152959207047
Energy: 1.7098373569973895
Energy: 1.704637627787191
Energy: 1.7098373569973895
Energy: 1.8891152959199384
Energy: 1.7098373569973895
Energy: 2.05850091391081
Energy: 2.029182879035276
Energy: 1.7111963632579914
Energy: 2.029182879036042
Energy: 2.058500913910044
Energy: 2.029182879036042
Energy: 1.697839092476403
Energy: 1.8741599108462623
Energy: 1.723690068522341
Energy: 1.8741599108462623
Energy: 1.697839092476403
Energy: 1.8741599108462623
Energy: 1.704537754774756
Energy: 2.0634718098778095
Energy: 1.854229104350449
Energy: 2.0634718098778095
Energy: 1.704537754774756
Energy: 2.063471809878576
Energy: 1.7164519317044544
Energy: 2.103641438198036
Energy: 1.8547707874500148
Energy: 2.103641438198036
Energy: 1.7164519317044544
Energy: 2.1036414381988027
Energy: 1.7046832307579363
Energy: 1.8735205684018863
Energy: 1.835906145839536
Energy: 1.8735205684018863
Energy: 1.7046832307587023
Energy: 1.8735205684034189
Energy: 1.8420863207834808
Energy: 2.287353455859114
Energy: 1.8526285809281935
Energy: 2.2873534558598796
Energy: 1.8420863207773512
Energy: 2.2873534558598796
Energy: 1.8365644961807108
Energy: 1.8735957201978235
Energy: 1.697379594261343
Energy: 1.8735957201978235
Energy: 1.8365644961814767
Energy: 1.8735957201978235
Energy: 1.8547034679658312
Energy: 2.1035788231469907
Energy: 1.7165378636088848
Energy: 2.1035788231469907
Energy: 1.8547034679658312
Energy: 2.103578823146225
Energy: 1.8544331021762244
Energy: 2.0634375095842716
Energy: 1.704529618024171
Energy: 2.0634375095850372
Energy: 1.854433102175458
Energy: 2.0634375095850372
Energy: 1.7237088898504633
Energy: 1.874107205083565
Energy: 1.6979758617661398
Energy: 1.8741072050850975
Energy: 1.7237088898519957
Energy: 1.8741072050850975
Energy: 1.7107725717562898
Energy: 2.0291480960061565
Energy: 2.0581846742042655
Energy: 2.0291480960069226
Energy: 1.7107725717562898
Energy: 2.0291480960069226
Energy: 1.705098298118512
Energy: 1.709845095704292
Energy: 1.8889462605626364
Energy: 1.709845095704292
Energy: 1.7050982981162135
Energy: 1.709845095704292
Energy: 1.7113846113295408
Energy: 1.8735305558379034
Energy: 1.7046485679934298
Energy: 1.8735305558386695
Energy: 1.7113846113287747
Energy: 1.8735305558379034
Energy: 1.854816679231235
Energy: 2.06336687256253
Energy: 1.704285588711681
Energy: 2.0633668725632957
Energy: 1.854816679232001
Energy: 2.0633668725632957

minimum gb energy = 1.6899710937129002 eV
minimum distance =  2.31034371731173 Angstroms
sigma value = 81


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

Energy: 1.8177189728188363
Energy: 1.8188427574834407
Energy: 1.824361066719598
Energy: 1.8188427574839847
Energy: 1.8177189728194116
Energy: 1.8188427574834407
Energy: 1.831834401751116
Energy: 1.8186906015985413
Energy: 1.817779268627575
Energy: 1.8186906015985413
Energy: 1.8318344018878436
Energy: 1.8186906015985413
Energy: 1.8177463971191985
Energy: 1.8185902187693934
Energy: 2.306593470407227
Energy: 1.8185902187696814
Energy: 1.8177463971194865
Energy: 1.8185902187699692
Energy: 1.824361066719598
Energy: 1.8188427574839847
Energy: 1.8177189728196999
Energy: 1.8188427574848485
Energy: 1.8243610667221573
Energy: 1.8188427574834407
Energy: 1.8177792686278627
Energy: 1.8186906015979973
Energy: 1.831834402231711
Energy: 1.8186906015979973
Energy: 1.817779268628119
Energy: 1.8186906015982856
Energy: 2.3065934704074826
Energy: 1.8185902187693934
Energy: 1.8177463971191985
Energy: 1.8185902187702574
Energy: 2.3065934704074826
Energy: 1.8185902187699692
Energy: 1.8177189728194116
Energy: 1.8188427574836967
Energy: 1.8243610667207497
Energy: 1.8188427574834407
Energy: 1.817718972819124
Energy: 1.8188427574836967
Energy: 1.8318344017502521
Energy: 1.8186906015985413
Energy: 1.8177792686272871
Energy: 1.8186906015974216
Energy: 1.8318344017418067
Energy: 1.8186906015985413
Energy: 1.8177463971191985
Energy: 1.8185902187696814
Energy: 1.9749211159329414
Energy: 1.8185902187702574
Energy: 1.8177463971191985
Energy: 1.8185902187696814
Energy: 1.8243610667210057
Energy: 1.818842757482865
Energy: 1.8177189728196999
Energy: 1.818842757482865
Energy: 1.8243610667184782
Energy: 1.8188427574836967

minimum gb energy = 1.8177189728188363 eV
minimum distance =  2.28418329192301 Angstroms
sigma value = 3


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

Energy: 2.269696719457949
Energy: 2.2399487172480117
Energy: 2.358081271492622
Energy: 2.2399487172480117
Energy: 2.269696719460476
Energy: 2.2399487172480117
Energy: 1.6540154787878025
Energy: 1.8417291011635737
Energy: 1.636533716627203
Energy: 1.8417291011627313
Energy: 1.6540154787835903
Energy: 1.8417291011627313
Energy: 1.6612696920729282
Energy: 1.662596649570907
Energy: 1.700594329694385
Energy: 1.6625966495700646
Energy: 1.6612696920729282
Energy: 1.6625966495700646
Energy: 1.6769164596995088
Energy: 2.2303601525977577
Energy: 1.8353407109073445
Energy: 2.2303601525977577
Energy: 1.6769164596978237
Energy: 2.2303601525977577
Energy: 1.796210740344728
Energy: 1.807326340265138
Energy: 1.755723137953584
Energy: 1.8073263402659805
Energy: 1.796210740344728
Energy: 1.8073263402659805
Energy: 1.9398395256367054
Energy: 1.7343903241365914
Energy: 1.6334806591289224
Energy: 1.734390324135749
Energy: 1.9398395256367054
Energy: 1.734390324135749
Energy: 1.7962127944484003
Energy: 1.848381078628281
Energy: 1.8226416765914388
Energy: 1.8483810786274388
Energy: 1.7962127944484003
Energy: 1.8483810786274388
Energy: 1.791874167061939
Energy: 2.205946893382913
Energy: 1.827751385101167
Energy: 2.2059468933821083
Energy: 1.791874167061939
Energy: 2.2059468933821083
Energy: 1.6606992186200558
Energy: 1.6635529221911325
Energy: 1.9473796534216792
Energy: 1.6635529221919747
Energy: 1.6606992186192135
Energy: 1.6635529221919747
Energy: 1.6714695774580068
Energy: 1.856594687808431
Energy: 1.6359041698997394
Energy: 1.8565946878101158
Energy: 1.6714695774563217
Energy: 1.8565946878092734
Energy: 2.2538368342895465
Energy: 1.813692997332946
Energy: 1.8163431793430724
Energy: 1.8136929973321034
Energy: 2.253836834288704
Energy: 1.8136929973321034
Energy: 2.225180486144263
Energy: 1.875009410089783
Energy: 1.635871507093451
Energy: 1.8750094100914678
Energy: 2.225180486143421
Energy: 1.8750094100914678
Energy: 1.6605021792684973
Energy: 1.9092214104408576
Energy: 1.6477021118943447
Energy: 1.9092214104425422
Energy: 1.6605021792693397
Energy: 1.9092214104425422
Energy: 1.6693704397256626
Energy: 1.8273311753975194
Energy: 1.8135850520935564
Energy: 1.8273311753975194
Energy: 1.6693704397256626
Energy: 1.827331175396677
Energy: 1.7912699511898849
Energy: 1.8754529659904267
Energy: 1.8143656761287945
Energy: 1.8754529659904267
Energy: 1.7912699511907273
Energy: 1.8754529659904267
Energy: 1.787552143610189
Energy: 1.6710064476713156
Energy: 1.6324341516522323
Energy: 1.6710064476713156
Energy: 1.7875521436110315
Energy: 1.6710064476713156
Energy: 1.7916230539892142
Energy: 1.6665825516718558
Energy: 1.634865147001069
Energy: 1.6665825516676434
Energy: 1.7916230539900564
Energy: 1.6665825516676434
Energy: 1.791453899161674
Energy: 1.8546811539625496
Energy: 1.8144273857569846
Energy: 1.8546811539625496
Energy: 1.791453899161674
Energy: 1.854681153963392
Energy: 1.6640574616931665
Energy: 1.9155469978854576
Energy: 1.8138651495769487
Energy: 1.915546997883773
Energy: 1.6640574616940087
Energy: 1.915546997883773
Energy: 1.6610518938669554
Energy: 1.8775034591567537
Energy: 1.6360341375608334
Energy: 1.8775034591542266
Energy: 1.661051893866113
Energy: 1.8775034591542266
Energy: 2.1312740181708465
Energy: 1.8219881284662502
Energy: 1.6362375607867021
Energy: 1.8219881284654078
Energy: 2.1312740181708465
Energy: 1.8219881284654078
Energy: 2.1317925197240455
Energy: 1.8964047885940654
Energy: 1.8133571260528263
Energy: 1.8964047885940654
Energy: 2.1317925197240455
Energy: 1.8964047885940654
Energy: 1.6622517042410578
Energy: 1.8563766770670356
Energy: 1.6357793865356112
Energy: 1.8563766770670356
Energy: 1.6622517042410578
Energy: 1.8563766770670356
Energy: 1.6609576525645036
Energy: 1.6656664846777798
Energy: 2.0867703078111264
Energy: 1.6656664846777798
Energy: 1.660957652565346
Energy: 1.6656664846777798
Energy: 1.7918853552285456
Energy: 1.854188826323677
Energy: 1.8125679820552263
Energy: 1.8541888263228348
Energy: 1.7918853552285456
Energy: 1.8541888263228348
Energy: 1.7960191200706423
Energy: 1.904260184820941
Energy: 1.7278392615837608
Energy: 1.9042601848200986
Energy: 1.7960191200698
Energy: 1.9042601848200986
Energy: 1.7911490108242312
Energy: 1.6778409196803699
Energy: 1.6317423400915496
Energy: 1.6778409196803699
Energy: 1.7911490108242312
Energy: 1.677840919681174
Energy: 1.7960280509544264
Energy: 1.8119747772456767
Energy: 1.9404377067137115
Energy: 1.8119747772439916
Energy: 1.7960280509544264
Energy: 1.8119747772439916
Energy: 1.725343707415427
Energy: 1.9510835938713444
Energy: 1.8260019707443675
Energy: 1.9510835938780842
Energy: 1.7253437074162694
Energy: 1.9510835938688174
Energy: 1.661666515027168
Energy: 1.6701766045909947
Energy: 2.087074227026179
Energy: 1.6701766045918371
Energy: 1.6616665150280103
Energy: 1.6701766045918371
Energy: 1.9130481566893105
Energy: 1.8452336805787175
Energy: 1.636719123504992
Energy: 1.845233680577875
Energy: 1.9130481566876256
Energy: 1.8452336805770322
Energy: 2.254117742961068
Energy: 1.9495935594466713
Energy: 1.6741605208477073
Energy: 1.9495935594449865
Energy: 2.2541177429593833
Energy: 1.9495935594458291
Energy: 2.034602921935568
Energy: 1.8441078074772879
Energy: 1.6359917138319247
Energy: 1.8441078074781303
Energy: 2.0346029219372523
Energy: 1.8441078074781303

minimum gb energy = 1.6317423400915496 eV
minimum distance =  2.24273494253852 Angstroms
sigma value = 67


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

Energy: 1.803196633491468
Energy: 1.6252525333358234
Energy: 2.2044772278732503
Energy: 1.625252533334623
Energy: 1.8031966334890672
Energy: 1.6252525333334227
Energy: 1.517572891846612
Energy: 1.75292512950373
Energy: 1.5116024112896518
Energy: 1.7529251295025297
Energy: 1.5175728918502132
Energy: 1.7529251295025297
Energy: 1.511397776544442
Energy: 1.606441289009608
Energy: 1.909761652131328
Energy: 1.6064412890072073
Energy: 1.5113977765456426
Energy: 1.6064412890084079
Energy: 2.1051971985538507
Energy: 2.0244509200847327
Energy: 1.723571901598473
Energy: 2.0244509200871335
Energy: 2.1051971985538507
Energy: 2.0244509200871335
Energy: 1.7217588216846824
Energy: 2.3078387278952572
Energy: 1.592051240865566
Energy: 2.3078387278976575
Energy: 1.7217588216834823
Energy: 2.3078387278976575
Energy: 1.723042822338725
Energy: 1.5196456315574547
Energy: 1.5001556635013977
Energy: 1.5196456315574547
Energy: 1.723042822338725
Energy: 1.5196456315574547
Energy: 1.5002131174363518
Energy: 1.5296873855553559
Energy: 1.525498721070081
Energy: 1.5296873855577564
Energy: 1.5002131174375521
Energy: 1.5296873855577564
Energy: 1.7411262015858144
Energy: 2.0249472460538374
Energy: 2.3280035816074163
Energy: 2.0249472460550377
Energy: 1.7411262015858144
Energy: 2.0249472460550377
Energy: 1.7405703452518617
Energy: 1.5235695545098176
Energy: 2.3334838432499727
Energy: 1.523569554511018
Energy: 1.7405703452518617
Energy: 1.523569554511018
Energy: 1.739647618114772
Energy: 1.5276581183600895
Energy: 1.520108734498086
Energy: 1.5276581183588889
Energy: 1.739647618114772
Energy: 1.5276581183588889
Energy: 1.7226144228976854
Energy: 1.5244702735815685
Energy: 1.531347603040494
Energy: 1.5244702735815685
Energy: 1.7226144228988856
Energy: 1.5244702735815685
Energy: 1.7222005008899883
Energy: 1.63004404808941
Energy: 1.7223785354705983
Energy: 1.6300440480870093
Energy: 1.7222005008911887
Energy: 1.6300440480870093
Energy: 1.5234034924747415
Energy: 1.5257158161869018
Energy: 1.7219725961869885
Energy: 1.5257158161893027
Energy: 1.5234034924747415
Energy: 1.5257158161893027
Energy: 1.5206777158394267
Energy: 1.5257802226616863
Energy: 1.7402547207625811
Energy: 1.525780222662887
Energy: 1.5206777158394267
Energy: 1.5257802226616863
Energy: 2.2401475123967183
Energy: 1.8328269555617323
Energy: 1.7400446653090478
Energy: 1.8328269555617323
Energy: 2.240147512399119
Energy: 1.8328269555617323
Energy: 2.2338016893942627
Energy: 1.8583668408345586
Energy: 1.7408413157390563
Energy: 1.8583668408321579
Energy: 2.233801689393062
Energy: 1.8583668408321579
Energy: 1.51682837696799
Energy: 1.5324198653828969
Energy: 1.5035021925959082
Energy: 1.5324198653804961
Energy: 1.516828376965589
Energy: 1.5324198653804961
Energy: 1.5046131153589488
Energy: 1.5286157683014576
Energy: 1.7375339880927263
Energy: 1.528615768302658
Energy: 1.5046131153565478
Energy: 1.5286157683014576
Energy: 1.5443888002957165
Energy: 1.7623137632791945
Energy: 1.7234962082627323
Energy: 1.7623137632791945
Energy: 1.5443888003053197
Energy: 1.7623137632791945
Energy: 1.7238281223007503
Energy: 1.5338317842704894
Energy: 2.0824848571746637
Energy: 1.5338317842716898
Energy: 1.7238281223007503
Energy: 1.5338317842728901
Energy: 2.133408492701861
Energy: 1.8175538439786063
Energy: 1.499024270702106
Energy: 1.8175538439798067
Energy: 2.133408492701861
Energy: 1.817553843981007
Energy: 1.5151768036628719
Energy: 1.746022584463899
Energy: 1.6038260131902162
Energy: 1.7460225844626984
Energy: 1.5151768036616715
Energy: 1.7460225844626984
Energy: 2.2044772278720495
Energy: 2.377217496268048
Energy: 1.5583532332496042
Energy: 2.3772174962692483
Energy: 2.2044772278732503
Energy: 2.3772174962692483

minimum gb energy = 1.499024270702106 eV
minimum distance =  2.26238162298783 Angstroms
sigma value = 33


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

Energy: 1.9493803012503619
Energy: 1.360532945096408
Energy: 2.1414885737554648
Energy: 1.3605329450971693
Energy: 1.9493803012511235
Energy: 1.3605329450971693
Energy: 2.0577759342127453
Energy: 1.9307360998239353
Energy: 1.340792183998355
Energy: 1.9307360998239353
Energy: 2.0577759342142685
Energy: 1.9307360998239353
Energy: 1.3483650142734622
Energy: 1.4639858341114125
Energy: 2.1066917211181826
Energy: 1.4639858341106509
Energy: 1.3483650142727008
Energy: 1.4639858341106509
Energy: 1.4602250961047922
Energy: 1.6242548844962381
Energy: 1.352142202105732
Energy: 1.6242548844977611
Energy: 1.4602250961040308
Energy: 1.6242548844977611
Energy: 1.8786952069318974
Energy: 1.3497396355676985
Energy: 1.8817840574174258
Energy: 1.3497396355669369
Energy: 1.8786952069303742
Energy: 1.3497396355669369
Energy: 1.8773010095703355
Energy: 1.6606155143710808
Energy: 1.3454221893721294
Energy: 1.6606155143718424
Energy: 1.8773010095695741
Energy: 1.6606155143718424
Energy: 1.3507678943232624
Energy: 1.379128169365409
Energy: 1.3769256324972399
Energy: 1.379128169366932
Energy: 1.3507678943232624
Energy: 1.379128169366932
Energy: 1.381783959759231
Energy: 1.3477196362134802
Energy: 1.8771508237224148
Energy: 1.3477196362142416
Energy: 1.3817839597599921
Energy: 1.3477196362142416
Energy: 1.8863244629301472
Energy: 1.7437285883659752
Energy: 1.8811527865960669
Energy: 1.7437285883659752
Energy: 1.8863244629301472
Energy: 1.7437285883659752
Energy: 1.3473111128378865
Energy: 1.3705868198643678
Energy: 1.3428146455695076
Energy: 1.3705868198658908
Energy: 1.3473111128378865
Energy: 1.3705868198658908
Energy: 1.3369073457731564
Energy: 1.3794979601916437
Energy: 1.3787792892598405
Energy: 1.379497960190121
Energy: 1.3369073457723946
Energy: 1.379497960190121
Energy: 1.3367170795222971
Energy: 1.473133722855747
Energy: 2.077282470012818
Energy: 1.473133722855747
Energy: 1.3367170795245815
Energy: 1.473133722855747
Energy: 1.9340393367336404
Energy: 1.8590987517046444
Energy: 1.9186807645020099
Energy: 1.8590987516916988
Energy: 1.9340393367336404
Energy: 1.8590987516551811
Energy: 1.3408253660547604
Energy: 1.9473534854094656
Energy: 1.3565015308008517
Energy: 1.9473534854094656
Energy: 1.3408253660555218
Energy: 1.9473534854094656
Energy: 1.8819668166606796
Energy: 1.4620125561554849
Energy: 1.3486457763709914
Energy: 1.4620125561539616
Energy: 1.8819668166614414
Energy: 1.462012556154723
Energy: 1.3520590209200765
Energy: 1.8960500119873704
Energy: 2.0605944719440132
Energy: 1.8960500119873704
Energy: 1.3520590209200765
Energy: 1.8960500119873704
Energy: 2.1431950550109087
Energy: 1.3476768591421882
Energy: 1.905569327904666
Energy: 1.3476768591429495
Energy: 2.1431950550101466
Energy: 1.3476768591429495
Energy: 1.349447002286999
Energy: 1.3802405804226632
Energy: 1.7128644785161005
Energy: 1.3802405804234248
Energy: 1.349447002285476
Energy: 1.3802405804226632
Energy: 1.7338255208856839
Energy: 1.3818236958413186
Energy: 1.348834939341814
Energy: 1.3818236958413186
Energy: 1.7338255208856839
Energy: 1.3818236958413186
Energy: 1.8770107609830489
Energy: 1.3492235666021972
Energy: 1.3781137174402298
Energy: 1.3492235666037202
Energy: 1.877010760981526
Energy: 1.3492235666044818
Energy: 2.0550681953376175
Energy: 1.7205882988692474
Energy: 1.3488126806245782
Energy: 1.7205882988684857
Energy: 2.0550681953376175
Energy: 1.7205882988684857
Energy: 1.3494996499034333
Energy: 1.3793084286910062
Energy: 1.8818121095996743
Energy: 1.3793084286910062
Energy: 1.3494996499041947
Energy: 1.3793084286910062
Energy: 1.3852085493981579
Energy: 1.3797322254966393
Energy: 1.348634966481824
Energy: 1.379732225497401
Energy: 1.3852085493981579
Energy: 1.379732225497401
Energy: 1.9176101276852202
Energy: 1.4730287644233628
Energy: 1.3485817190977845
Energy: 1.4730287644218398
Energy: 1.917610127684459
Energy: 1.4730287644226014
Energy: 2.077897271866699
Energy: 1.4720910882679747
Energy: 1.3366790329633833
Energy: 1.4720910882687364
Energy: 2.077897271866699
Energy: 1.4720910882687364
Energy: 1.3810074235078749
Energy: 1.721674457055723
Energy: 1.3368257616910721
Energy: 1.721674457055723
Energy: 1.3810074235071135
Energy: 1.721674457055723
Energy: 1.350304251682586
Energy: 1.378871878236484
Energy: 1.8860492309727053
Energy: 1.378871878236484
Energy: 1.3503042516833474
Energy: 1.378871878236484
Energy: 1.8770987025128762
Energy: 1.720480395329418
Energy: 1.3469555916189668
Energy: 1.720480395329418
Energy: 1.8770987025128762
Energy: 1.720480395329418
Energy: 1.8787786323310072
Energy: 1.3478553640396749
Energy: 1.386852629380162
Energy: 1.3478553640396749
Energy: 1.8787786323294842
Energy: 1.3478553640396749
Energy: 1.3799040816097692
Energy: 1.3792455221666156
Energy: 1.3496001228154997
Energy: 1.3792455221666156
Energy: 1.3799040816105308
Energy: 1.3792455221666156
Energy: 1.350835337947054
Energy: 1.6612433677337064
Energy: 2.0907804417932514
Energy: 1.661243367734468
Energy: 1.3508353379462923
Energy: 1.6612433677337064
Energy: 1.6168503567952335
Energy: 1.3570142081823806
Energy: 1.8768527089866738
Energy: 1.3570142081816194
Energy: 1.6168503567967565
Energy: 1.3570142081823806
Energy: 1.3489743773548717
Energy: 1.8941161463183742
Energy: 1.970435284306509
Energy: 1.8941161463176124
Energy: 1.3489743773548717
Energy: 1.8941161463176124
Energy: 2.050052294297328
Energy: 1.4632228098196733
Energy: 1.349632738263083
Energy: 1.4632228098196733
Energy: 2.0500522942958046
Energy: 1.4632228098196733
Energy: 1.337706519689671
Energy: 1.9325298847763246
Energy: 1.989698061270312
Energy: 1.9325298847748014
Energy: 1.337706519688148
Energy: 1.9325298847755632
Energy: 1.9339324531894218
Energy: 1.3595212347622638
Energy: 1.9166815412275509
Energy: 1.3595212347630254
Energy: 1.9339324531894218
Energy: 1.3595212347630254
Energy: 1.3487309408469228
Energy: 1.7183030085404978
Energy: 2.0568220377385575
Energy: 1.7183030085412592
Energy: 1.3487309408461614
Energy: 1.7183030085412592

minimum gb energy = 1.3366790329633833 eV
minimum distance =  2.27157162507657 Angstroms
sigma value = 41


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

Energy: 1.0533151687991884
Energy: 1.0202685985825481
Energy: 2.127274413923438
Energy: 1.0202685985804691
Energy: 1.0533151687991884
Energy: 1.0202685985825481
Energy: 2.1531781817315836
Energy: 1.0185787271335043
Energy: 1.018407340630327
Energy: 1.0185787271335043
Energy: 2.1531781817315836
Energy: 1.0185787271314255
Energy: 1.0549797904911593
Energy: 1.3058832607109527
Energy: 1.5454711187171186
Energy: 1.3058832607109527
Energy: 1.0549797904911593
Energy: 1.3058832607130322
Energy: 2.2199110109340525
Energy: 1.0184911443213025
Energy: 1.0184063144466364
Energy: 1.0184911443213025
Energy: 2.219911010950639
Energy: 1.0184911443213025
Energy: 1.0536581800320137
Energy: 1.0201666707144132
Energy: 1.0191932847664298
Energy: 1.0201666707144132
Energy: 1.0536581800320137
Energy: 1.020166670712334
Energy: 1.0536566159238019
Energy: 1.0964533322548198
Energy: 1.0186535306273723
Energy: 1.0964533322548198
Energy: 1.0536566159238019
Energy: 1.0964533322548198
Energy: 2.2182791665318073
Energy: 1.0192172059275342
Energy: 1.0192249742428703
Energy: 1.0192172059296134
Energy: 2.218279166546361
Energy: 1.0192172059296134
Energy: 1.0530757623173452
Energy: 1.019322617200736
Energy: 1.0187102285711747
Energy: 1.019322617200736
Energy: 1.053075762315266
Energy: 1.0193226172028151
Energy: 2.1180223589201215
Energy: 1.0966266464966004
Energy: 1.0191229033702975
Energy: 1.0966266464986796
Energy: 2.1180223589201215
Energy: 1.0966266464986796
Energy: 1.053867719661705
Energy: 1.0190626151988613
Energy: 1.019380303816321
Energy: 1.0190626151988613
Energy: 1.053867719661705
Energy: 1.0190626151988613
Energy: 2.124989143706394
Energy: 1.0188523179102225
Energy: 1.0190412778185374
Energy: 1.0188523179081432
Energy: 2.124989143706394
Energy: 1.0188523179102225
Energy: 1.0546729166315623
Energy: 1.307200777298247
Energy: 2.090034536869434
Energy: 1.3072007772920096
Energy: 1.0546729166315623
Energy: 1.3072007772899306
Energy: 2.125039194509894
Energy: 1.0188493985862004
Energy: 1.0190111844465797
Energy: 1.0188493985841214
Energy: 2.125039194509894
Energy: 1.0188493985841214
Energy: 1.0539144482115765
Energy: 1.0189686928416557
Energy: 1.0193982397586931
Energy: 1.0189686928416557
Energy: 1.0539144482115765
Energy: 1.0189686928416557

minimum gb energy = 1.0184063144466364 eV
minimum distance =  2.39772188665847 Angstroms
sigma value = 11


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

Energy: 1.771184105341686
Energy: 1.5160322019817254
Energy: 1.5230074123454518
Energy: 1.516032201980812
Energy: 1.7711841053425994
Energy: 1.5160322019826387
Energy: 1.5039470575243397
Energy: 1.643529104221703
Energy: 1.5014903502654298
Energy: 1.643529104221703
Energy: 1.503947057525253
Energy: 1.6435291042226166
Energy: 1.4881728964237475
Energy: 1.5217421526333959
Energy: 1.5023965725343054
Energy: 1.5217421526333959
Energy: 1.4881728964237475
Energy: 1.5217421526333959
Energy: 1.5224865600381612
Energy: 1.5220741580020132
Energy: 1.506095666821863
Energy: 1.5220741580011001
Energy: 1.5224865600381612
Energy: 1.5220741580011001
Energy: 1.6518653938502688
Energy: 1.629669998037557
Energy: 1.522724762780095
Energy: 1.6296699980393838
Energy: 1.6518653938502688
Energy: 1.6296699980393838
Energy: 1.5561876572471036
Energy: 1.5221951532023434
Energy: 1.5023696332474956
Energy: 1.5221951532005167
Energy: 1.5561876572471036
Energy: 1.5221951532005167
Energy: 1.521491344784049
Energy: 1.601719406968531
Energy: 1.5565115143035555
Energy: 1.601719406968531
Energy: 1.5214913447831353
Energy: 1.601719406968531
Energy: 1.5018520475715182
Energy: 1.5301762667336087
Energy: 1.4906105494914061
Energy: 1.5301762667345222
Energy: 1.5018520475715182
Energy: 1.5301762667345222
Energy: 1.490882397169694
Energy: 1.597088108513383
Energy: 1.4906294560464848
Energy: 1.597088108513383
Energy: 1.490882397169694
Energy: 1.5970881085142963
Energy: 1.5049539982778486
Energy: 1.5223019428031905
Energy: 1.5226816104376775
Energy: 1.5223019428041036
Energy: 1.5049539982787619
Energy: 1.5223019428031905
Energy: 1.5171804337445116
Energy: 1.4877542672601523
Energy: 1.52699054763567
Energy: 1.4877542672592388
Energy: 1.5171804337435983
Energy: 1.4877542672592388
Energy: 1.5014588713251826
Energy: 1.5024057335572711
Energy: 1.5270680225344853
Energy: 1.502405733559098
Energy: 1.5014588713260961
Energy: 1.502405733559098
Energy: 1.5015376498395456
Energy: 1.5214025922498895
Energy: 1.5121483735657204
Energy: 1.5214025922517163
Energy: 1.5015376498395456
Energy: 1.5214025922517163
Energy: 1.521809991518501
Energy: 1.588191201979117
Energy: 1.5208733010737598
Energy: 1.5881912019800306
Energy: 1.521809991518501
Energy: 1.5881912019800306
Energy: 1.5083109494170988
Energy: 1.8543796886471884
Energy: 1.50218460131075
Energy: 1.8543796886471884
Energy: 1.5083109494170988
Energy: 1.8543796886462751
Energy: 1.5221839762839668
Energy: 1.5023404874438957
Energy: 1.5607160949490622
Energy: 1.5023404874448092
Energy: 1.5221839762839668
Energy: 1.5023404874448092
Energy: 1.5596408401891546
Energy: 1.6287601525400908
Energy: 1.5013387487291399
Energy: 1.628760152470696
Energy: 1.5596408401891546
Energy: 1.628760152436009
Energy: 1.651180734109314
Energy: 1.6911651576791897
Energy: 1.5055482780585798
Energy: 1.6911651576791897
Energy: 1.651180734109314
Energy: 1.6911651576791897
Energy: 1.5256786960393598
Energy: 1.5226002434988604
Energy: 1.5215558694565512
Energy: 1.5226002434997736
Energy: 1.525678696040273
Energy: 1.522600243500687
Energy: 1.4944620285423478
Energy: 1.5229957126268248
Energy: 1.5012813734116923
Energy: 1.5229957126268248
Energy: 1.4944620285432608
Energy: 1.5229957126268248
Energy: 1.6975523291598034
Energy: 1.6466745887833145
Energy: 1.5013163021159064
Energy: 1.6466745887824012
Energy: 1.6975523291607169
Energy: 1.6466745887814878
Energy: 1.5556906702453095
Energy: 1.5043876249801706
Energy: 1.5221748622353821
Energy: 1.5043876249792572
Energy: 1.5556906702453095
Energy: 1.5043876249792572
Energy: 1.5208340444811341
Energy: 1.5215876043133727
Energy: 1.6895220382109133
Energy: 1.5215876043133727
Energy: 1.5208340444811341
Energy: 1.5215876043133727
Energy: 1.4876230575812475
Energy: 1.5858988544422103
Energy: 1.4892177142610563
Energy: 1.585898854444037
Energy: 1.4876230575812475
Energy: 1.585898854443124
Energy: 1.4907229060296523
Energy: 1.5229293994506419
Energy: 1.5028085419180874
Energy: 1.5229293994515554
Energy: 1.4907229060305658
Energy: 1.5229293994515554
Energy: 1.5589151609576297
Energy: 1.6290127685326838
Energy: 1.5345301110550935
Energy: 1.6290127685345104
Energy: 1.5589151609576297
Energy: 1.6290127685345104
Energy: 1.6516092874424775
Energy: 1.5079969950417116
Energy: 1.6512739170405808
Energy: 1.5079969950417116
Energy: 1.651609287443391
Energy: 1.5079969950417116
Energy: 1.5287364637754468
Energy: 1.5048544479825094
Energy: 1.5560707070402988
Energy: 1.5048544479834227
Energy: 1.5287364637754468
Energy: 1.5048544479834227
Energy: 1.5050739762002527
Energy: 1.5219593191024015
Energy: 1.5209916874858558
Energy: 1.5219593191033147
Energy: 1.505073976201166
Energy: 1.5219593191033147
Energy: 1.5050759073389455
Energy: 1.522855302176603
Energy: 1.488964443640546
Energy: 1.522855302176603
Energy: 1.5050759073389455
Energy: 1.522855302176603
Energy: 1.5050064294250363
Energy: 1.63451554125116
Energy: 1.488988347548393
Energy: 1.6345155412420473
Energy: 1.5050064294250363
Energy: 1.634515541236567

minimum gb energy = 1.4876230575812475 eV
minimum distance =  2.25660657121569 Angstroms
sigma value = 57


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

Energy: 1.7491457693833916
Energy: 1.7492564631150906
Energy: 1.992626443763626
Energy: 1.7492564631150906
Energy: 1.7491457693833916
Energy: 1.749256463116716
Energy: 1.6603501955800701
Energy: 1.7573397382408669
Energy: 1.6623314603004575
Energy: 1.7573397382408669
Energy: 1.6603501955784448
Energy: 1.7573397382408669
Energy: 1.6544200079015727
Energy: 1.8215856273801994
Energy: 1.6621469028135816
Energy: 1.8215856273801994
Energy: 1.6544200079015727
Energy: 1.8215856273801994
Energy: 1.6628649946743153
Energy: 1.6629557164512856
Energy: 1.662914339224436
Energy: 1.662955716452911
Energy: 1.6628649946743153
Energy: 1.6629557164512856
Energy: 1.6621533170898042
Energy: 1.8216174341529818
Energy: 1.6546156315746012
Energy: 1.8216174341529818
Energy: 1.6621533170898042
Energy: 1.8216174341546072
Energy: 1.6623908279106947
Energy: 1.6639729944860895
Energy: 1.6602974181728463
Energy: 1.6639729944844643
Energy: 1.6623908279090696
Energy: 1.6639729944844643
Energy: 1.937532116996667
Energy: 1.7492564631183414
Energy: 1.749145769385017
Energy: 1.7492564631150906
Energy: 1.937532116996667
Energy: 1.749256463116716
Energy: 1.6623314603004575
Energy: 1.7573397382408669
Energy: 1.6603501955784448
Energy: 1.7573397382392415
Energy: 1.6623314603004575
Energy: 1.7573397382392415
Energy: 1.662146902815207
Energy: 1.8215856273801994
Energy: 1.6544200079015727
Energy: 1.8215856273801994
Energy: 1.6621469028135816
Energy: 1.8215856273801994
Energy: 1.662914339222811
Energy: 1.774574640515478
Energy: 1.6628649946743153
Energy: 1.7745746405138527
Energy: 1.662914339222811
Energy: 1.6629557164512856
Energy: 1.6546156315729759
Energy: 1.8216174341529818
Energy: 1.6621533170898042
Energy: 1.8216174341529818
Energy: 1.6546156315746012
Energy: 1.8216174341529818
Energy: 1.6602974181744716
Energy: 1.6639729944844643
Energy: 1.6623908279090696
Energy: 1.6639729944844643
Energy: 1.6602974181744716
Energy: 1.6639729944860895
Energy: 1.7491457693833916
Energy: 1.749256463116716
Energy: 1.9375321169950417
Energy: 1.749256463116716
Energy: 1.7491457693833916
Energy: 1.749256463116716
Energy: 1.6603501955800701
Energy: 1.7573397382408669
Energy: 1.6623314603004575
Energy: 1.7573397382392415
Energy: 1.6603501955800701
Energy: 1.7573397382408669
Energy: 1.6544200079015727
Energy: 1.8215856273801994
Energy: 1.6621469028135816
Energy: 1.8215856273801994
Energy: 1.6544200079015727
Energy: 1.8215856273801994
Energy: 1.6628649946726899
Energy: 1.9731095524886422
Energy: 1.662914339224436
Energy: 1.774574640515478
Energy: 1.6628649946726899
Energy: 1.9731095524902675
Energy: 1.6621533170898042
Energy: 1.8216174341529818
Energy: 1.6546156315746012
Energy: 1.8216174341529818
Energy: 1.6621533170898042
Energy: 1.8216174341529818

minimum gb energy = 1.6544200079015727 eV
minimum distance =  2.27202252126855 Angstroms
sigma value = 9


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

Energy: 1.791237893784072
Energy: 2.071730830077402
Energy: 1.9282892809209486
Energy: 2.071730830076075
Energy: 1.7912378937853992
Energy: 2.071730830077402
Energy: 1.7113043426599024
Energy: 1.9354944043001971
Energy: 1.8781126303882247
Energy: 1.9354944043015243
Energy: 1.7113043426599024
Energy: 1.9354944043001971
Energy: 1.8909920523462853
Energy: 2.0106709213659113
Energy: 1.8707493436219393
Energy: 2.010670921364584
Energy: 1.8909920523462853
Energy: 2.010670921363257
Energy: 1.8907084228567468
Energy: 2.013243600030116
Energy: 1.745037191479161
Energy: 2.013243600030116
Energy: 1.8907084228567468
Energy: 2.013243600030116
Energy: 1.7129510266321928
Energy: 2.063198833442507
Energy: 1.8698998667908824
Energy: 2.063198833443834
Energy: 1.7129510266321928
Energy: 2.063198833443834
Energy: 1.8908996769492643
Energy: 1.9999337342960395
Energy: 1.905100260811327
Energy: 1.9999337342973666
Energy: 1.8908996769492643
Energy: 1.9999337342973666
Energy: 1.893952627861665
Energy: 2.0920208267202494
Energy: 1.869434450247794
Energy: 2.0920208267189224
Energy: 1.8939526278603378
Energy: 2.0920208267175955
Energy: 1.729582148583098
Energy: 1.8309725854106986
Energy: 1.8702386210494215
Energy: 1.830972585413353
Energy: 1.729582148583098
Energy: 1.830972585413353
Energy: 1.711220606362467
Energy: 2.0901990971745867
Energy: 1.7441708244875522
Energy: 2.0901990971732594
Energy: 1.711220606363794
Energy: 2.0901990971732594
Energy: 1.922178394346875
Energy: 2.0941757329679467
Energy: 1.8634831959519251
Energy: 2.0941757329652924
Energy: 1.922178394345548
Energy: 2.0941757329652924
Energy: 1.881068154714093
Energy: 1.9274713627888584
Energy: 1.8014311371869807
Energy: 1.9274713627888584
Energy: 1.881068154714093
Energy: 1.9274713627888584
Energy: 1.8777004412361373
Energy: 2.011870860758685
Energy: 1.7592476263186594
Energy: 2.0118708607573583
Energy: 1.8777004412348104
Energy: 2.0118708607573583
Energy: 1.88113375200764
Energy: 2.0078244626216524
Energy: 1.8036720864496016
Energy: 2.0078244626216524
Energy: 1.8811337520063127
Energy: 2.0078244626216524
Energy: 1.8785653213141522
Energy: 1.9242737368287257
Energy: 1.7422283497903153
Energy: 1.9242737368247746
Energy: 1.8785653213154794
Energy: 1.9242737368247746
Energy: 1.928288894468769
Energy: 2.0943592065462555
Energy: 1.8625589149103092
Energy: 2.094359206544929
Energy: 1.9282888944674421
Energy: 2.094359206544929
Energy: 1.711036472909247
Energy: 1.8629221840665018
Energy: 1.7516621909276553
Energy: 1.8629221840638477
Energy: 1.711036472909247
Energy: 1.8629221840638477
Energy: 1.7110761228309805
Energy: 1.9073569296054256
Energy: 1.7990547607004495
Energy: 1.907356929606753
Energy: 1.7110761228309805
Energy: 1.907356929606753
Energy: 1.8763629228316667
Energy: 2.0906977534371034
Energy: 1.8636543068650404
Energy: 2.0906977534344486
Energy: 1.8763629228316667
Energy: 2.090697753435776
Energy: 1.888262360439678
Energy: 1.9275532387128698
Energy: 1.8263311347143305
Energy: 1.9275532387141967
Energy: 1.8882623604383508
Energy: 1.9275532387128698
Energy: 1.8777188560636964
Energy: 2.0626972753046084
Energy: 1.8633184324275303
Energy: 2.0626972753046084
Energy: 1.8777188560623694
Energy: 2.062697275303281
Energy: 1.888187091453977
Energy: 2.00861127011075
Energy: 1.7540367755016093
Energy: 2.00861127011075
Energy: 1.888187091453977
Energy: 2.00861127011075

minimum gb energy = 1.711036472909247 eV
minimum distance =  2.28654118214715 Angstroms
sigma value = 27


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

Energy: 1.8181533173194013
Energy: 1.7773578465942106
Energy: 1.9121700231685346
Energy: 1.7773578465942106
Energy: 1.81815331732052
Energy: 1.777357846593092
Energy: 1.7935875735610165
Energy: 1.7329901462945287
Energy: 1.7657587437181432
Energy: 1.73299014629341
Energy: 1.7935875735621354
Energy: 1.73299014629341
Energy: 1.7595159389883657
Energy: 1.7593306133066768
Energy: 1.7658292109898999
Energy: 1.7593306133077957
Energy: 1.7595159389883657
Energy: 1.7593306133077957
Energy: 1.8387623258227512
Energy: 2.020674103186784
Energy: 1.7873030886800607
Energy: 2.0206741031856654
Energy: 1.8387623258227512
Energy: 2.020674103186784
Energy: 1.7290731312639278
Energy: 2.054071206796818
Energy: 1.7261321038708344
Energy: 2.054071206796818
Energy: 1.7290731312628091
Energy: 2.054071206797937
Energy: 1.8234623087563302
Energy: 1.9604816767384075
Energy: 1.8046779657286158
Energy: 1.9604816767372888
Energy: 1.8234623087574484
Energy: 1.9604816767372888
Energy: 1.7594531991182463
Energy: 1.9857050216475172
Energy: 1.7995975142323448
Energy: 1.9857050216475172
Energy: 1.7594531991171276
Energy: 1.9857050216475172
Energy: 1.7462083563278876
Energy: 1.7860251976165011
Energy: 1.795788508097239
Energy: 1.7860251976120263
Energy: 1.7462083563278876
Energy: 1.7860251976287806
Energy: 1.7455565442280885
Energy: 1.9863695418560532
Energy: 1.858736656133336
Energy: 1.9863695418560532
Energy: 1.7455565442292074
Energy: 1.9863695418560532
Energy: 1.7457253824992802
Energy: 1.7461944158612392
Energy: 1.7778232925163453
Energy: 1.7461944158601206
Energy: 1.7457253824992802
Energy: 1.7461944158601206
Energy: 1.7460223166579443
Energy: 1.7269665447737228
Energy: 1.7780403035532455
Energy: 1.72696654477596
Energy: 1.7460223166579443
Energy: 1.7269665447748412
Energy: 1.745971797067437
Energy: 2.01022628950487
Energy: 1.7597272602229044
Energy: 2.010226289503752
Energy: 1.7459717970696744
Energy: 2.010226289503752
Energy: 1.7468333080441856
Energy: 1.9246698749550557
Energy: 1.8003228823927837
Energy: 1.9246698749550557
Energy: 1.7468333080441856
Energy: 1.9246698749550557
Energy: 1.7290986665151893
Energy: 1.9589502090740487
Energy: 1.795813186603964
Energy: 1.9589502090751674
Energy: 1.7290986665151893
Energy: 1.9589502090751674
Energy: 1.8544426788303825
Energy: 1.9575609401747665
Energy: 1.8048564596703671
Energy: 1.9575609401736478
Energy: 1.8544426788315012
Energy: 1.9575609401736478
Energy: 1.7260628156765323
Energy: 2.0540712067956997
Energy: 1.726162730026619
Energy: 2.0540712067956997
Energy: 1.7260628156765323
Energy: 2.0540712067956997
Energy: 1.838650924326899
Energy: 1.9835758101481291
Energy: 1.7317526684826452
Energy: 1.9835758101492473
Energy: 1.8386509243257803
Energy: 1.9835758101492473
Energy: 1.75887701873565
Energy: 1.759354771264463
Energy: 1.7655895981642205
Energy: 1.7593547712633444
Energy: 1.758877018734531
Energy: 1.7593547712633444
Energy: 1.8043589365937627
Energy: 1.759383371582724
Energy: 1.7657758362548186
Energy: 1.7593833715838427
Energy: 1.8043589365915254
Energy: 1.7593833715838427
Energy: 1.8181533173194013
Energy: 1.777357846593092
Energy: 1.936894620085748
Energy: 1.7773578465953292
Energy: 1.81815331732052
Energy: 1.7773578465953292
Energy: 1.7935875735610165
Energy: 1.7329901462945287
Energy: 1.7657587437170243
Energy: 1.73299014629341
Energy: 1.7935875735621354
Energy: 1.73299014629341
Energy: 1.7595159389894846
Energy: 1.7593306133055582
Energy: 1.7658292109898999
Energy: 1.7593306133066768
Energy: 1.7595159389894846
Energy: 1.7593306133066768
Energy: 1.8387623258216326
Energy: 2.020674103187903
Energy: 1.7873030886811794
Energy: 2.020674103187903
Energy: 1.8387623258216326
Energy: 2.020674103187903
Energy: 1.7290731312628091
Energy: 2.054071206796818
Energy: 1.726132103871953
Energy: 2.0540712067956997
Energy: 1.7290731312616907
Energy: 2.0540712067956997
Energy: 1.8234623087574484
Energy: 1.9604816767384075
Energy: 1.8046779657286158
Energy: 1.9604816767372888
Energy: 1.823462308758567
Energy: 1.9604816767372888

minimum gb energy = 1.7260628156765323 eV
minimum distance =  2.28389467812042 Angstroms
sigma value = 19


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

Energy: 1.7581465894086077
Energy: 1.7419785872123759
Energy: 1.706844922201913
Energy: 1.7419785872133415
Energy: 1.7581465894095734
Energy: 1.7419785872133415
Energy: 1.7426259098196863
Energy: 1.7049563735754139
Energy: 1.6944475217538524
Energy: 1.7049563735744482
Energy: 1.7426259098187205
Energy: 1.7049563735744482
Energy: 1.7099408482181246
Energy: 1.8644882479664453
Energy: 1.7145047487747516
Energy: 1.8644882479664453
Energy: 1.7099408482171592
Energy: 1.8644882479664453
Energy: 1.7261500682693998
Energy: 1.8501029955202488
Energy: 1.7275687462501694
Energy: 1.8501029955221802
Energy: 1.726150068268434
Energy: 1.8501029955221802
Energy: 1.7098854434354214
Energy: 1.86916655457046
Energy: 1.7269017492492857
Energy: 1.8691665545694944
Energy: 1.7098854434354214
Energy: 1.8691665545694944
Energy: 1.7154985584523585
Energy: 1.934461478621073
Energy: 1.727061088419833
Energy: 1.934461478621073
Energy: 1.715498558451393
Energy: 1.934461478621073
Energy: 1.7019712472357584
Energy: 1.9705779896668085
Energy: 1.727138256936582
Energy: 1.970577989665843
Energy: 1.7019712472357584
Energy: 1.970577989665843
Energy: 1.7006526326101592
Energy: 1.9099269734397022
Energy: 1.72713507142985
Energy: 1.9099269734416335
Energy: 1.7006526326091935
Energy: 1.9099269734416335
Energy: 1.7260280317416667
Energy: 1.851689707052651
Energy: 1.7434326738333974
Energy: 1.851689707052651
Energy: 1.7260280317416667
Energy: 1.8516897070545824
Energy: 1.7107186566192465
Energy: 1.8315546606226631
Energy: 1.6945217230076393
Energy: 1.8315546606236288
Energy: 1.7107186566192465
Energy: 1.8315546606236288
Energy: 1.7017727522305552
Energy: 1.7877761909568812
Energy: 1.7204836726802726
Energy: 1.7877761909559156
Energy: 1.7017727522305552
Energy: 1.7877761909559156
Energy: 1.7224383550225326
Energy: 1.675401693603547
Energy: 1.6943828718459801
Energy: 1.6754016936016156
Energy: 1.722438355023498
Energy: 1.6754016936025813
Energy: 1.7224153969395533
Energy: 1.675438832915828
Energy: 1.6944623151186842
Energy: 1.675438832915828
Energy: 1.7224153969385874
Energy: 1.675438832915828
Energy: 1.70935355492796
Energy: 1.787740357616193
Energy: 1.8000021843326746
Energy: 1.7877403576171589
Energy: 1.70935355492796
Energy: 1.7877403576171589
Energy: 1.7229191203109508
Energy: 1.7247390349839615
Energy: 1.6946572548661882
Energy: 1.7247390349829956
Energy: 1.722919120309985
Energy: 1.7247390349829956
Energy: 1.7286338368952712
Energy: 1.8727465862608825
Energy: 1.678212421627118
Energy: 1.8727465862608825
Energy: 1.7286338368962366
Energy: 1.8727465862608825
Energy: 1.7107946417349302
Energy: 1.9071766731709783
Energy: 1.699030822047189
Energy: 1.907176673171944
Energy: 1.7107946417349302
Energy: 1.907176673171944
Energy: 1.715983537675916
Energy: 1.8774041633629994
Energy: 1.675099960861935
Energy: 1.8774041633649305
Energy: 1.715983537675916
Energy: 1.8774041633629994
Energy: 1.7092562829821552
Energy: 1.9103450961400266
Energy: 1.6992633730769633
Energy: 1.9103450961400266
Energy: 1.7092562829811893
Energy: 1.9103450961400266
Energy: 1.7289436974711718
Energy: 1.8728477458547108
Energy: 1.7067278933281433
Energy: 1.8728477458556765
Energy: 1.7289436974711718
Energy: 1.8728477458556765
Energy: 1.7227086993244305
Energy: 1.8223367161233484
Energy: 1.6945635665357015
Energy: 1.8223367161243138
Energy: 1.7227086993244305
Energy: 1.8223367161233484
Energy: 1.7093890265285552
Energy: 1.7298670201149091
Energy: 1.8000706188433924
Energy: 1.7298670201139432
Energy: 1.7093890265285552
Energy: 1.7298670201139432
Energy: 1.7583858437214919
Energy: 1.6943669788566702
Energy: 1.6944095403625097
Energy: 1.6943669788576357
Energy: 1.7583858437214919
Energy: 1.6943669788586013
Energy: 1.77361129560444
Energy: 1.6948871379971768
Energy: 1.6944139854162457
Energy: 1.6948871379962114
Energy: 1.77361129560444
Energy: 1.6948871379962114
Energy: 1.737098405052387
Energy: 1.7334249636156207
Energy: 1.7202462652692465
Energy: 1.7334249636165862
Energy: 1.7370984050533522
Energy: 1.7334249636165862
Energy: 1.709974791693502
Energy: 1.7091144871190493
Energy: 1.6945352528007296
Energy: 1.7091144871190493
Energy: 1.7099747916925367
Energy: 1.7091144871190493
Energy: 1.726285242057408
Energy: 1.8833900688209009
Energy: 1.745052895112061
Energy: 1.883390068822832
Energy: 1.726285242057408
Energy: 1.883390068822832
Energy: 1.7004970739617151
Energy: 1.908774029876946
Energy: 1.7275234391350767
Energy: 1.9087740298779117
Energy: 1.7004970739617151
Energy: 1.9087740298779117
Energy: 1.7008332170140017
Energy: 1.9812989906294782
Energy: 1.727102542687948
Energy: 1.9812989906294782
Energy: 1.7008332170140017
Energy: 1.9812989906294782

minimum gb energy = 1.675099960861935 eV
minimum distance =  2.24851285702184 Angstroms
sigma value = 101


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

Energy: 1.8606489993774602
Energy: 1.9114171454762134
Energy: 1.81466796824776
Energy: 1.9114171454762134
Energy: 1.8606489993757627
Energy: 1.9114171454762134
Energy: 1.656108701422315
Energy: 1.6430909105720752
Energy: 1.6596174869928182
Energy: 1.6430909105729241
Energy: 1.656108701422315
Energy: 1.6430909105720752
Energy: 1.6425409240026443
Energy: 1.8600255668954901
Energy: 1.6794591664414558
Energy: 1.8600255668946415
Energy: 1.6425409240026443
Energy: 1.8600255668954901
Energy: 1.650537154254957
Energy: 1.8578147015292752
Energy: 1.6429740108588957
Energy: 1.8578147015292752
Energy: 1.650537154254957
Energy: 1.8578147015292752
Energy: 1.6288177997735078
Energy: 1.819824850735011
Energy: 1.6456869810451804
Energy: 1.8198248507341621
Energy: 1.6288177997743567
Energy: 1.8198248507341621
Energy: 1.6422082877173816
Energy: 1.8447952186747478
Energy: 1.6230388435797587
Energy: 1.8447952186755965
Energy: 1.6422082877165327
Energy: 1.8447952186755965
Energy: 1.646175820423842
Energy: 1.9134465300187526
Energy: 1.6257482857894574
Energy: 1.9134465300196015
Energy: 1.646175820423842
Energy: 1.9134465300196015
Energy: 1.6426407530426903
Energy: 1.885546440308648
Energy: 1.6425620540706594
Energy: 1.885546440308648
Energy: 1.6426407530426903
Energy: 1.885546440308648
Energy: 1.628849396941283
Energy: 1.8438909216237491
Energy: 1.6428106440650991
Energy: 1.8438909216254464
Energy: 1.628849396941283
Energy: 1.8438909216254464
Energy: 1.6284532093579753
Energy: 1.7767240490234109
Energy: 1.6231012231332822
Energy: 1.7767240490234109
Energy: 1.628453209358824
Energy: 1.7767240490234109
Energy: 1.6766505250520338
Energy: 1.838078844772206
Energy: 1.9958525395542945
Energy: 1.838078844773055
Energy: 1.6766505250520338
Energy: 1.838078844773055
Energy: 1.6580068280753435
Energy: 1.622012638377963
Energy: 1.6231131899101723
Energy: 1.6220126383771143
Energy: 1.6580068280753435
Energy: 1.6220126383771143
Energy: 1.6795924124891148
Energy: 1.7471035590863415
Energy: 1.6504018649275207
Energy: 1.7471035590846442
Energy: 1.6795924124891148
Energy: 1.7471035590854929
Energy: 1.6427737997848426
Energy: 1.6875915806086639
Energy: 1.6567306498619834
Energy: 1.687591580607815
Energy: 1.6427737997848426
Energy: 1.7345754072483281
Energy: 1.6326438265724768
Energy: 1.779385739174327
Energy: 1.6557561958053573
Energy: 1.779385739174327
Energy: 1.6326438265716279
Energy: 1.779385739174327
Energy: 1.6792297724036138
Energy: 1.884813954712722
Energy: 1.64238276395555
Energy: 1.884813954712722
Energy: 1.6792297724036138
Energy: 1.884813954712722
Energy: 1.62537240261437
Energy: 1.892185325945726
Energy: 1.6411698911270558
Energy: 1.892185325945726
Energy: 1.6253724026135212
Energy: 1.892185325945726
Energy: 1.6425305207328078
Energy: 1.8540081360327436
Energy: 1.628224342593898
Energy: 1.8540081360335923
Energy: 1.6425305207319592
Energy: 1.8540081360344411
Energy: 1.639958458192763
Energy: 1.846419270135272
Energy: 1.6423433153245413
Energy: 1.846419270135272
Energy: 1.639958458192763
Energy: 1.846419270135272
Energy: 1.6219999391269149
Energy: 1.7095387588101139
Energy: 1.625319679394169
Energy: 1.7095387588101139
Energy: 1.6219999391277637
Energy: 1.7095387588101139
Energy: 1.664249951221703
Energy: 1.8540077693336627
Energy: 1.6428538746149683
Energy: 1.8540077693336627
Energy: 1.6642499512225521
Energy: 1.8540077693336627
Energy: 1.623005969892256
Energy: 1.8596020225895855
Energy: 1.6284725771750697
Energy: 1.8596020225895855
Energy: 1.623005969892256
Energy: 1.8596020225904342
Energy: 1.6436065646580322
Energy: 1.8450307476382417
Energy: 1.6291201314850021
Energy: 1.8450307476382417
Energy: 1.6436065646571834
Energy: 1.8450307476382417
Energy: 1.6504081351989655
Energy: 1.8566433441834718
Energy: 1.7119434038786103
Energy: 1.8878100978851542
Energy: 1.6504081351989655
Energy: 1.8566433441834718
Energy: 1.6289533799240667
Energy: 1.741211171116461
Energy: 1.6216828601197417
Energy: 1.741211171116461
Energy: 1.6289533799240667
Energy: 1.741211171116461
Energy: 1.643236749180321
Energy: 1.8846489979272474
Energy: 1.6791978158010012
Energy: 1.8846489979272474
Energy: 1.6432367491794722
Energy: 1.8846489979272474
Energy: 1.6561413352416865
Energy: 1.6222695694729996
Energy: 1.6224647265652405
Energy: 1.6222695694729996
Energy: 1.6561413352425352
Energy: 1.6222695694721507
Energy: 1.655699842788022
Energy: 1.622639132533048
Energy: 1.623447086458352
Energy: 1.6226391325321992
Energy: 1.655699842788022
Energy: 1.622639132533048
Energy: 1.7319509977890195
Energy: 1.8846107339589826
Energy: 1.7370601407942197
Energy: 1.8846107339598315
Energy: 1.7319509977898684
Energy: 1.8846107339598315
Energy: 1.6282460525451476
Energy: 1.7452342633177151
Energy: 1.6221102054554304
Energy: 1.7452342633177151
Energy: 1.628246052544299
Energy: 1.7452342633177151
Energy: 1.6505746176922367
Energy: 1.8547862433591813
Energy: 1.641795416538869
Energy: 1.8547862433591813
Energy: 1.6505746176922367
Energy: 1.85478624336003
Energy: 1.6427013194259135
Energy: 1.8458997110537396
Energy: 1.6223248263349517
Energy: 1.8458997110528907
Energy: 1.6427013194259135
Energy: 1.8458997110537396
Energy: 1.622072124744668
Energy: 1.9227576163007123
Energy: 1.6384172426211006
Energy: 1.9227576163007123
Energy: 1.622072124744668
Energy: 1.9227576163007123

minimum gb energy = 1.6216828601197417 eV
minimum distance =  2.26772685565628 Angstroms
sigma value = 33


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

Energy: 0.014912515380905699
Energy: 0.016220476248972243
Energy: 1.6889452833803447
Energy: 0.01622047624967749
Energy: 0.014912515380905699
Energy: 0.01622047624967749
Energy: 0.015064003423658791
Energy: 0.801902915106355
Energy: 0.015064003423658791
Energy: 0.8019029151056497
Energy: 0.015064003423658791
Energy: 0.801902915106355
Energy: 1.688945283377602
Energy: 0.01622047624967749
Energy: 0.014912515380905699
Energy: 0.01622047624967749
Energy: 1.6889452833796785
Energy: 0.01622047624967749
Energy: 0.015064003423658791
Energy: 0.801902915106355
Energy: 0.015064003423658791
Energy: 0.8019029151056497
Energy: 0.015064003423658791
Energy: 0.801902915107021

minimum gb energy = 0.014912515380905699 eV
minimum distance =  2.47011882954265 Angstroms
sigma value = 1