Model name: model_name=MEAM_LAMMPS_JeongLee_2020_PdC__MO_068985622065_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.8890872895717616
cohesive_energy=3.9103075413017163
mass=106.42
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4797334890998178e-19, 2.1216824075744998e-19, 2.63700650013426e-19, 3.0766918338028797e-19, 3.4625920978681194e-19, 3.8065633994215797e-19, 4.1158796203816196e-19, 4.39537933418292e-19, 4.6485392641212595e-19, 4.87793891457738e-19, 5.08556498457744e-19, 5.272987607222759e-19, 5.4414725020542e-19, 5.59209312741654e-19, 5.72574670222482e-19, 5.843202271263359e-19, 5.94510070518576e-19, 6.032034809346599e-19, 6.10451728026876e-19, 6.162996727409759e-19, 6.2078736949281e-19, 6.23953270521594e-19, 6.258310215366419e-19, 6.264510638939999e-19, 6.257717410011839e-19, 6.235495220098259e-19, 6.19454358533322e-19, 6.13092115119708e-19, 6.03978934425516e-19, 5.91518806742898e-19, 5.749763329968479e-19, 5.5343987468262e-19, 5.25768682036806e-19, 4.905272047953419e-19, 4.45898574655272e-19, 3.8956123767392994e-19, 3.1852072572237e-19, 2.2887734087343597e-19, 1.155068415986058e-19, -2.84163649982874e-20, -2.12107358045358e-19, -4.48165654592382e-19, -7.54146143800434e-19, -1.154927424442266e-18, -1.6865312337801e-18, -2.40241579738398e-18, -3.3841174863347997e-18, -4.7601468884456995e-18, -6.741094100489639e-18, -9.688314040498979e-18, -1.425844278015228e-17, -2.17332056048832e-17, -3.4857755937620996e-17, -6.030048110320439e-17]
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: 0.013031028442182973
Energy: 0.9133240316471114
Energy: 0.8991263803505276
Energy: 0.013287757819118248
Energy: 0.9058540625882099
Energy: 0.013489736772613703
Energy: 0.913324031657679
Energy: 0.9513502731722581
Energy: 0.5045128742850158
Energy: 0.5045434755052359
Energy: 0.9372625115840078
Energy: 0.502173280794228
Energy: 0.8991263803510395
Energy: 0.5045128742857986
Energy: 0.09754817255298127
Energy: 0.8995155540366712
Energy: 0.50365010862553
Energy: 0.5022975475396149
Energy: 0.013287757819118248
Energy: 0.5045434755046939
Energy: 0.8995155540364002
Energy: 0.013293563435408126
Energy: 0.5027969616433826
Energy: 0.013525710471039584
Energy: 0.9058540626064849
Energy: 0.9372625115715435
Energy: 0.5036501086250181
Energy: 0.5027969616433826
Energy: 0.9242478939762445
Energy: 0.5055952226074532
Energy: 0.013489736772884663
Energy: 0.502173280794228
Energy: 0.5022975475380193
Energy: 0.013525710471039584
Energy: 0.5055952226071821
Energy: 0.01381706267029434

minimum gb energy = 0.013031028442182973 eV
minimum distance =  2.74455658625028 Angstroms
sigma value = 1


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

Energy: 1.6741775284532818
Energy: 1.8676120043773556
Energy: 1.483981335316226
Energy: 1.6232518956913013
Energy: 1.9077270109821733
Energy: 1.4803383095920732
Energy: 1.7211484233932708
Energy: 1.1624830725980526
Energy: 1.1868489408713823
Energy: 1.6627398915609597
Energy: 1.1629834159304204
Energy: 1.138382929955144
Energy: 1.6260483352132031
Energy: 1.1620859371245864
Energy: 1.1819476337876802
Energy: 1.6378474536937888
Energy: 1.2064628474320858
Energy: 1.1964131336646853
Energy: 1.8085271523727124
Energy: 1.6810330556886173
Energy: 1.487180360222449
Energy: 1.8490841234477013
Energy: 1.6839330534838317
Energy: 1.6499490932742717
Energy: 1.5858362850929095
Energy: 1.2572457736548153
Energy: 1.1755317501628806
Energy: 1.5860545829411867
Energy: 1.2579911265986856
Energy: 1.196860709772602
Energy: 1.523714368292289
Energy: 1.2408030361842288
Energy: 1.1805003280103927
Energy: 1.49147139156461
Energy: 1.265923656992367
Energy: 1.1826937223835345
Energy: 1.552897483942559
Energy: 1.4825744155962248
Energy: 1.3741001302714078
Energy: 1.5552454712876542
Energy: 1.4831300975540473
Energy: 1.4139004491109415
Energy: 1.5376662314684266
Energy: 1.44975029616406
Energy: 1.382356635872714
Energy: 1.539449993307095
Energy: 1.4636033812819813
Energy: 1.3631086056832207
Energy: 1.2514239563684681
Energy: 1.289426331697511
Energy: 1.1979529624919139
Energy: 1.252509568127403
Energy: 1.4878667143671198
Energy: 1.1538767698081418
Energy: 1.3217800676731057
Energy: 1.411438557354419
Energy: 1.2381157269629048
Energy: 1.2835275359217142
Energy: 1.4484175661309902
Energy: 1.2091286232097513
Energy: 1.6869620934637373
Energy: 1.5855756793099187
Energy: 1.5411154930067223
Energy: 1.6864717523009156
Energy: 1.5874834493560885
Energy: 1.5052297142072875
Energy: 1.2014541979456306
Energy: 1.2598471355251926
Energy: 1.1604670991650474
Energy: 1.201786069871617
Energy: 1.6951579414163385
Energy: 1.1417891554420299
Energy: 1.1243764968345669
Energy: 1.32993981501985
Energy: 1.1903269664793512
Energy: 1.124169884839523
Energy: 1.7746347691931335
Energy: 1.1723054601502474
Energy: 1.1966641670340448
Energy: 1.7432403012487216
Energy: 1.5815919192222072
Energy: 1.1926482385531234
Energy: 1.7537381716733316
Energy: 1.6309250757859761
Energy: 1.1675065210774986
Energy: 1.276427926403117
Energy: 1.1604822105384014
Energy: 1.168254688669306
Energy: 1.3365272350534105
Energy: 1.144971172624419
Energy: 1.1740645021687746
Energy: 1.2671311433204242
Energy: 1.2113296337489732
Energy: 1.1740851756656183
Energy: 1.6121602816202345
Energy: 1.1351592794676335
Energy: 1.5603082720137273
Energy: 1.5843167508684803
Energy: 1.502114003474272
Energy: 1.56166358889245
Energy: 1.6045999194026406
Energy: 1.5250704233245098
Energy: 1.3738606264132762
Energy: 1.4487972923797046
Energy: 1.2817783430028342
Energy: 1.3753042976151273
Energy: 1.4484113417271955
Energy: 1.2781837438735215
Energy: 1.3949144406290102
Energy: 1.3528727051201028
Energy: 1.2097374027016103
Energy: 1.440766110724804
Energy: 1.4217872612188829
Energy: 1.157861988489223
Energy: 1.553464135500466
Energy: 1.385653188310038
Energy: 1.328167518410157
Energy: 1.5531343058212665
Energy: 1.4373971628702753
Energy: 1.280181585053404
Energy: 1.6213668108817019
Energy: 1.5589571000696179
Energy: 1.4102617094753969
Energy: 1.6232855736030192
Energy: 1.5614315700887205
Energy: 1.508392337599969
Energy: 1.5199959763874056
Energy: 1.1332546867657691
Energy: 1.1455445711236685
Energy: 1.5555536781504906
Energy: 1.176067256459037
Energy: 1.1754710816813736
Energy: 1.7742590846469286
Energy: 1.2161475672310893
Energy: 1.2448950597787054
Energy: 1.7558849828526626
Energy: 1.2160481250461974
Energy: 1.1305818945314918

minimum gb energy = 1.124169884839523 eV
minimum distance =  2.51319724458935 Angstroms
sigma value = 33


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

Energy: 1.892685043909921
Energy: 1.6466331119097481
Energy: 1.4382168438132747
Energy: 1.7788021148373918
Energy: 1.6659242251781172
Energy: 1.5003276320099295
Energy: 1.732044748252726
Energy: 1.2800329533784318
Energy: 1.11376681092093
Energy: 1.5817524714372928
Energy: 1.2700005360043467
Energy: 1.1988736077906808
Energy: 1.7104822583304709
Energy: 1.139099221556046
Energy: 1.3374473487623795
Energy: 1.671509335144941
Energy: 1.243829546214987
Energy: 1.3953948688997166
Energy: 1.604278697485143
Energy: 1.8484699996760723
Energy: 1.8629509757395795
Energy: 1.6051719618226352
Energy: 1.887484254524395
Energy: 1.4322188891216256
Energy: 1.6382111048927723
Energy: 1.3527185420944745
Energy: 1.423249224484157
Energy: 1.6330802756309861
Energy: 1.3657014236087375
Energy: 1.421510785001194
Energy: 1.622952190686031
Energy: 1.301335170237772
Energy: 1.3244319310438266
Energy: 1.6101385953193297
Energy: 1.3199308375053922
Energy: 1.3555206502021195
Energy: 1.6229862873763448
Energy: 1.5556532479166234
Energy: 1.5342604837751652
Energy: 1.6160171384794462
Energy: 1.5890225045252193
Energy: 1.5272427115795404
Energy: 1.6807510288613696
Energy: 1.256428451538147
Energy: 1.2916745849165694
Energy: 1.6441345382913388
Energy: 1.2536201704107182
Energy: 1.3072915620689427
Energy: 1.295158620245699
Energy: 1.5087013100910431
Energy: 1.340783512162667
Energy: 1.305802251162635
Energy: 1.4618190853193633
Energy: 1.3328779376894662
Energy: 1.3932630677375886
Energy: 1.4006230119523901
Energy: 1.3747585013356651
Energy: 1.3940636582145465
Energy: 1.609762541260909
Energy: 1.2836586981091305
Energy: 1.5868639975647973
Energy: 1.642628250849722
Energy: 1.6465844259836464
Energy: 1.587635024940651
Energy: 1.7660269069173982
Energy: 1.4925421897996003
Energy: 1.2861872040843947
Energy: 1.3843461442576206
Energy: 1.2758424621643387
Energy: 1.2794441744419085
Energy: 1.6243269671136773
Energy: 1.1597106082928494
Energy: 1.2594298899526468
Energy: 1.4333382856536385
Energy: 1.407055974275106
Energy: 1.2587001728867104
Energy: 1.5619813139639536
Energy: 1.3328215394947165
Energy: 1.9622745646795288
Energy: 1.6066002493093952
Energy: 1.388956417319039
Energy: 1.9327366611551935
Energy: 1.6053990952009398
Energy: 1.4346976319362537
Energy: 1.384519694780184
Energy: 1.448627796486331
Energy: 1.4318682613003935
Energy: 1.368095669117051
Energy: 1.6200190957553664
Energy: 1.4245425801331517
Energy: 1.3736881367912641
Energy: 1.5264282754106915
Energy: 1.3577440390778568
Energy: 1.331950121134956
Energy: 1.615745991730333
Energy: 1.3288442504904092
Energy: 1.5931093834327792
Energy: 1.5792289302713023
Energy: 1.5788336669975387
Energy: 1.5976997728560298
Energy: 1.6366653292134843
Energy: 1.5040532892930316
Energy: 1.2544114109281
Energy: 1.4049430108798768
Energy: 1.4046026166547998
Energy: 1.254526726674738
Energy: 1.5929590957954554
Energy: 1.3184344188727029
Energy: 1.326665250190785
Energy: 1.3530529024887827
Energy: 1.3345603476223062
Energy: 1.3300240053555457
Energy: 1.293374205196847
Energy: 1.315902712126819
Energy: 1.6693022005072526
Energy: 1.2570489646530776
Energy: 1.30259734484631
Energy: 1.6553584016844463
Energy: 1.2850305367543553
Energy: 1.3410153819199853
Energy: 1.7601689551793613
Energy: 1.6979001550762798
Energy: 1.4923892498266853
Energy: 1.7607352113656383
Energy: 1.7177012502070623
Energy: 1.4184616909073613
Energy: 1.657681608742523
Energy: 1.3201749608474056
Energy: 1.319231292765613
Energy: 1.6747112870447085
Energy: 1.3213861884029046
Energy: 1.2538013670772528
Energy: 1.692434579750533
Energy: 1.1453457616220861
Energy: 1.3535303545169952
Energy: 1.651623012662465
Energy: 1.262003138167652
Energy: 1.3765824909368174
Energy: 1.6020207150081758
Energy: 1.8879810238579802
Energy: 1.8677756653301039
Energy: 1.6033912887228086
Energy: 1.8630432546701816
Energy: 1.3752350879071866
Energy: 1.7141138697723726
Energy: 1.349475215037537
Energy: 1.4233431881002325
Energy: 1.6310176111202825
Energy: 1.3684178852745565
Energy: 1.422668905837166
Energy: 1.575992530200202
Energy: 1.3012797242125846
Energy: 1.3196716884053872
Energy: 1.5583286145696256
Energy: 1.324013991865779
Energy: 1.3024020535910474
Energy: 1.609553058490556
Energy: 1.5411106889811443
Energy: 1.524204907081733
Energy: 1.5906279719158076
Energy: 1.5628768041660668
Energy: 1.512314132383138
Energy: 1.626048884558838
Energy: 1.301372252043396
Energy: 1.3015216032554209
Energy: 1.572174089971301
Energy: 1.2919214156911687
Energy: 1.3812433164656897
Energy: 1.3345956507431145
Energy: 1.4835515286413834
Energy: 1.3073461399542954
Energy: 1.288967973856282
Energy: 1.3296404310655374
Energy: 1.3333218090606895
Energy: 1.22062924559531
Energy: 1.347105226391033
Energy: 1.346749295058843
Energy: 1.2192390724378177
Energy: 1.6488782701392848
Energy: 1.2955956202254102
Energy: 1.6060766620471554
Energy: 1.6846322402278573
Energy: 1.6850994443963114
Energy: 1.6221344017436432
Energy: 1.9321344021644875
Energy: 1.5532264850928725
Energy: 1.2895218711961363
Energy: 1.5715934035082078
Energy: 1.321524284840213
Energy: 1.2884409962081596
Energy: 1.7340504421289302
Energy: 1.2755492525265808
Energy: 1.260465860189501
Energy: 1.3982615795056357
Energy: 1.3770183847660904
Energy: 1.2627193269875032
Energy: 1.6486647681554916
Energy: 1.3734345865309057
Energy: 1.853027506269346
Energy: 1.6074646218949793
Energy: 1.3642081426767336
Energy: 1.8397788915354367
Energy: 1.605003195764514
Energy: 1.4267699902305389
Energy: 1.3833017539613939
Energy: 1.436318945917816
Energy: 1.416583021996764
Energy: 1.3663862217101668
Energy: 1.5745736069384089
Energy: 1.4251986037617856
Energy: 1.3317023482958215
Energy: 1.4787614416421184
Energy: 1.245318727600144
Energy: 1.3117416023955875
Energy: 1.5596569180386157
Energy: 1.287995895081849
Energy: 1.6186764218519374
Energy: 1.4911278382248536
Energy: 1.4938840718673323
Energy: 1.5620641284711847
Energy: 1.5848360437275586
Energy: 1.5106896874592044
Energy: 1.5144260036925794
Energy: 1.3567163665186486
Energy: 1.3930170569287628
Energy: 1.521230230175095
Energy: 1.5627663250466273
Energy: 1.3850129739964252
Energy: 1.3295559689944234
Energy: 1.34403107768498
Energy: 1.2806878749649853
Energy: 1.3289991525489617
Energy: 1.3426193162753417
Energy: 1.3457738173258296
Energy: 1.6886537961477917
Energy: 1.2111615152255433
Energy: 1.271592347198072
Energy: 1.5558562463805499
Energy: 1.1200517194936965
Energy: 1.284275421347549
Energy: 1.8763010612491047
Energy: 1.39374647770946
Energy: 1.5072900771590925
Energy: 1.7323392010024714
Energy: 1.4663003489121191
Energy: 1.6403284399635298

minimum gb energy = 1.11376681092093 eV
minimum distance =  2.47076789452371 Angstroms
sigma value = 51


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

Energy: 1.6835866237761923
Energy: 1.9152955589036746
Energy: 1.7075673895563126
Energy: 1.6847133792734468
Energy: 1.9449999560104752
Energy: 1.4061490076422112
Energy: 1.5905991631378003
Energy: 1.1880601515192775
Energy: 1.18804001042905
Energy: 1.5673301743829924
Energy: 1.1887043391214218
Energy: 1.290802765564715
Energy: 1.634278122992434
Energy: 1.123012125841086
Energy: 1.1677704902592752
Energy: 1.659017288848502
Energy: 1.2388884216681406
Energy: 1.189582403958384
Energy: 1.490898987329125
Energy: 1.684523895656545
Energy: 1.6463335868893265
Energy: 1.4915360549399435
Energy: 1.6841652378567034
Energy: 1.3504175834199217
Energy: 1.5294363248286944
Energy: 1.33011116111399
Energy: 1.3590108650822152
Energy: 1.5376621993918376
Energy: 1.345877517184816
Energy: 1.3592906635369153
Energy: 1.345201175521853
Energy: 1.4123145445862808
Energy: 1.299380415005865
Energy: 1.3466636458329069
Energy: 1.3661759059816767
Energy: 1.27395956785241
Energy: 1.2736197280946253
Energy: 1.369533540174875
Energy: 1.353993236256356
Energy: 1.2741653123431727
Energy: 1.4185435788380394
Energy: 1.3405001943418742
Energy: 1.5845877028068882
Energy: 1.6284038094333833
Energy: 1.536749362661727
Energy: 1.585135019673768
Energy: 1.7230586978578566
Energy: 1.4674947708101829
Energy: 1.222630854398693
Energy: 1.5814642426208863
Energy: 1.2992169079966454
Energy: 1.2256297851144438
Energy: 1.6705277519183153
Energy: 1.2043389679595788
Energy: 1.1943441618158794
Energy: 1.3177807168698215
Energy: 1.1141722127922835
Energy: 1.1948146034506226
Energy: 1.6007680107689868
Energy: 1.1289835024168746
Energy: 1.9107112264917554
Energy: 1.7949563445727805
Energy: 1.6923584421881575
Energy: 1.8717979393456656
Energy: 1.9229782235017796
Energy: 1.6001994151784167
Energy: 1.2401262809789193
Energy: 1.3358125838493322
Energy: 1.1793383294542588
Energy: 1.255573947957291
Energy: 1.57934432906244
Energy: 1.1853332072029448
Energy: 1.1426975948208842
Energy: 1.4660329287265097
Energy: 1.1735888093918125
Energy: 1.1440799493807186
Energy: 1.5217738190463226
Energy: 1.1786485720946553
Energy: 1.5712903088378096
Energy: 1.4109732267569133
Energy: 1.3375189956105364
Energy: 1.5732094053769456
Energy: 1.4653751124896908
Energy: 1.384336834006051
Energy: 1.5395303599434087
Energy: 1.4568511549730743
Energy: 1.4029765333899615
Energy: 1.4879546443132299
Energy: 1.622211744277919
Energy: 1.4014420102676135
Energy: 1.333780251037389
Energy: 1.3283646495014145
Energy: 1.3265232052675686
Energy: 1.3356151502451679
Energy: 1.3558008567414324
Energy: 1.2912913983604728
Energy: 1.5810260293955143
Energy: 1.1742240240155193
Energy: 1.1935388892132321
Energy: 1.4965157690842206
Energy: 1.182472748728198
Energy: 1.294128003028212
Energy: 1.7751200602422472
Energy: 1.3869700991634764
Energy: 1.439962326927713
Energy: 1.7765796553049944
Energy: 1.3871403820619994
Energy: 1.2963793754931918

minimum gb energy = 1.1141722127922835 eV
minimum distance =  2.52242562065158 Angstroms
sigma value = 19


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

Energy: 1.3457333595256955
Energy: 1.7064127226869747
Energy: 1.0757394459903085
Energy: 1.3482551259680275
Energy: 1.8653960341970244
Energy: 1.1920799301264824
Energy: 1.5390278796793486
Energy: 1.0139443291151802
Energy: 0.979260786030326
Energy: 1.4058102570891884
Energy: 1.0136050590044319
Energy: 1.3527219665530834
Energy: 1.467463054688009
Energy: 1.1375092876451138
Energy: 1.1379884321050597
Energy: 1.2859475774052722
Energy: 1.137547132839731
Energy: 1.1382569464510914
Energy: 1.156798166817418
Energy: 1.5657128821173631
Energy: 1.6334404425979305
Energy: 1.1557265117985513
Energy: 1.56700565565952
Energy: 1.6356638232169085
Energy: 1.5621142525797347
Energy: 1.3106560652468888
Energy: 1.408734583958403
Energy: 1.5625024414656032
Energy: 1.3695783773584376
Energy: 1.4093589694320032
Energy: 1.2146906403408768
Energy: 1.1220949617050175
Energy: 1.1923365537395427
Energy: 1.2149199563101831
Energy: 1.0139838906368424
Energy: 1.1483039208965693
Energy: 1.1629292828441589
Energy: 1.5264834468001083
Energy: 1.4645658026062784
Energy: 1.162124906311713
Energy: 1.4732233726368016
Energy: 1.0918272830633537
Energy: 1.3193507427288187
Energy: 1.350654407853752
Energy: 1.1920052947278492
Energy: 1.3194341794360784
Energy: 1.3491258457581778
Energy: 1.2148508149756543
Energy: 1.0819300740439721
Energy: 1.348412709658265
Energy: 1.1392580972959165
Energy: 1.0818369613193224
Energy: 1.3487484776280219
Energy: 1.1409637264095431
Energy: 1.1360506634796863
Energy: 1.4543780093288998
Energy: 1.4108185118110883
Energy: 1.1378145494072727
Energy: 1.4100059603811792
Energy: 1.1385369377603165
Energy: 1.5469841061504583
Energy: 1.210774799883013
Energy: 1.1946357550894264
Energy: 1.5480419584044265
Energy: 1.209470548579031
Energy: 1.6204010113606697
Energy: 1.3939364399531873
Energy: 1.2184236724321587
Energy: 1.2192990002391286
Energy: 1.3381309813894526
Energy: 1.409804651472782
Energy: 1.32836324457111
Energy: 1.0152781833370454
Energy: 1.2170508829470397
Energy: 1.1877985276240528
Energy: 1.014276479134398
Energy: 1.2495566177972952
Energy: 1.186900561772678
Energy: 1.4813465638735586
Energy: 1.1607269863583438
Energy: 1.0918963558050998
Energy: 1.4826338417062552
Energy: 1.159838871347342
Energy: 1.352295437789234
Energy: 1.4801637309923454
Energy: 1.3198864587219643
Energy: 1.2684874919839713
Energy: 1.481799278826406
Energy: 1.319258020119096
Energy: 1.1394649221398292
Energy: 1.347814858656005
Energy: 1.0816371652207257
Energy: 1.2151418645600274
Energy: 1.3485507093388707
Energy: 1.0817869235376985
Energy: 1.1402652658542123
Energy: 1.4669042469971536
Energy: 1.0268160573537983
Energy: 1.0281651012006476
Energy: 1.4510452101748645
Energy: 1.1377814462176137
Energy: 1.4967716480674573
Energy: 1.6182026219816863
Energy: 1.1375354140744915
Energy: 1.1379029989125935
Energy: 1.3644402419466737
Energy: 1.137488045924376
Energy: 1.3239472552974116
Energy: 1.332594374299138
Energy: 1.3277967465357907
Energy: 1.3278317673062714
Energy: 1.3315533659495908
Energy: 1.3384475788605925
Energy: 1.3286578598236118
Energy: 1.2497533617962702
Energy: 1.0615032356935261
Energy: 1.1874831653122517
Energy: 1.2496381222605477
Energy: 0.9556363209185796
Energy: 1.1874799970399332
Energy: 1.1580642575909976
Energy: 1.1913752039545182
Energy: 1.2041954583441177
Energy: 1.159549150804358
Energy: 1.1901591614475238
Energy: 1.09196632719393
Energy: 1.2688522071606827
Energy: 1.3559720151800057
Energy: 1.4871803990329522
Energy: 1.2703425469107272
Energy: 1.4503138539975262
Energy: 1.2270228482469454
Energy: 1.578450793853645
Energy: 1.3509060900520073
Energy: 1.1915291895324394
Energy: 1.4395155047610522
Energy: 1.3508496750539236
Energy: 1.214811891666484
Energy: 1.079956456395728
Energy: 1.5370682628035903
Energy: 1.2251270013313706
Energy: 1.0136784284209532
Energy: 1.4486929181939587
Energy: 1.0143783838860734
Energy: 1.1375629190773597
Energy: 1.4161968862173802
Energy: 1.2977205951314674
Energy: 1.1376129106615587
Energy: 1.3243884640265613
Energy: 1.138353569617953
Energy: 1.5606835854610015
Energy: 1.1550452228261083
Energy: 1.195360147199892
Energy: 1.56197397679366
Energy: 1.1559994390542607
Energy: 1.6308340725472321
Energy: 1.367760502657363
Energy: 1.4090102245431793
Energy: 1.4094097395259804
Energy: 1.3693569410556754
Energy: 1.4215261029576813
Energy: 1.4095641094242886
Energy: 1.0137559222113586
Energy: 1.2167621219638038
Energy: 1.1753267448751776
Energy: 1.0152452642185275
Energy: 1.2157902460495242
Energy: 1.1476090619235801
Energy: 1.4823700990213522
Energy: 1.1600571815015572
Energy: 1.0917652918424563
Energy: 1.4730976545386907
Energy: 1.1593066381757893
Energy: 1.3532202799148916
Energy: 1.3476582939367034
Energy: 1.3194581157541663
Energy: 1.2920253144493565
Energy: 1.3484404523777986
Energy: 1.3193514893409994
Energy: 1.2147878604934512

minimum gb energy = 0.9556363209185796 eV
minimum distance =  2.48250589055391 Angstroms
sigma value = 27


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

Energy: 1.2572050330619284
Energy: 1.825195590134491
Energy: 1.4424485229413269
Energy: 1.1440421580853342
Energy: 1.8374059268761456
Energy: 1.5628803078757174
Energy: 1.6137720745598776
Energy: 1.1885057235355148
Energy: 1.188546532500114
Energy: 1.5443924409886074
Energy: 1.1892435261885002
Energy: 1.3100628890618389
Energy: 1.56666856470199
Energy: 1.030047667794438
Energy: 1.0301462961384733
Energy: 1.5676876153892363
Energy: 1.03100921268989
Energy: 1.1549319136662364
Energy: 1.5786037569343492
Energy: 1.2057674467119985
Energy: 1.43009646810234
Energy: 1.5804529495344504
Energy: 1.2058310398409546
Energy: 1.3232407025767965
Energy: 1.4494269428085083
Energy: 1.364783544545332
Energy: 1.4423602823240542
Energy: 1.4048066613836943
Energy: 1.3651217543600218
Energy: 1.4017486399705397
Energy: 1.1396805245671837
Energy: 1.0663657021808248
Energy: 1.1361326629272654
Energy: 1.0638371401576303
Energy: 1.1457238682841857
Energy: 1.3256509370499863
Energy: 1.1787639560228005
Energy: 1.0943924603161288
Energy: 1.3776891306752896
Energy: 1.180092595519806
Energy: 1.5500331201984436
Energy: 1.2359783445215293
Energy: 1.3945712700107287
Energy: 1.3856852763452197
Energy: 1.451011606026222
Energy: 1.1805077443032501
Energy: 1.5209824281724336
Energy: 1.482800683317711
Energy: 1.570378348584536
Energy: 1.5295598206360572
Energy: 1.5848023238412015
Energy: 1.522389890813962
Energy: 1.7061584433233683
Energy: 1.559352398037745
Energy: 1.0639995795455301
Energy: 1.0747221303096652
Energy: 1.1608474377172497
Energy: 1.06377645125914
Energy: 1.276300034775719
Energy: 1.0551015926522709
Energy: 1.2030030585556188
Energy: 0.9964057983475993
Energy: 0.9977522028577703
Energy: 1.2025094411208657
Energy: 1.0329416187779394
Energy: 1.1783044555448716
Energy: 1.6168345326188245
Energy: 1.3529629703887878
Energy: 1.331734434961509
Energy: 1.549458436484788
Energy: 1.352765332607719
Energy: 1.4457702957108713

minimum gb energy = 0.9964057983475993 eV
minimum distance =  2.50698734091804 Angstroms
sigma value = 9


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

Energy: 1.7986425615002193
Energy: 1.9563497542747692
Energy: 1.381843980282256
Energy: 1.8013199151389687
Energy: 1.9552666216716499
Energy: 1.530534975423632
Energy: 1.5352520959683476
Energy: 1.1030145307567158
Energy: 1.1036627549040423
Energy: 1.6409980708206506
Energy: 1.1031890343444977
Energy: 1.1862541077716564
Energy: 1.1644090915779273
Energy: 0.8788736300531383
Energy: 0.9374154406252935
Energy: 1.1646908751216745
Energy: 0.8789935962726382
Energy: 1.1297648500095565
Energy: 1.1364419084218615
Energy: 1.074896329462223
Energy: 1.1043349410584278
Energy: 1.139449196499361
Energy: 1.133389840984598
Energy: 1.0614536452639598
Energy: 1.4026515926486751
Energy: 1.4312881881495574
Energy: 1.3406507631138924
Energy: 1.4019784377222775
Energy: 1.6134688173259915
Energy: 1.2659007494564294
Energy: 1.201288236830666
Energy: 1.2551017824757327
Energy: 1.3260234334565986
Energy: 1.2023597066253864
Energy: 1.3430322348327028
Energy: 1.2110192749312878
Energy: 1.061286491495057
Energy: 1.3355352054851921
Energy: 1.0920288379162824
Energy: 1.0147153998449605
Energy: 1.3989471527058925
Energy: 1.0443848072822013
Energy: 1.0334615258091933
Energy: 1.0757372187308614
Energy: 1.2663098023567547
Energy: 1.0334616351965273
Energy: 1.1385058937674126
Energy: 1.0891909020745139
Energy: 1.4276323109328253
Energy: 1.2818665767257682
Energy: 1.205766906261061
Energy: 1.4183349940297425
Energy: 1.4164497063566912
Energy: 1.2372216314800617
Energy: 1.3431085722084244
Energy: 1.2050551338082531
Energy: 1.2691812846872668
Energy: 1.3384593471388602
Energy: 1.4565612316002998
Energy: 1.2088241994926754
Energy: 1.4589813926277
Energy: 0.9519240352174224
Energy: 0.952144554863562
Energy: 1.4611412966951673
Energy: 1.034544699996771
Energy: 1.2229937906073307
Energy: 1.5923240524649334
Energy: 0.9970256136113803
Energy: 0.9976410478971603
Energy: 1.5924668347079272
Energy: 0.9988986561326407
Energy: 1.0483731294985013
Energy: 1.5681437887201157
Energy: 1.56993562848804
Energy: 1.270382635418074
Energy: 1.5711234998213803
Energy: 1.5698159075772655
Energy: 1.3895693770249848
Energy: 1.171166772761599
Energy: 1.360466278130284
Energy: 1.262830033584647
Energy: 1.1751484880719376
Energy: 1.383038660645107
Energy: 1.3007242179757361
Energy: 0.9931360657042969
Energy: 0.8927090776332914
Energy: 0.8962726332313341
Energy: 1.000045661309694
Energy: 0.9344174683102586
Energy: 1.1211038898154024
Energy: 0.9533607852366416
Energy: 1.050766343860001
Energy: 1.116016055859376
Energy: 0.9525277050576592
Energy: 1.1629456964871292
Energy: 1.0187556165825091
Energy: 1.1671085631036393
Energy: 1.4559403700804077
Energy: 1.4165994365395864
Energy: 1.1682763867386763
Energy: 1.5522421435571245
Energy: 1.1402200957492654
Energy: 1.6357809015500455
Energy: 1.4646728593405347
Energy: 1.4590186377860561
Energy: 1.4152050922892616
Energy: 1.5607731142686994
Energy: 1.3936107020913358
Energy: 1.0330171423793844
Energy: 1.3772025652878026
Energy: 1.3692866978232052
Energy: 1.1992347593539892
Energy: 1.3290174554756993
Energy: 1.1994072003237888
Energy: 0.9216005753632875
Energy: 0.8685082376732364
Energy: 0.9619316195910902
Energy: 0.9232081035832143
Energy: 0.8856219584629511
Energy: 0.9877211612879543
Energy: 0.9667654417958608
Energy: 1.07065069587081
Energy: 1.0982326050132851
Energy: 0.9781549346912392
Energy: 1.0880758809374673
Energy: 1.2101450009606867
Energy: 1.770469510770412
Energy: 1.4927446179389208
Energy: 1.5503242803458375
Energy: 1.7717097113402551
Energy: 1.5175366057709176
Energy: 1.4269505933719513
Energy: 1.8255756956505036
Energy: 1.2924353896154261
Energy: 1.2540851788079614
Energy: 1.8239302917714308
Energy: 1.3878636039570766
Energy: 1.3439648403446944
Energy: 1.27811042881217
Energy: 0.9788427875692433
Energy: 1.0303590575336419
Energy: 1.288150189923804
Energy: 0.980016792723404
Energy: 1.13991182518668
Energy: 1.1348990819416742
Energy: 1.0122359948858108
Energy: 1.0426275863197285
Energy: 1.1372842141126462
Energy: 0.9536149955485936
Energy: 1.131642794987809
Energy: 1.3011634327771906
Energy: 1.2886286198814731
Energy: 1.2269850951262817
Energy: 1.3004209946947916
Energy: 1.2636512715892039
Energy: 1.2015918775785073
Energy: 1.5555513563916832
Energy: 1.2484542450861873
Energy: 1.1688209792522075
Energy: 1.5540095686509385
Energy: 1.3412795097741466
Energy: 1.590887625766899
Energy: 1.0134222822292844
Energy: 1.2915932012835019
Energy: 1.1425394986421225
Energy: 1.0134578099230152
Energy: 1.285802870028398
Energy: 0.9729188808109804
Energy: 1.033259891147333
Energy: 1.2796041316820248
Energy: 1.2328790419069071
Energy: 1.0344736647475146
Energy: 1.4186583024955655
Energy: 1.073652025815392
Energy: 1.5988927123118741
Energy: 1.0756389464867975
Energy: 1.2022601437825138
Energy: 1.335359083421803
Energy: 1.1390948836496957
Energy: 1.2136635049477729
Energy: 1.4561560439725576
Energy: 1.3661644518779588
Energy: 1.2565206242170452
Energy: 1.3306375851817107
Energy: 1.3695514934075126
Energy: 1.2195448077526025
Energy: 1.3411355792434936
Energy: 1.0320021025622859
Energy: 1.2464348434499375
Energy: 1.3420592290375872
Energy: 1.113780512539064
Energy: 1.2092435826102015
Energy: 1.5422409541601014
Energy: 1.0623192983615406
Energy: 1.0627327811602365
Energy: 1.415746378629795
Energy: 1.063061952254269
Energy: 1.0623169271725765
Energy: 1.5563986834230152
Energy: 1.2941051073978291
Energy: 1.3697591163657805
Energy: 1.5577919653235364
Energy: 1.2941578442536696
Energy: 1.379858929213193
Energy: 1.6561543485277719
Energy: 1.3578304082413268
Energy: 1.3013802549274902
Energy: 1.6575677999760545
Energy: 1.5458915482840605
Energy: 1.2966779609177885
Energy: 1.2555161920340483
Energy: 1.0289482358523265
Energy: 1.120895811815071
Energy: 1.1934792211501153
Energy: 1.0677793746058375
Energy: 1.074562157239382
Energy: 0.8767489297300974
Energy: 1.0545202949290862
Energy: 1.0767158133675803
Energy: 0.8779258565045721
Energy: 1.07930408727289
Energy: 0.9832096150146096
Energy: 1.0954926751305836
Energy: 1.3470629009874366
Energy: 1.305035686286888
Energy: 1.0956232591140131
Energy: 1.0319330615953395
Energy: 1.109615181448914
Energy: 1.9138330225266351
Energy: 1.46171369119588
Energy: 1.3623297202700344
Energy: 1.9136759684828626
Energy: 1.5549577149696423
Energy: 1.6613238336964966
Energy: 1.2244011280447498
Energy: 1.3263639735433241
Energy: 1.2884909137054732
Energy: 1.2245154312318303
Energy: 1.0302547115860061
Energy: 1.21651912347984
Energy: 0.8825683122224572
Energy: 0.9223038888381633
Energy: 0.9616207024770363
Energy: 0.8838130726346688
Energy: 0.8840413027570609
Energy: 0.9502854271238492
Energy: 1.0117039954960376
Energy: 0.9048010855445535
Energy: 0.8820708286040959
Energy: 1.0096999125662023
Energy: 0.9230846385179916
Energy: 1.010184251229912
Energy: 1.8247419842171726
Energy: 1.3356318457269858
Energy: 1.3361688824882172
Energy: 1.7750624670519928
Energy: 1.3678785506637412
Energy: 1.3310704432300653

minimum gb energy = 0.8685082376732364 eV
minimum distance =  2.55344355546357 Angstroms
sigma value = 57


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

Energy: 0.4058471065257348
Energy: 1.4412762013537577
Energy: 0.4146541213329386
Energy: 0.40876437634256735
Energy: 1.441097767350831
Energy: 0.40633663030254724
Energy: 0.4848882850570068
Energy: 0.44645955183034736
Energy: 0.44680832430297934
Energy: 0.5875072914726798
Energy: 0.44574564971491176
Energy: 0.5605288565028431
Energy: 0.4876942739402537
Energy: 0.4470229774593115
Energy: 0.574534601824608
Energy: 0.4876037317726161
Energy: 0.44694271136921043
Energy: 0.5741693558420603
Energy: 1.4765981248401405
Energy: 1.3044878543022176
Energy: 1.3035642231047455
Energy: 1.4770526145602019
Energy: 1.181386447643735
Energy: 1.3022954925670498
Energy: 0.484175577645421
Energy: 0.40667914212294687
Energy: 0.4069206067994571
Energy: 0.4850968163586949
Energy: 0.406541580240177
Energy: 0.5736596686741104
Energy: 0.44766741540455945
Energy: 0.4064196438000238
Energy: 0.40656461427481166
Energy: 0.4474894207096432
Energy: 0.40644339412456504
Energy: 0.43453043384128337
Energy: 0.4428270113054285
Energy: 0.5896325139895764
Energy: 0.5733911305404059
Energy: 0.44366891706983047
Energy: 0.48482068213659807
Energy: 0.5727175066904827
Energy: 1.1686920251539779
Energy: 1.2810435287945123
Energy: 1.2827463215146708
Energy: 1.1661311063173423
Energy: 1.4754142266836112
Energy: 1.2859919433673415
Energy: 0.48600018113663945
Energy: 0.4916458910428103
Energy: 0.5900908820070097
Energy: 0.4867096145422747
Energy: 0.487834139629023
Energy: 0.5896993341704609
Energy: 0.4063187796395022
Energy: 0.4875774193252684
Energy: 0.4144486297943006
Energy: 0.4064006737298224
Energy: 0.4874291351269866
Energy: 0.4066836283192765
Energy: 0.406385050902963
Energy: 0.447261927173951
Energy: 0.447121665363328
Energy: 0.4065161079081374
Energy: 0.44748870685826336
Energy: 0.6287216209147436
Energy: 0.48606917820317735
Energy: 0.4468630958172457
Energy: 0.5741388537652163
Energy: 0.4865703226313894
Energy: 0.4460419176608925
Energy: 0.573959515600742
Energy: 1.4758587846583269
Energy: 1.2788040744421467
Energy: 1.2781561455581452
Energy: 1.4749300004127908
Energy: 1.1476487173269643
Energy: 1.2773420450431974
Energy: 0.48479844832881575
Energy: 0.5738461029206816
Energy: 0.5735670923125055
Energy: 0.48569398153950155
Energy: 0.5878686186290315
Energy: 0.5742136336297303
Energy: 0.48779553642001905
Energy: 0.40621279499743795
Energy: 0.406300557739791
Energy: 0.4875304641657725
Energy: 0.40896799010069307
Energy: 0.6347849748474885
Energy: 0.44560755861937085
Energy: 0.44601452841684547
Energy: 0.7743273361442028
Energy: 0.44593440728451955
Energy: 0.4067576763229042
Energy: 0.5609641691528718
Energy: 0.4470322296197017
Energy: 0.5743136708864441
Energy: 0.5745968794809669
Energy: 0.44668889048028626
Energy: 0.48878758755183654
Energy: 0.5741342432116844
Energy: 1.1749457533644838
Energy: 1.199403354083507
Energy: 1.2989231948322209
Energy: 1.175220407183895
Energy: 1.475124662628717
Energy: 1.300005128843884
Energy: 0.4064081134574094
Energy: 0.4867425867803316
Energy: 0.49022870272147717
Energy: 0.406544274283257
Energy: 0.48551092513216154
Energy: 0.5734773800532798

minimum gb energy = 0.4058471065257348 eV
minimum distance =  2.60914193548403 Angstroms
sigma value = 11


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

Energy: 1.44496151504376
Energy: 1.9290851166456815
Energy: 1.4248168864699786
Energy: 1.4476826861090737
Energy: 1.9285615857828788
Energy: 1.5702603998134093
Energy: 1.3589526160405172
Energy: 0.9297634822857274
Energy: 0.8591039443082651
Energy: 1.1149220751913864
Energy: 0.9246929541456225
Energy: 0.8489134312604794
Energy: 0.8838647843405542
Energy: 0.7920675685656162
Energy: 0.8408513387145391
Energy: 0.8532367801620058
Energy: 0.7740663391908282
Energy: 0.854593939948389
Energy: 0.8606427435481493
Energy: 0.8810985720098307
Energy: 0.9914666640882787
Energy: 0.8625702565988954
Energy: 0.9807059775844374
Energy: 0.8669306349545791
Energy: 1.1086363362286122
Energy: 1.4561698749595606
Energy: 1.4105500005285823
Energy: 1.1032737497381697
Energy: 1.6805722113644699
Energy: 1.0352899536555216
Energy: 1.7922368795908707
Energy: 1.61066326183803
Energy: 1.4247530906399966
Energy: 1.7801874698417819
Energy: 1.634312579159995
Energy: 1.6510418872950459
Energy: 1.1121968643560969
Energy: 1.1648015895511536
Energy: 0.986469019489427
Energy: 1.1147486940994646
Energy: 0.9493512384590178
Energy: 0.9761897385451819
Energy: 0.8064512631259673
Energy: 0.841422645191706
Energy: 0.8925080536495189
Energy: 0.8127761251447297
Energy: 0.8305104702469207
Energy: 1.014827610109812
Energy: 1.476098112757288
Energy: 0.8925362508955172
Energy: 0.8463184298211893
Energy: 1.4263116866399494
Energy: 1.0106341002684056
Energy: 0.8595986541452965
Energy: 1.3275008704656093
Energy: 1.4545156214172945
Energy: 1.3909632972500512
Energy: 1.3396200863313668
Energy: 1.45696648578692
Energy: 1.3790134343570204
Energy: 1.6715659300553525
Energy: 1.4718984669681636
Energy: 1.4357355530076412
Energy: 1.4617639075707503
Energy: 1.4761758861160899
Energy: 1.2996890991883718
Energy: 1.2627709613132487
Energy: 1.1183970642718735
Energy: 1.1919119683967057
Energy: 1.282113846749428
Energy: 1.1147717676276017
Energy: 1.1676040866961712
Energy: 1.032144112422468
Energy: 1.092303183796824
Energy: 1.074813990852597
Energy: 1.0329938661656906
Energy: 1.1183500369928474
Energy: 1.0434454142355092
Energy: 1.0663778142576643
Energy: 1.132912907254643
Energy: 1.0350603086918344
Energy: 1.059373542117912
Energy: 1.4501006322372039
Energy: 1.0454259367571783
Energy: 1.285505334049041
Energy: 1.2626745518568883
Energy: 1.1964653471309528
Energy: 1.2870411720253072
Energy: 1.2830150688293198
Energy: 1.3219878183715792
Energy: 1.4021466930246251
Energy: 1.2108956955630714
Energy: 1.2068811199002325
Energy: 1.3366455812420732
Energy: 1.3854911927413271
Energy: 1.2072705492903955
Energy: 1.1371788077333145
Energy: 1.3223055112890745
Energy: 1.2556553959748915
Energy: 1.139168147313128
Energy: 1.3235179651653843
Energy: 1.2937291443339314
Energy: 1.5798775486713736
Energy: 1.0798326937642249
Energy: 1.0800973117334063
Energy: 1.4194229078843683
Energy: 1.0752120343719023
Energy: 1.1215959162242013
Energy: 1.3734592644312558
Energy: 0.9914922299768685
Energy: 0.9876256259414948
Energy: 1.2281535913274932
Energy: 0.9804582538890046
Energy: 1.0197175750124183
Energy: 0.9870549824990964
Energy: 1.0506445908198698
Energy: 1.1620462136301393
Energy: 0.9891809332779511
Energy: 1.0555065178127743
Energy: 1.197423510636861
Energy: 1.5575454263923585
Energy: 1.2836381589201928
Energy: 1.2706969998728102
Energy: 1.3773044684241889
Energy: 1.5566317468515845
Energy: 1.2731680734163864
Energy: 1.5795988342440854
Energy: 1.4450092632402016
Energy: 1.3167589806769557
Energy: 1.5809550869502675
Energy: 1.4669463267480853
Energy: 1.4787637642419464
Energy: 1.1351819245583343
Energy: 1.1866506562398016
Energy: 0.9882346123829031
Energy: 0.9993325963870743
Energy: 1.5792573320154617
Energy: 0.9888132196384193
Energy: 0.8318773335564873
Energy: 0.9751400566482813
Energy: 1.0209393277583192
Energy: 0.8327980521032415
Energy: 0.9713351833569478
Energy: 0.9057844325559635
Energy: 1.0128208677701354
Energy: 0.9510156136533046
Energy: 0.9884891016138748
Energy: 0.9646923986423781
Energy: 0.950906231835145
Energy: 1.017900032758234
Energy: 1.8432162492695077
Energy: 1.216408846282584
Energy: 1.1933208485117721
Energy: 1.703780409464284
Energy: 1.5291530734735224
Energy: 1.3818861861045995

minimum gb energy = 0.7740663391908282 eV
minimum distance =  2.54374869599451 Angstroms
sigma value = 41


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

Energy: 1.3976417160903447
Energy: 1.819075754168489
Energy: 1.5328577579308693
Energy: 1.399752849251303
Energy: 1.8184972194918316
Energy: 1.2622022637263528
Energy: 1.494895978160532
Energy: 1.0921726447263191
Energy: 1.1092366744513804
Energy: 1.1461297001021151
Energy: 1.0918397209794986
Energy: 1.1093405627762287
Energy: 0.8559122106825385
Energy: 0.9145399723272887
Energy: 0.9755049378405011
Energy: 0.855022403370587
Energy: 0.8894492152237217
Energy: 0.9519313700943175
Energy: 0.9961518795970355
Energy: 1.0999841700266668
Energy: 1.0893159022158174
Energy: 0.9344979765787906
Energy: 0.9993452632479503
Energy: 0.9234293002105274
Energy: 1.1051462278538737
Energy: 1.547075644426751
Energy: 1.522387073973107
Energy: 1.1052198909585784
Energy: 1.6426446861578186
Energy: 1.0495403705152382
Energy: 1.2296889188843978
Energy: 1.5368343612385962
Energy: 1.388174656551754
Energy: 1.5930549216454872
Energy: 1.6907403400341057
Energy: 1.3799055363241837
Energy: 1.243100260757087
Energy: 1.2011494438509023
Energy: 1.1659208933098006
Energy: 0.9980383228780205
Energy: 1.186914576070472
Energy: 1.1133789995647705
Energy: 0.9316379731650999
Energy: 0.9914620109797118
Energy: 1.074975214818827
Energy: 0.9341150143050988
Energy: 1.0014806674250625
Energy: 1.0833218517909686
Energy: 1.5644659078684517
Energy: 0.9504886919344161
Energy: 0.9454498773351034
Energy: 1.3390235381133557
Energy: 0.9593643541470931
Energy: 0.968373456712618
Energy: 1.1831316188645047
Energy: 1.287234793842615
Energy: 1.3312347509438203
Energy: 1.1844846735157744
Energy: 1.287527004922115
Energy: 1.3362234417780396
Energy: 1.452480295319781
Energy: 1.5344967557143594
Energy: 1.447778086825683
Energy: 1.4515898923796418
Energy: 1.5292919119706903
Energy: 1.1739115496725467
Energy: 1.5524887845783462
Energy: 1.2654296532040932
Energy: 1.2488918864560943
Energy: 1.5350881343056544
Energy: 1.3514410161898012
Energy: 1.2548076133275232
Energy: 1.2381048882116503
Energy: 1.2650216925229911
Energy: 1.2253404470119162
Energy: 1.2378525778203306
Energy: 1.3512261980251816
Energy: 1.182426624149103
Energy: 0.9905936971978183
Energy: 1.1144889987184075
Energy: 0.9670012262984161
Energy: 0.9919967773197103
Energy: 1.1367011483411456
Energy: 0.9670501177400123
Energy: 0.9639419868699757
Energy: 1.1741551091741236
Energy: 1.1732944559771623
Energy: 0.9495043777113363
Energy: 1.1654852868616
Energy: 1.1251541513906422
Energy: 1.1474581837797082
Energy: 1.1169126040994333
Energy: 1.117107407747677
Energy: 1.117368208697227
Energy: 1.261835295498682
Energy: 1.1509548541689922
Energy: 1.4166876550510499
Energy: 1.7491864992625918
Energy: 1.5443691487119613
Energy: 1.4178260354612162
Energy: 1.6954554470539347
Energy: 1.4029691137699556
Energy: 1.8816621039834442
Energy: 1.0943117214996112
Energy: 1.1493353547606513
Energy: 1.4655401547743772
Energy: 1.0776304384567008
Energy: 1.390510952747013
Energy: 1.0983417521179382
Energy: 0.9031367474835909
Energy: 0.8960364035311116
Energy: 1.0997450825326371
Energy: 0.8926572641131614
Energy: 0.9374868890549993
Energy: 0.8741483389471782
Energy: 0.9255881110797425
Energy: 0.9386913647068441
Energy: 0.8757581227239403
Energy: 0.8588351121068091
Energy: 0.9272007659160538
Energy: 0.9979518050667449
Energy: 1.089606557671216
Energy: 0.8992989487379786
Energy: 0.9348528523968317
Energy: 1.1543214160521966
Energy: 0.9221310747300752
Energy: 1.7730489227351798
Energy: 1.6387115359883448
Energy: 1.462416923314762
Energy: 1.7586705597693786
Energy: 1.6807067184577158
Energy: 1.4383788339867587
Energy: 1.221787059977774
Energy: 1.1205392375794783
Energy: 1.0971598868207033
Energy: 1.2004024622627214
Energy: 1.07883356659599
Energy: 1.1726051058098586
Energy: 0.9314778583764433
Energy: 1.0063718757342928
Energy: 1.084298610118393
Energy: 0.9342479332637897
Energy: 1.004560201111274
Energy: 1.0243684183092403
Energy: 1.4630457770736665
Energy: 0.9506690124033054
Energy: 0.9452753449371161
Energy: 1.207570208427874
Energy: 0.9501591853637367
Energy: 0.9683438710095686
Energy: 1.495670021289749
Energy: 1.1691871262104852
Energy: 1.2014757673084422
Energy: 1.235188013370526
Energy: 1.1691937210613887
Energy: 1.2455990221583226
Energy: 1.1656699907469343
Energy: 1.3337937936063462
Energy: 1.3651509164529638
Energy: 1.1829286234344762
Energy: 1.3338553423026613
Energy: 1.5640968132150321
Energy: 1.5512148078603478
Energy: 1.2132648035375
Energy: 1.1536596161885295
Energy: 1.588394329523788
Energy: 1.1753677699566234
Energy: 1.278900243810512
Energy: 1.3146076458190168
Energy: 1.3686513731118488
Energy: 1.368066417927286
Energy: 1.315363522351417
Energy: 1.4032270077894144
Energy: 1.2483487349516924
Energy: 0.9919727415839649
Energy: 1.2620527934091452
Energy: 0.9674592563057982
Energy: 0.9925476729603122
Energy: 1.5299983933516923
Energy: 0.9889806975221505
Energy: 0.9272535758818574
Energy: 1.1713864430019345
Energy: 1.0750857466579185
Energy: 0.9270476469828783
Energy: 1.1665385630474574
Energy: 1.0516878204771356
Energy: 1.1068457867102781
Energy: 1.1564010666769835
Energy: 1.2327067878724705
Energy: 1.1407061808818217
Energy: 0.8884988190873682
Energy: 1.1885351093874246
Energy: 1.4904142687270685
Energy: 1.2369569678271215
Energy: 1.4340150864861017
Energy: 1.4266341044111748
Energy: 1.20895218675692
Energy: 1.4798965331939575

minimum gb energy = 0.855022403370587 eV
minimum distance =  2.49380840482555 Angstroms
sigma value = 33


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

Energy: 1.1683105145221093
Energy: 1.6679514076753819
Energy: 1.332793226474636
Energy: 1.1692397035737294
Energy: 1.668246208436496
Energy: 1.4951868142066047
Energy: 1.1924314632909563
Energy: 0.9956254029215061
Energy: 0.9740168352612442
Energy: 1.2672528600774051
Energy: 0.9269547982830775
Energy: 1.0137765508874725
Energy: 0.9639862703723878
Energy: 1.0264992561601263
Energy: 1.0276070044192371
Energy: 0.9651177536886041
Energy: 0.9982120234069015
Energy: 1.019356352693734
Energy: 1.0240785150622147
Energy: 1.1205473391640848
Energy: 1.075029157347432
Energy: 1.025151461730041
Energy: 1.1577566199100195
Energy: 1.0068707297962396
Energy: 1.2022359797816675
Energy: 1.474275074886281
Energy: 0.9895498358828616
Energy: 1.19602842829553
Energy: 1.5636963859957198
Energy: 1.2547790686479112
Energy: 1.636294589835017
Energy: 1.3676330561446928
Energy: 1.2980293908531275
Energy: 1.6394925508471945
Energy: 1.4107996098479338
Energy: 1.303685152179523
Energy: 1.2391815167060696
Energy: 1.2375835195259806
Energy: 1.1680274555253625
Energy: 1.2778391705264083
Energy: 0.9852895013210923
Energy: 1.1317750348720184
Energy: 1.083743058799415
Energy: 1.1112728148436093
Energy: 1.1206330571609595
Energy: 1.0859880440638456
Energy: 1.201119993174381
Energy: 1.157146270618247
Energy: 1.6420067771790658
Energy: 0.9908144182126888
Energy: 0.9890132820484141
Energy: 1.5100077575238677
Energy: 0.9668918033042867
Energy: 0.9697267586230752
Energy: 1.4083039463211713
Energy: 1.044571982455773
Energy: 1.097626877714198
Energy: 1.4098326735654745
Energy: 1.0467281128750794
Energy: 1.0977665956829665
Energy: 1.3128169756702117
Energy: 1.2996779422103095
Energy: 1.3156492521098637
Energy: 0.9661324240773747
Energy: 1.2612289357603683
Energy: 1.3509971615161738
Energy: 1.4189373207007145
Energy: 1.5361944446772757
Energy: 1.4200136543741844
Energy: 1.4188916441865986
Energy: 1.5906274941738037
Energy: 1.4114681849590416
Energy: 1.1933112519230777
Energy: 1.60705006250083
Energy: 1.4123988573766195
Energy: 1.1938126715150814
Energy: 1.6077057484096746
Energy: 1.4114624137217784
Energy: 1.010544639052999
Energy: 0.9899725799146887
Energy: 1.0172930682398533
Energy: 0.9371638572405552
Energy: 1.2365636749677522
Energy: 0.9948005180407951
Energy: 0.9108210820954387
Energy: 0.9899261857051833
Energy: 1.034396807167982
Energy: 0.9691195797664198
Energy: 0.9803404671990668
Energy: 1.034282286289454
Energy: 1.3265065296387724
Energy: 1.0257316569024895
Energy: 1.0250856402119548
Energy: 1.4228992001884708
Energy: 1.0269022393263894
Energy: 0.9987956998060347
Energy: 1.4062414030859705
Energy: 1.6298066940290838
Energy: 1.127580967601193
Energy: 1.408686479631128
Energy: 1.618425674993606
Energy: 1.2905086372495684
Energy: 1.6639820213620709
Energy: 1.3165332275720292
Energy: 1.316823057777847
Energy: 1.5505782248849793
Energy: 1.3413663515157954
Energy: 1.1032320758795309
Energy: 1.1379212811729582
Energy: 1.1969671500150438
Energy: 1.096456924496489
Energy: 1.2165236968543311
Energy: 1.0604953815386826
Energy: 1.1720556391679513
Energy: 1.044658581244354
Energy: 1.1471447315801866
Energy: 1.051594022168844
Energy: 1.0678472391057217
Energy: 1.0483351485792576
Energy: 1.098198429879964
Energy: 1.1239815126716803
Energy: 0.9743644518916172
Energy: 0.9685570654337223
Energy: 0.9980793419927431
Energy: 1.2865191430762444
Energy: 0.9485284629102579
Energy: 1.1031088023020643
Energy: 1.403368915103663
Energy: 1.3941598255075418
Energy: 1.1045601909753795
Energy: 1.4065771159981795
Energy: 1.1670806775768197
Energy: 1.209221347986875
Energy: 1.0958797828440274
Energy: 1.276297638087001
Energy: 1.220421796599766
Energy: 1.3044480441819433
Energy: 1.3218382617535473
Energy: 1.2413027292243541
Energy: 1.6858887802586686
Energy: 1.3370482642094403
Energy: 1.7604030664886288
Energy: 1.630168726253899
Energy: 1.4732978815059445
Energy: 1.6431268591907444
Energy: 0.9655231529356232
Energy: 0.9656057193944485
Energy: 1.2543318016083336
Energy: 1.1444598243396709
Energy: 1.0590529341931794
Energy: 0.9299537984393899
Energy: 0.9628591041480646
Energy: 0.9748453417918769
Energy: 0.9305212761909017
Energy: 0.9801953103022154
Energy: 0.9734533832817988
Energy: 1.0254546756561558
Energy: 0.9630078753992246
Energy: 0.9787337500389243
Energy: 0.9860559837976038
Energy: 0.9824918790581308
Energy: 0.9842793801820086
Energy: 1.0248860954279086
Energy: 1.1044223549270038
Energy: 1.082738723139309
Energy: 1.1939672501049283
Energy: 1.4275376814491474
Energy: 1.0169088495116645
Energy: 1.6311315574795755
Energy: 1.3658670282117342
Energy: 1.2217143781729345
Energy: 1.7060858123499094
Energy: 1.4360127548379673
Energy: 1.1904878369852745
Energy: 1.239895879458555
Energy: 1.0422140074060147
Energy: 1.1242923512945036
Energy: 1.279364738777682
Energy: 1.4995004081642336
Energy: 1.1216499643842344
Energy: 1.0830340874038413
Energy: 1.1128944185851108
Energy: 1.0166196678980925
Energy: 1.0562776012083477
Energy: 1.182652091654427
Energy: 1.1799441495767742
Energy: 1.7023905343558094
Energy: 0.9900181737596067
Energy: 0.9880811970807425
Energy: 1.681605888358701
Energy: 0.9675528952127042
Energy: 0.9873813716235361
Energy: 1.4060026085810735
Energy: 1.0444148234925448
Energy: 1.0966512729132143
Energy: 1.3318200530064648
Energy: 1.0445521779258742
Energy: 1.0967012860294523
Energy: 1.3517805510856054
Energy: 1.1869400086492088
Energy: 1.2633905401128
Energy: 1.3615451300873391
Energy: 1.0731850150684379
Energy: 1.2823985123817694
Energy: 1.419278605400567
Energy: 1.4351417784266276
Energy: 1.2353562520791828
Energy: 1.331211755923144
Energy: 1.2600420765490628
Energy: 1.268353062289647
Energy: 1.6032227992119692
Energy: 1.5647540068504224
Energy: 1.565861079519593
Energy: 1.506475359903532
Energy: 1.7554642046456574
Energy: 1.3110849375088567
Energy: 1.0117302149406477
Energy: 1.4357495925263972
Energy: 0.9918604268270672
Energy: 0.9241740193171896
Energy: 1.2330790676013894
Energy: 0.9922155118237923
Energy: 0.9389671633195957
Energy: 0.9713879998599586
Energy: 1.0343532729222902
Energy: 0.9400524540238446
Energy: 0.9861173080121057
Energy: 0.9992486528748759
Energy: 1.323991544520877
Energy: 1.0258776910059453
Energy: 1.0052781568933915
Energy: 1.2900127591169988
Energy: 1.0278169505569636
Energy: 1.009759350086282
Energy: 1.4085802179291924
Energy: 1.2029311554002486
Energy: 1.2975459563676501
Energy: 1.4104412956610088
Energy: 1.4597361499446404
Energy: 1.3660166143880466
Energy: 1.5467591451985647
Energy: 1.312679868639612
Energy: 1.312489620201477
Energy: 1.548258902604024
Energy: 1.343490412893194
Energy: 1.1206310674808955
Energy: 1.1378827163964211
Energy: 1.1994377695896463
Energy: 1.0534279008315253
Energy: 1.301365036783985
Energy: 1.198523060495397
Energy: 1.132710118483888
Energy: 1.1159109017980773
Energy: 1.1569273499117032
Energy: 1.1847355642080597
Energy: 1.1171526376078522
Energy: 1.0578434863583839
Energy: 1.1430896273310285
Energy: 0.9936499049728975
Energy: 0.9740798532872084
Energy: 0.9694434136192717
Energy: 0.9949263997605116
Energy: 1.4372504574926108
Energy: 0.9700366061787301
Energy: 1.1080199740900027
Energy: 1.413032559957287
Energy: 1.4190794987290114
Energy: 1.1094518672983187
Energy: 1.406337563726428
Energy: 1.2540857278934923
Energy: 1.2063549808215737
Energy: 1.0960371287510684
Energy: 1.2749275988793252
Energy: 1.2071092422109497
Energy: 1.239384762506615
Energy: 1.3202502270575978
Energy: 1.7562811996203005
Energy: 1.5334154819116474
Energy: 1.3111870230447178
Energy: 1.7546919478741976
Energy: 1.5342447640553125
Energy: 1.4117650241479853

minimum gb energy = 0.9108210820954387 eV
minimum distance =  2.48911868740623 Angstroms
sigma value = 67


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

Energy: 1.2510316703588247
Energy: 1.3634549563337404
Energy: 0.8716801691569942
Energy: 1.2539972202150345
Energy: 1.361946123664851
Energy: 1.2766687107904757
Energy: 1.4850773571085185
Energy: 1.0308638661876417
Energy: 0.9528007237861518
Energy: 1.0909023499834332
Energy: 1.0308573586301384
Energy: 0.8050439825653448
Energy: 1.0618704380603559
Energy: 1.0016690543533264
Energy: 1.1045519192053337
Energy: 1.063220837432045
Energy: 1.0028586116052334
Energy: 1.111380268064424
Energy: 1.064438453630719
Energy: 1.0163341996711648
Energy: 1.1432634613800683
Energy: 1.0599743000688489
Energy: 1.3554409598423405
Energy: 1.00674486343345
Energy: 1.3167709501935283
Energy: 1.1425230480257655
Energy: 1.1225332285797494
Energy: 1.3212992760719913
Energy: 1.2869786352660149
Energy: 1.0173322906156526
Energy: 1.321695697879754
Energy: 1.0654550928540614
Energy: 1.5518447441657195
Energy: 1.3212308406880264
Energy: 1.245830529679138
Energy: 1.462697244949256
Energy: 1.4307857132383799
Energy: 1.0720639700451795
Energy: 1.158845827050181
Energy: 1.3607821657954422
Energy: 1.3504108641654908
Energy: 0.9685720564446384

minimum gb energy = 0.8050439825653448 eV
minimum distance =  2.52684409539414 Angstroms
sigma value = 3


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

Energy: 1.7026835046527782
Energy: 1.756548728551497
Energy: 1.3933628799293578
Energy: 1.7035784771104423
Energy: 1.7919014308967536
Energy: 1.5479037866807877
Energy: 1.55287742515736
Energy: 1.4120272455487155
Energy: 1.5424089815063755
Energy: 1.4558310004910007
Energy: 1.488164675136766
Energy: 1.4360128809423194
Energy: 1.3467880307774607
Energy: 1.3911326963961543
Energy: 1.3281739915745692
Energy: 1.3487155134215565
Energy: 1.4837554879545454
Energy: 1.3647722370247652
Energy: 0.9859956504332145
Energy: 1.2288123078870972
Energy: 1.01995151433267
Energy: 0.9874823017142504
Energy: 1.4778340369270802
Energy: 0.9223528510387493
Energy: 1.148238026082015
Energy: 1.245983505421726
Energy: 1.1804900819442368
Energy: 1.1301294792994792
Energy: 1.3758740516655596
Energy: 1.0766586327838739
Energy: 1.311241602745009
Energy: 1.322396344903544
Energy: 1.2712746972871591
Energy: 1.3100739497638654
Energy: 1.3712782923902185
Energy: 1.302398183376541
Energy: 1.5647918774906147
Energy: 1.2184040826262112
Energy: 1.2497483766560606
Energy: 1.4620789841544224
Energy: 1.2631625246285507
Energy: 1.2722166200395417
Energy: 1.5864397606144147
Energy: 1.53956630093736
Energy: 1.3821080049309824
Energy: 1.5877247001927663
Energy: 1.4927639526199292
Energy: 1.4620351223976125
Energy: 1.5532810962959422
Energy: 1.5451696495057803
Energy: 1.4549025976338645
Energy: 1.4898421678808447
Energy: 1.536922634320592
Energy: 1.4832699986707532
Energy: 1.5639105428038778
Energy: 1.6251666341402133
Energy: 1.3298319434570522
Energy: 1.5569899370209572
Energy: 1.6734839408725362
Energy: 1.5641177269237008
Energy: 1.177111927662059
Energy: 1.3520247482196937
Energy: 1.2057009483899372
Energy: 1.1770261328059053
Energy: 1.5522976643963318
Energy: 1.190927590009264
Energy: 1.4312065906886249
Energy: 1.2840823547426172
Energy: 1.3096473517147982
Energy: 1.3815992359042184
Energy: 1.3379477327440537
Energy: 1.2548388340193055
Energy: 1.4208288348513773
Energy: 1.122806117041769
Energy: 1.1213054289837634
Energy: 1.4098725321142365
Energy: 1.1163482000676703
Energy: 1.1841516987857763
Energy: 1.6188560065249482
Energy: 0.9543892569473293
Energy: 0.9491795685848106
Energy: 1.528861989047941
Energy: 0.9494614266337085
Energy: 0.9490970227525902
Energy: 1.4361796599771017
Energy: 1.0664422082990335
Energy: 1.2762641086648543
Energy: 1.4379439387809088
Energy: 1.0663259590023644
Energy: 1.336329488448825
Energy: 1.4787103000300628
Energy: 1.4730155649796162
Energy: 1.3858523458016017
Energy: 1.4805709344072338
Energy: 1.438071884183197
Energy: 1.494278709174898
Energy: 1.572080380513226
Energy: 1.7721882215026517
Energy: 1.3934221732243304
Energy: 1.563737320298064
Energy: 1.825321186713207
Energy: 1.5812406750235555
Energy: 1.5139913802093588
Energy: 1.4006512221692116
Energy: 1.4942819813649304
Energy: 1.4949587101263406
Energy: 1.3793249475591498
Energy: 1.5605629116250146
Energy: 1.7447804460661125
Energy: 1.3936336410181474
Energy: 1.4239745272417925
Energy: 1.6997575668873453
Energy: 1.3717654707572609
Energy: 1.401904787894232
Energy: 1.5514213706735824
Energy: 1.0739153189980561
Energy: 1.1253872498284405
Energy: 1.7372889600102288
Energy: 1.0799901331879744
Energy: 1.2759132813745409
Energy: 1.4942877627395614
Energy: 1.1592006357793763
Energy: 1.212511212100682
Energy: 1.4226541534149215
Energy: 1.1436614507715372
Energy: 1.1400304588137071
Energy: 1.198840598404985
Energy: 1.3203591081828445
Energy: 1.3217835429772673
Energy: 1.2290708134547397
Energy: 1.3124053061833056
Energy: 1.3038266400076364
Energy: 1.0672553202338633
Energy: 1.3440488819093364
Energy: 1.0533593766836131
Energy: 1.0691767026562657
Energy: 1.5515830491684044
Energy: 1.021035204719023
Energy: 1.2671645769531032
Energy: 1.5359564831017831
Energy: 1.2871975532187512
Energy: 1.2688775177812295
Energy: 1.5278580525366972
Energy: 1.2876346750337127
Energy: 1.5087810327844124
Energy: 1.426162938903082
Energy: 1.4568354170910276
Energy: 1.4362640934336715
Energy: 1.5948001235034062
Energy: 1.4299282651447656
Energy: 1.7131326659777388
Energy: 1.4556759014511371
Energy: 1.4374775182788475
Energy: 1.7159058127235198
Energy: 1.4148145933526726
Energy: 1.4541450888953442
Energy: 1.712094333840328
Energy: 1.358805153986347
Energy: 1.3478012254760623
Energy: 1.8293623856774863
Energy: 1.3749201112479303
Energy: 1.3447233921409436
Energy: 1.4941003458781448
Energy: 1.440209541845039
Energy: 1.3823183267551913
Energy: 1.4542247253426028
Energy: 1.3849133561685916
Energy: 1.343620551522628
Energy: 1.1453162008014266
Energy: 1.453654037537173
Energy: 1.2947112913864953
Energy: 1.146729163154298
Energy: 1.43893072307385
Energy: 1.2296637476868832
Energy: 0.9625651213869593
Energy: 1.3038472507307768
Energy: 0.9656993050196689
Energy: 0.9646358131121535
Energy: 1.5819836686703024
Energy: 0.9481338671369457
Energy: 1.1394183702356324
Energy: 1.3248275217099872
Energy: 1.2916672329126524
Energy: 1.1381371820889288
Energy: 1.320553891844415
Energy: 1.2970129784983866
Energy: 1.4794195934693664
Energy: 1.2560078882032353
Energy: 1.230080879047166
Energy: 1.3579131175198533
Energy: 1.3337351387805734
Energy: 1.2919812300804485
Energy: 1.7050381448643952
Energy: 1.293220978295941
Energy: 1.2717478438382612
Energy: 1.6937926908401577
Energy: 1.3406573892564273
Energy: 1.3653500199126098
Energy: 1.7510815349374818
Energy: 1.4647490288568066
Energy: 1.4713357659084858
Energy: 1.7247162848830324
Energy: 1.5088114435203523
Energy: 1.587839396237731
Energy: 1.4597984284728183
Energy: 1.3799859476740193
Energy: 1.4611916167022665
Energy: 1.466856733720784
Energy: 1.3596135449895275
Energy: 1.506902012616318
Energy: 1.386363163532795
Energy: 1.5117575704489845
Energy: 1.3261590319555858
Energy: 1.361780132437512
Energy: 1.6769307344676383
Energy: 1.4104620767455174
Energy: 1.3257530272695623
Energy: 1.3679263931980365
Energy: 1.21584549054956
Energy: 1.2596561664799142
Energy: 1.5312383702653511
Energy: 1.254772182654272
Energy: 1.3274346981047245
Energy: 1.112856375133505
Energy: 1.231127572172395
Energy: 1.3066374048125096
Energy: 1.1104431894520472
Energy: 1.3168394797583922
Energy: 1.536803433105049
Energy: 0.9318558155335412
Energy: 0.9219076839912533
Energy: 1.504780886951043
Energy: 1.0002502837462097
Energy: 1.0061528235590163
Energy: 1.502780385357465
Energy: 1.130996145611917
Energy: 1.1233538027887
Energy: 1.4659651447374282
Energy: 1.1274040758293042
Energy: 1.1819719516609914
Energy: 1.5974144427933215
Energy: 1.375164484784636
Energy: 1.3827058555079679
Energy: 1.5662077614782919
Energy: 1.3848077140656307
Energy: 1.320497244214772
Energy: 1.4290885253990189
Energy: 1.4504294273855884
Energy: 1.4693470441485001
Energy: 1.3995274417143186
Energy: 1.857598512276202
Energy: 1.3776515930035595
Energy: 1.5922646068206443
Energy: 1.634623518457741
Energy: 1.393479897748492
Energy: 1.5930218178446343
Energy: 1.8990902281112758
Energy: 1.603433443416734
Energy: 1.6469710380846394
Energy: 1.4854160321824126
Energy: 1.4356994296632999
Energy: 1.5663767612761401
Energy: 1.457470328089196
Energy: 1.4577865158004326
Energy: 1.4834304614203633
Energy: 1.1838495510088007
Energy: 1.2555184510889164
Energy: 1.4851740427567461
Energy: 1.194200506143831
Energy: 1.378935381810506
Energy: 1.575949884162323
Energy: 1.0248916205200809
Energy: 1.0028995333997381
Energy: 1.4812928522010944
Energy: 1.0099337991564092
Energy: 1.003074730585798
Energy: 1.3405025217926188
Energy: 1.1811590166722328
Energy: 1.2077050298095477
Energy: 1.2636489466842216
Energy: 1.216470412318782
Energy: 1.2863064455991056
Energy: 1.211063272216284
Energy: 1.286496380854997
Energy: 1.2523025448739011
Energy: 1.2076420492228397
Energy: 1.2940586873424726
Energy: 1.1176474890026256
Energy: 1.0212400970329565
Energy: 1.51908030666793
Energy: 1.2873393777046747
Energy: 1.0865532879654214
Energy: 1.606774078306598
Energy: 1.097916171723713
Energy: 1.549454794328779
Energy: 1.5589904559304213
Energy: 1.3513365436768188
Energy: 1.4505217279667357
Energy: 1.6460721703990202
Energy: 1.4548244349895318
Energy: 1.5614366289064796
Energy: 1.4596730958423658
Energy: 1.5992922000463636
Energy: 1.4619039983795876
Energy: 1.5407185190872068
Energy: 1.4788915356044947

minimum gb energy = 0.9219076839912533 eV
minimum distance =  2.51470929248818 Angstroms
sigma value = 81


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

Energy: 1.6427360585804578
Energy: 1.4779777619947168
Energy: 1.087041322519293
Energy: 1.6388639950169412
Energy: 1.4781295653224458
Energy: 1.3954669226887086
Energy: 1.5502969240342637
Energy: 1.0305866445318346
Energy: 1.0304275852663491
Energy: 1.43175858046052
Energy: 1.0317026177569493
Energy: 0.9267054246681306
Energy: 1.1292400939560194
Energy: 1.1097372511639896
Energy: 1.2169075228801485
Energy: 1.1158104237195086
Energy: 1.1583301477863783
Energy: 1.3185369264819125
Energy: 1.039661099324673
Energy: 1.2423051880659703
Energy: 1.0987663598724862
Energy: 1.041284791162425
Energy: 1.3481931459559136
Energy: 0.9007895657689781
Energy: 1.0283472830081672
Energy: 1.3393495991232944
Energy: 0.9928786394552948
Energy: 1.028316416411086
Energy: 1.3090769287185358
Energy: 0.9693671365671368
Energy: 1.3350266513849571
Energy: 1.2213784957422722
Energy: 1.2213780478067475
Energy: 1.3369233030667613
Energy: 1.3092478651812647
Energy: 1.2211180349411603
Energy: 1.2392553062897302
Energy: 1.0216291224681933
Energy: 0.9079794994423789
Energy: 1.254435550590033
Energy: 1.020828614834759
Energy: 1.1882880937534899
Energy: 1.37439946714053
Energy: 1.4375038456296558
Energy: 1.6278815901492316
Energy: 1.375172494783955
Energy: 1.438741820818868
Energy: 1.1675755701117005
Energy: 1.2518265604741252
Energy: 0.9063931677906321
Energy: 1.3949082777767314
Energy: 1.253591106220098
Energy: 1.379396160136771
Energy: 1.3270278161284286
Energy: 1.371123111577644
Energy: 1.45674407660617
Energy: 1.3608306078330081
Energy: 1.2281491940271798
Energy: 1.6680603643783254
Energy: 1.2179524056362636
Energy: 1.0315170353423806
Energy: 1.5419111811063864
Energy: 1.1337212272423205
Energy: 1.0315443337369254
Energy: 1.5465572493948416
Energy: 0.9890362947056929
Energy: 1.142599764873578
Energy: 1.3018851717226236
Energy: 1.2930005364675476
Energy: 1.1428778990109179
Energy: 1.1707877475035062
Energy: 1.3023361635981943
Energy: 1.1568949509903612
Energy: 1.062569664817069
Energy: 1.0734637865699692
Energy: 1.1116951267726536
Energy: 1.0627871732600285
Energy: 1.3008134385534378
Energy: 1.3373163765545186
Energy: 0.9877410644160324
Energy: 0.9720402737832317
Energy: 1.334603290388035
Energy: 0.9040831776808559
Energy: 0.9690773221869209
Energy: 1.37800278285019
Energy: 1.3011173619678966
Energy: 1.3182169496504117
Energy: 1.3926883906515017
Energy: 1.248974955045127
Energy: 1.294027213188728
Energy: 1.2077320082812995
Energy: 1.1990177071396193
Energy: 1.1808974302193445
Energy: 1.209000293510973
Energy: 1.2545051927651505
Energy: 1.2531964132857603
Energy: 1.4242658525823804
Energy: 1.3762138114173745
Energy: 1.1672427559970748
Energy: 1.4292115668176704
Energy: 1.3800140462741528
Energy: 1.1672595764623428
Energy: 1.2002801413307016
Energy: 1.3668034624470935
Energy: 1.3287286833190977
Energy: 1.1901658974497182
Energy: 1.2524397464858525
Energy: 1.3959609876156027
Energy: 1.6953812567018283
Energy: 1.2281546703529471
Energy: 1.0851700551932029
Energy: 1.5833043066184074
Energy: 1.2272363617124458
Energy: 1.1336348466762913
Energy: 1.694555943429549
Energy: 0.9898855791046524
Energy: 1.1417534507818579
Energy: 1.6409402583368646
Energy: 1.0316084901511262
Energy: 1.1367018264959423
Energy: 1.3617752303476707
Energy: 1.0409976600483148
Energy: 1.1341662823401633
Energy: 1.3629613148646733
Energy: 1.0412874994580603
Energy: 1.1350350329078553
Energy: 1.1081372281261206
Energy: 1.1143340646091484
Energy: 1.2446186767558276
Energy: 1.1094106029654578
Energy: 1.1142179288401262
Energy: 1.2435083514788092
Energy: 0.898783521791436
Energy: 1.1617270887126536
Energy: 0.9693096763242679
Energy: 0.8999960226000215
Energy: 1.336263821096803
Energy: 0.9676576609892559
Energy: 1.083269036638131
Energy: 1.4182523866138994
Energy: 1.2685203262201388
Energy: 1.0986866021415918
Energy: 1.393596073571571
Energy: 1.0796646728146182
Energy: 1.2000736449897773
Energy: 1.3261101283744916
Energy: 1.2691950962052654
Energy: 1.1376317070842403
Energy: 1.3375747479729418
Energy: 1.2257149218178305
Energy: 1.501811448050966
Energy: 1.3231770078139875
Energy: 1.3249530592436802
Energy: 1.5183618491948219
Energy: 1.3242208303787013
Energy: 1.3829910419731966
Energy: 1.4462274392208874
Energy: 1.304145670584095
Energy: 1.389601454652699
Energy: 1.447668951928142
Energy: 1.304278156119724
Energy: 1.3896247973379154
Energy: 1.3625402296937232
Energy: 1.2517866871919991
Energy: 1.2158963953010604
Energy: 1.362199641158608
Energy: 1.5117003498946515
Energy: 1.2043891978537233
Energy: 1.1275556706531924
Energy: 1.3909289647744243
Energy: 1.4692223238234239
Energy: 1.0830640916265675
Energy: 1.6673939372734987
Energy: 1.084505943541881
Energy: 1.0410034691206222
Energy: 1.102887378602686
Energy: 0.9260064279931254
Energy: 1.0421882615135063
Energy: 1.4230602184835508
Energy: 1.1361600626645174
Energy: 1.109642022183603
Energy: 1.1084455005636158
Energy: 1.337295766313239
Energy: 1.1125076253868393
Energy: 1.1082932850339555
Energy: 1.2459666319683438
Energy: 1.4156103690357187
Energy: 0.90054946708401
Energy: 0.9001393639556743
Energy: 1.3106790174517176
Energy: 0.9138821238394813
Energy: 0.900049791976137
Energy: 1.3904442393241827
Energy: 1.061000669297228
Energy: 1.079869546435357
Energy: 1.3923182474951137
Energy: 1.0639679083697056
Energy: 1.0832550270145118
Energy: 1.3350855480306754
Energy: 1.2277952304564315
Energy: 1.1822721689666176
Energy: 1.3283095883182976
Energy: 1.320021448010599
Energy: 1.2032408027836548
Energy: 0.906322723054296
Energy: 1.2031037420110726
Energy: 1.2214156796127624
Energy: 1.0225788017539907
Energy: 1.7099430808312348
Energy: 1.14007212369761
Energy: 1.5446925081682414
Energy: 1.3904516784712866
Energy: 1.167397935105795
Energy: 1.434996783572395
Energy: 1.3765978814910111
Energy: 1.6399685015200627
Energy: 1.4243493352982326
Energy: 1.2004065675764846
Energy: 1.247321644214249
Energy: 1.4247330397235147
Energy: 1.2010893859994092
Energy: 1.1245244224572213
Energy: 1.6395230950188928
Energy: 1.1252864057711618
Energy: 1.0835220498322098
Energy: 1.6411908979939953
Energy: 1.1252888874673244
Energy: 1.2366369433941162

minimum gb energy = 0.898783521791436 eV
minimum distance =  2.52505703394039 Angstroms
sigma value = 43


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

Energy: 1.6973439947826128
Energy: 1.7008029256428512
Energy: 1.3438339972876725
Energy: 1.697235271637333
Energy: 1.7597897320583564
Energy: 1.2252445199922328
Energy: 1.6582218663090407
Energy: 1.3126893626065022
Energy: 1.1790413589638433
Energy: 1.4810190249396173
Energy: 1.3128235800790715
Energy: 1.2856830203817267
Energy: 1.3842727508703185
Energy: 1.4313054873074222
Energy: 1.341733501133945
Energy: 1.3223816902209822
Energy: 1.4765383762626743
Energy: 1.374371827022929
Energy: 1.0080766781592112
Energy: 1.231915946062156
Energy: 1.0187934642079697
Energy: 0.9509529972478195
Energy: 1.436348786384297
Energy: 0.9360437616528139
Energy: 1.1838688960001187
Energy: 1.2429795340952987
Energy: 1.2112527341812431
Energy: 1.1335997633037909
Energy: 1.2815294450276136
Energy: 1.1439036238480436
Energy: 1.3614735946425929
Energy: 1.1897215663309093
Energy: 1.1464817877287872
Energy: 1.3399219207479387
Energy: 1.1876022764871772
Energy: 1.1682979784306877
Energy: 1.4355131045963776
Energy: 0.9509761736467733
Energy: 0.9503981835620676
Energy: 1.421406408912029
Energy: 0.9519200722550238
Energy: 0.9506244103245791
Energy: 1.4984909120765455
Energy: 1.0959100099925314
Energy: 1.1550335181549811
Energy: 1.4634634096280335
Energy: 1.204763577705143
Energy: 1.384362790743706
Energy: 1.4449344974006995
Energy: 1.2435503233758105
Energy: 1.383083027354173
Energy: 1.3724787758168429
Energy: 1.3539352316709201
Energy: 1.3795250176217229
Energy: 1.5296945366882315
Energy: 1.5685568082712886
Energy: 1.376941518826069
Energy: 1.535224242380564
Energy: 1.7166450836959135
Energy: 1.3215659872142433
Energy: 1.4101531474645088
Energy: 1.409403971605935
Energy: 1.3899542331409038
Energy: 1.364496452909686
Energy: 1.6119180101499921
Energy: 1.3865556309160303
Energy: 1.4916176150376956
Energy: 1.2946403860970688
Energy: 1.3347814080272045
Energy: 1.5407611849870655
Energy: 1.2949920798792218
Energy: 1.3926382332679172
Energy: 1.6202262484289776
Energy: 1.1382428035834862
Energy: 1.1560977057888435
Energy: 1.6224287256365164
Energy: 1.138290456610571
Energy: 1.2729470167747163
Energy: 1.4339566939273112
Energy: 1.087270481255934
Energy: 1.1705252897191551
Energy: 1.4555951255088184
Energy: 1.089301806002278
Energy: 1.1824628099215477
Energy: 1.1488305883391445
Energy: 1.3267337084451245
Energy: 1.326349057116649
Energy: 1.1449839130114086
Energy: 1.2274295317335533
Energy: 1.2568508971884078
Energy: 0.9570743295313894
Energy: 1.260701946121251
Energy: 0.9171799145003448
Energy: 0.9564308739310251
Energy: 1.3331431510149783
Energy: 0.9194735342920979
Energy: 1.1102857431037878
Energy: 1.4733058338132958
Energy: 1.283731072085445
Energy: 1.1077589045609644
Energy: 1.4092431902880491
Energy: 1.1365010667032136
Energy: 1.363779292111063
Energy: 1.2455917800225471
Energy: 1.3133983667568803
Energy: 1.3234325494017616
Energy: 1.225438546435179
Energy: 1.290831190428938
Energy: 1.6653504398632375
Energy: 1.2226515117299719
Energy: 1.2224203131194424
Energy: 1.6570865020177605
Energy: 1.192969077844863
Energy: 1.2369937596775802
Energy: 1.6584079797580644
Energy: 1.3658805423767846
Energy: 1.3870535711136318
Energy: 1.5978233157437587
Energy: 1.3669267804630891
Energy: 1.418022746583082
Energy: 1.3546574866189511
Energy: 1.2257824932946466
Energy: 1.4151510741340534
Energy: 1.3764284758793157
Energy: 1.388607621529389
Energy: 1.3645479121805926
Energy: 1.449511817193255
Energy: 1.5353081724193773
Energy: 1.2976061138910115
Energy: 1.452424459191287
Energy: 1.57415076074157
Energy: 1.2068595192589722
Energy: 1.2298099183259266
Energy: 1.2091156945463442
Energy: 1.1623320655021598
Energy: 1.1923035933544868
Energy: 1.3888470811259488
Energy: 1.1416112245394832
Energy: 1.4248181963026032
Energy: 1.2030973942856245
Energy: 1.2983267595897994
Energy: 1.408533012666655
Energy: 1.2039244253604398
Energy: 1.3710284027590367
Energy: 1.431471135250426
Energy: 0.9108342462106931
Energy: 0.910772110775612
Energy: 1.4383911293089209
Energy: 0.9511941530699939
Energy: 0.9113597965024454
Energy: 1.4222933930858876
Energy: 1.117995008551092
Energy: 1.1182403232477183
Energy: 1.3562644326794486
Energy: 1.0827783542644975
Energy: 1.1448420227229146
Energy: 1.3082342786533097
Energy: 1.3248419934791376
Energy: 1.247796013255331
Energy: 1.2934252270053925
Energy: 1.2810228282313962
Energy: 1.2000535804637036
Energy: 1.0747339310780022
Energy: 1.3190100248632337
Energy: 1.040435292251727
Energy: 1.0596041431128356
Energy: 1.394257591820274
Energy: 1.007548678320717
Energy: 1.4198458843868613
Energy: 1.4932680677020729
Energy: 1.351345128022074
Energy: 1.35506352090784
Energy: 1.5201223302145628
Energy: 1.3340612462318397
Energy: 1.434612983793859
Energy: 1.307947817134331
Energy: 1.441125325637158
Energy: 1.3407551406989113
Energy: 1.4209848399302427
Energy: 1.2307657334913313
Energy: 1.7631613845028662
Energy: 1.639577157425157
Energy: 1.4395324519753383
Energy: 1.755063523326804
Energy: 1.6090578268142057
Energy: 1.4392069795760982

minimum gb energy = 0.910772110775612 eV
minimum distance =  2.52046501843519 Angstroms
sigma value = 57


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

Energy: 1.5237603363384558
Energy: 1.4420154546626769
Energy: 1.1160548453491483
Energy: 1.4544230162573553
Energy: 1.6331819560723162
Energy: 1.5258074052801194
Energy: 1.474506216498557
Energy: 1.1005623591049942
Energy: 1.1007191946919954
Energy: 1.3669050729220473
Energy: 1.060922596564679
Energy: 1.1620269282145614
Energy: 1.3509875568139904
Energy: 1.2723375136802655
Energy: 1.1860784242595628
Energy: 1.2319535453846246
Energy: 1.400472210821546
Energy: 1.2398810519007688
Energy: 0.9664616212498612
Energy: 1.3166900486795061
Energy: 1.361327351873849
Energy: 0.9680433275216952
Energy: 1.4250979141803797
Energy: 0.9644153323638167
Energy: 1.1711207165862974
Energy: 1.1749064234481321
Energy: 1.175044504451076
Energy: 1.105904110834156
Energy: 1.268421189283768
Energy: 1.0525519377196884
Energy: 1.2259906406728047
Energy: 1.1199247024383059
Energy: 1.1593357048071917
Energy: 1.295583737997952
Energy: 1.1196102114305875
Energy: 1.1610384144456314
Energy: 1.2925797005319264
Energy: 0.9625424543239124
Energy: 0.9629965820474694
Energy: 1.2944139734383777
Energy: 0.9650546358263771
Energy: 0.9642543415171869
Energy: 1.3230425892169337
Energy: 1.3069266224106528
Energy: 1.317687673965264
Energy: 1.3216552668980375
Energy: 1.170846918829135
Energy: 1.3924320146719533
Energy: 1.196153982345677
Energy: 1.1971271232309124
Energy: 1.0477326365095576
Energy: 1.2212239517864196
Energy: 1.181025401935462
Energy: 1.3085759128914651
Energy: 1.3053561119224948
Energy: 1.4859515982336944
Energy: 1.4218981486879718
Energy: 1.3060817990402176
Energy: 1.5297082674939952
Energy: 1.2758496268992994
Energy: 1.2116283969363018
Energy: 1.1724291997637923
Energy: 1.3052677284748069
Energy: 1.2121221439005754
Energy: 1.2994011036300228
Energy: 1.3047938396857848
Energy: 1.4213267095794535
Energy: 1.1804627967707053
Energy: 1.1787561895120398
Energy: 1.4233536346207618
Energy: 1.3834547936653248
Energy: 1.271826349521949
Energy: 1.767919222419891
Energy: 1.1452358274169057
Energy: 1.17454992220174
Energy: 1.5996510064196965
Energy: 1.1491635628964936
Energy: 1.2827859346343427
Energy: 1.4463274248865885
Energy: 1.0590946876917873
Energy: 1.1837261798547107
Energy: 1.3786399460927683
Energy: 1.1494893105731374
Energy: 1.1363242800074815
Energy: 1.190020809000215
Energy: 1.3230257452842564
Energy: 1.350254742306494
Energy: 1.1905119213680513
Energy: 1.322483749465655
Energy: 1.214164539185472
Energy: 0.9257649535600819
Energy: 1.1243664547720573
Energy: 0.9716333205669215
Energy: 0.9270034283068465
Energy: 1.3780590641097432
Energy: 1.0160686975083848
Energy: 1.2747608101946226
Energy: 1.2811334851196259
Energy: 1.2307444037117827
Energy: 1.2097652198363646
Energy: 1.2882056553114194
Energy: 1.1550823716553027
Energy: 1.412610126093028
Energy: 0.9289297445309588
Energy: 0.928554977354189
Energy: 1.389602932217964
Energy: 1.0215866606731254
Energy: 1.0418622748916853
Energy: 1.3875192661736613
Energy: 0.9644719685096645
Energy: 0.9727656639668704
Energy: 1.3620556249388327
Energy: 0.9647677812322444
Energy: 0.9731801807384706
Energy: 1.605003787564328
Energy: 1.2595104578504144
Energy: 1.2119745337601049
Energy: 1.3598483327322148
Energy: 1.227010683554701
Energy: 1.3092701198963317
Energy: 1.2238349422065156
Energy: 1.0431623375219994
Energy: 1.0430426394064556
Energy: 1.2208191361275222
Energy: 1.558041399819951
Energy: 1.1171517439343495
Energy: 1.4767071040660267
Energy: 1.4250505026739289
Energy: 1.2460165278513218
Energy: 1.4781512560497014
Energy: 1.543218949949032
Energy: 1.184708009772887
Energy: 1.3715257523358646
Energy: 1.058861706961627
Energy: 1.1842991935451557
Energy: 1.37244141650328
Energy: 1.2128406127101896
Energy: 1.059539095090415
Energy: 1.767591799263054
Energy: 1.2500034443204344
Energy: 1.135090199433952
Energy: 1.599428406556252
Energy: 1.2484858751239027
Energy: 1.231194151816212

minimum gb energy = 0.9257649535600819 eV
minimum distance =  2.48627628220054 Angstroms
sigma value = 17


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

Energy: 1.4278395177086445
Energy: 1.4776435093546956
Energy: 1.0893990104143865
Energy: 1.4292492210620686
Energy: 1.4776638503722894
Energy: 1.3106855935912896
Energy: 1.3907820875010493
Energy: 1.1531633076306753
Energy: 1.1019747857767932
Energy: 1.2515889525778836
Energy: 1.155583417173484
Energy: 1.2434441359707076
Energy: 1.2931102665106464
Energy: 1.2237646323132352
Energy: 1.1538260779500733
Energy: 1.1892532409881662
Energy: 1.407586504041946
Energy: 1.169110644847349
Energy: 0.9681322248787823
Energy: 1.1740278246361187
Energy: 1.174011347336964
Energy: 0.9691622233399374
Energy: 1.2569493302819146
Energy: 0.9658848183716757
Energy: 1.0785618979898657
Energy: 1.2371443543820169
Energy: 1.092517007833145
Energy: 1.0784455182988735
Energy: 1.2584330964049653
Energy: 1.1395105500722635
Energy: 1.3413087960716283
Energy: 0.8909924393379223
Energy: 1.0741918988712904
Energy: 1.3160493802599413
Energy: 0.9592518189124436
Energy: 1.1878016279842423
Energy: 1.2378658931476503
Energy: 0.824299257288323
Energy: 0.8539592477154136
Energy: 1.2172630333424306
Energy: 0.8278306478875308
Energy: 0.9776827674627662
Energy: 1.2892768741479461
Energy: 1.1804413773734583
Energy: 1.2069352781873484
Energy: 1.2909724872763095
Energy: 1.1774283812285256
Energy: 1.2081851058618822
Energy: 0.8961912617667441
Energy: 1.185012296085283
Energy: 1.0478782782374647
Energy: 0.8977285684881104
Energy: 1.1967162877539022
Energy: 0.8247647951662619
Energy: 1.0293630218319718
Energy: 1.2517103002829402
Energy: 1.0994645184096354
Energy: 0.9539210512547022
Energy: 1.3337430239900219
Energy: 1.1011511549958581
Energy: 1.3844478061874843
Energy: 1.195498985897819
Energy: 1.1336860814871783
Energy: 1.264947819834954
Energy: 1.1866464646267563
Energy: 1.1085461406408528
Energy: 1.4673437465048687
Energy: 0.9655430005550328
Energy: 0.9663922325157573
Energy: 1.350000365933117
Energy: 0.9690240146836566
Energy: 0.9659407892965719
Energy: 1.440044178422894
Energy: 1.188968092760213
Energy: 1.2047260724832958
Energy: 1.4415876726329422
Energy: 1.1916595041921438
Energy: 1.270117914342122
Energy: 1.1722255352768494
Energy: 1.3465737869656482
Energy: 1.1634389731873647
Energy: 1.1736793701681596
Energy: 1.3483811679765625
Energy: 1.236179275394844
Energy: 1.2920654016476958
Energy: 1.4807743223399101
Energy: 1.1440652004369871
Energy: 1.292676355513771
Energy: 1.4818848978037908
Energy: 1.1451781937001877
Energy: 1.2853621215136066
Energy: 1.161542514293429
Energy: 1.2195639686425848
Energy: 1.2870675446740083
Energy: 1.3454137084715752
Energy: 1.1783137856392167
Energy: 1.5314070053755504
Energy: 1.1882909184070825
Energy: 1.119416903981318
Energy: 1.5005108232803281
Energy: 1.245954315703463
Energy: 1.18602178146062

minimum gb energy = 0.824299257288323 eV
minimum distance =  2.5291461154455 Angstroms
sigma value = 17


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

Energy: 1.4889153026742885
Energy: 1.3587070098401017
Energy: 1.3351961333532805
Energy: 1.526160320054401
Energy: 1.3595374448110753
Energy: 1.2023005096471793
Energy: 1.3366712591455092
Energy: 1.0412790126389169
Energy: 0.9952935690847233
Energy: 1.1874159934028887
Energy: 1.0830096317926334
Energy: 1.2191813860506704
Energy: 1.1787952199876974
Energy: 1.2515567768133655
Energy: 1.110736201249005
Energy: 1.1799736550893256
Energy: 1.3478075101393057
Energy: 1.0870728816742228
Energy: 0.9183757967623
Energy: 1.0428005269394078
Energy: 0.9396137893687571
Energy: 0.9196514965853817
Energy: 1.291182899795803
Energy: 0.9331593054836872
Energy: 1.1260090723573184
Energy: 1.153161832502268
Energy: 1.1530072733415577
Energy: 1.1261137167370159
Energy: 1.2008367304940957
Energy: 1.0966113293202315
Energy: 1.3533072319272699
Energy: 0.8333793470419947
Energy: 1.141663956285923
Energy: 1.3341459934269577
Energy: 0.833122897222112
Energy: 1.1723804921743513
Energy: 1.250273099084516
Energy: 0.7970851342685978
Energy: 0.7902028948906683
Energy: 1.14125756488168
Energy: 0.7929377930829659
Energy: 1.0419695889655527
Energy: 1.1302519219419571
Energy: 1.1129474346285728
Energy: 1.1783295239985265
Energy: 1.1317794842929385
Energy: 1.2591064695441754
Energy: 1.124763559279826
Energy: 0.7529464716321952
Energy: 1.0214355677642453
Energy: 0.785776701379273
Energy: 0.7542621176709132
Energy: 1.064911012802792
Energy: 0.7896154878594442
Energy: 1.0687745250763596
Energy: 1.1010273945228284
Energy: 1.0362536241725635
Energy: 0.8544694975066495
Energy: 1.219885218681492
Energy: 0.9377725123253344
Energy: 1.220044015187129
Energy: 0.9616998355673315
Energy: 0.9121947741035751
Energy: 1.22146957229042
Energy: 0.8014909935177034
Energy: 1.0237334503637987
Energy: 1.206594333313946
Energy: 0.7929749637106213
Energy: 0.7894363095036985
Energy: 1.1603904876648627
Energy: 0.7720696956990968
Energy: 0.7893294757409962
Energy: 1.3346879734228043
Energy: 1.1931445501224796
Energy: 1.0807443864089967
Energy: 1.19790116105116
Energy: 1.1817228276836076
Energy: 1.0675434809369042
Energy: 0.8398740237897174
Energy: 1.033014946043837
Energy: 1.056259092292621
Energy: 0.7909136779386494
Energy: 1.140896524544096
Energy: 0.8056837293730236
Energy: 0.9942561401102346
Energy: 1.2781260091207427
Energy: 1.2147486714476126
Energy: 0.9410563292558577
Energy: 1.3028811610800932
Energy: 1.0193811905605072
Energy: 1.2491541923473104
Energy: 1.0467370716343898
Energy: 1.0454630648971794
Energy: 1.2533490227232116
Energy: 1.0737191068562466
Energy: 1.00064126310688
Energy: 1.3694735690378033
Energy: 0.9171447103701981
Energy: 0.9174386820675441
Energy: 1.3736105828443372
Energy: 0.9224341015787662
Energy: 1.041147226580993
Energy: 1.3748165582372602
Energy: 1.1347056411537946
Energy: 1.1160830907344133
Energy: 1.324368170085695
Energy: 1.0997653572568091
Energy: 1.0974009498135378
Energy: 1.1032994541345753
Energy: 1.0362244994370209
Energy: 1.1953154974115368
Energy: 1.1001383912867422
Energy: 1.2755818716806813
Energy: 1.1645129408211365
Energy: 1.2802179092403243
Energy: 1.4232712545119763
Energy: 1.3073418600369062
Energy: 1.2803900622312496
Energy: 1.4546522551777643
Energy: 1.116443604835007
Energy: 1.2698047737381424
Energy: 1.2559941130406655
Energy: 1.0134403876939293
Energy: 1.1849282124197356
Energy: 1.260847625401602
Energy: 1.058320272751757
Energy: 1.5682879811524233
Energy: 1.1393797943148412
Energy: 1.0502071005040234
Energy: 1.4508916419929874
Energy: 1.143208176843833
Energy: 1.0825499912008685
Energy: 1.450727072365687
Energy: 1.0807165734561215
Energy: 1.0975763736585347
Energy: 1.3447740411476652
Energy: 1.0959375290309608
Energy: 1.1270526950033812
Energy: 1.1908996320323837
Energy: 1.1329364305052012
Energy: 1.0713814886887716
Energy: 1.1924331570629316
Energy: 1.2723850622271107
Energy: 1.0559581120693486
Energy: 0.9827600468116772
Energy: 1.3407651476170175
Energy: 1.1785540260393643
Energy: 0.9224849844836048
Energy: 1.389428073161823
Energy: 1.2493141672191095
Energy: 0.9801820775133947
Energy: 1.0643623225141394
Energy: 1.0236579014299194
Energy: 0.981395043647645
Energy: 1.2160392861323899
Energy: 1.1680821887809776
Energy: 1.3875423013647292
Energy: 1.1324758531635282
Energy: 1.12034773752833
Energy: 1.3889189642223394
Energy: 1.0821029158521873
Energy: 1.169161092621142
Energy: 1.23239029016072
Energy: 0.8268838323593882
Energy: 0.8218421002041744
Energy: 1.1154988274256517
Energy: 0.7922925539924907
Energy: 0.821591461233039
Energy: 1.2475886541452332
Energy: 1.1169155669416857
Energy: 1.0759863366663718
Energy: 1.1726302320371016
Energy: 1.1698884787748196
Energy: 1.1048486916216802
Energy: 0.7982446394257408
Energy: 1.1617856443362422
Energy: 1.0251414680867943
Energy: 0.8476234949396698
Energy: 1.2451149236845171
Energy: 0.7852821626802229
Energy: 0.8809100154778574
Energy: 1.0045639886815652
Energy: 0.9899991768575047
Energy: 0.7744493307952413
Energy: 1.0807721823149439
Energy: 0.9007798652530175
Energy: 1.1635747407405166
Energy: 1.0437278922039495
Energy: 1.0938392171686726
Energy: 1.1626651068220784
Energy: 1.07642075902246
Energy: 1.0007260690416144
Energy: 1.1166330959798283
Energy: 0.7581383426270972
Energy: 0.7522920786484072
Energy: 1.117547990352479
Energy: 0.7532286519139036
Energy: 0.7683198310441726
Energy: 1.2479519948957931
Energy: 0.8736819232360123
Energy: 1.0967436322701398
Energy: 1.2502976524777636
Energy: 0.9704245594584537
Energy: 1.052190496695702
Energy: 0.8491598068907982
Energy: 1.1126078470023064
Energy: 1.010006670859401
Energy: 0.8980789215596335
Energy: 1.1139130881918975
Energy: 1.0663470698053452
Energy: 0.827016265595636
Energy: 1.183274866914583
Energy: 1.02377938725513
Energy: 0.8284761023015528
Energy: 1.266359880911408
Energy: 0.8212960084315214
Energy: 1.249703786273036
Energy: 1.101642965206042
Energy: 1.1553091431615703
Energy: 1.1758493528215601
Energy: 1.2003803662103782
Energy: 1.1176460737440255
Energy: 1.2541494451042188
Energy: 0.9071782056653692
Energy: 0.9170502133389248
Energy: 1.2040009110402252
Energy: 0.9033974070035281
Energy: 0.9166827007621268
Energy: 1.4400744936044496
Energy: 1.116598546576503
Energy: 1.0767423559849716
Energy: 1.420474758202793
Energy: 1.1048581243546296
Energy: 1.2458513468183186
Energy: 1.1833781008550461
Energy: 1.1291340059403725
Energy: 0.9752555106329681
Energy: 1.1675677643929216
Energy: 1.2889436614394592
Energy: 1.1269568460721264
Energy: 1.1936448435159905
Energy: 1.3637969267064347
Energy: 1.1571526168756396
Energy: 1.1085954858655778
Energy: 1.4811450565520454
Energy: 0.9861055537501522
Energy: 1.1747569964667706
Energy: 1.2361482072030479
Energy: 1.0546516326846702
Energy: 1.176039141346058
Energy: 1.2659823099936252
Energy: 1.2038727352295586
Energy: 1.4401454712915815
Energy: 1.1474168672879468
Energy: 1.1663239960765708
Energy: 1.3164751156992662
Energy: 1.1619636457373326
Energy: 1.0915920156817427

minimum gb energy = 0.7522920786484072 eV
minimum distance =  2.51469978466973 Angstroms
sigma value = 57


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

Energy: 1.4013811484833387
Energy: 1.2704574792061052
Energy: 1.1102912695946827
Energy: 1.4027138651930995
Energy: 1.2706125091333265
Energy: 1.1886096445828547
Energy: 1.2108030100580442
Energy: 0.9816947152046296
Energy: 0.9503141736084282
Energy: 1.1966217191653956
Energy: 0.996959997103483
Energy: 1.013202988371309
Energy: 1.0889775182076862
Energy: 1.1299102834525
Energy: 1.13951824441327
Energy: 1.0900790620973737
Energy: 1.3028643169044343
Energy: 1.0307986391688317
Energy: 0.8731886312441399
Energy: 1.1684302602235341
Energy: 1.002629188573945
Energy: 0.874351856479442
Energy: 1.170994413325487
Energy: 0.8867323033294492
Energy: 1.1028298212424767
Energy: 1.0896233488324365
Energy: 1.0827063167947044
Energy: 1.0256689263758072
Energy: 1.0990519124577613
Energy: 1.012522739011158
Energy: 1.283190966810483
Energy: 0.7902269857215367
Energy: 1.080040131143494
Energy: 1.2850997706315863
Energy: 0.8036750591853135
Energy: 1.0837011654666289
Energy: 1.1524736026613724
Energy: 0.7652698121658441
Energy: 0.7679450690633539
Energy: 1.0876958766990426
Energy: 0.7620878729174831
Energy: 1.045963688058395
Energy: 1.0441878657332553
Energy: 1.0557180464475195
Energy: 1.0649959711967243
Energy: 1.0304596801362607
Energy: 1.2029894172049342
Energy: 1.13688503326985
Energy: 0.7358466799673269
Energy: 0.9420961839241558
Energy: 0.7341642559802902
Energy: 0.7373690863444359
Energy: 1.1270720766546698
Energy: 0.7346846182392732
Energy: 1.175635640958673
Energy: 1.066889425885568
Energy: 0.9672339805576409
Energy: 1.070883493692723
Energy: 1.169962478499547
Energy: 0.9811753678014363
Energy: 1.1852731355175796
Energy: 0.8660353365417406
Energy: 0.8690368468093136
Energy: 1.187559683981377
Energy: 0.7355311279969428
Energy: 0.937338081540216
Energy: 1.1099020550915975
Energy: 0.710975263874835
Energy: 0.723063221683662
Energy: 1.0708445997172795
Energy: 0.7090397266398406
Energy: 0.9078184951306798
Energy: 1.1404404215213892
Energy: 1.0815420112581557
Energy: 0.9889557487603053
Energy: 1.1355326032979411
Energy: 1.119539487068886
Energy: 0.9687146612009999
Energy: 0.6922979952774321
Energy: 0.9448752179976352
Energy: 0.7234003479860657
Energy: 0.6936867857899424
Energy: 1.0027001136122704
Energy: 0.6915377179480064
Energy: 0.9609949540595655
Energy: 1.0456145164609587
Energy: 0.9760270005038187
Energy: 0.921243645654552
Energy: 1.1755095384933931
Energy: 0.9477218927468123
Energy: 1.1128447027392234
Energy: 0.7910467989296308
Energy: 0.9854525664625874
Energy: 1.1145726636548259
Energy: 0.8284148783212286
Energy: 0.8808172878220303
Energy: 1.2230083588277483
Energy: 0.7431996512056817
Energy: 0.7351924615147085
Energy: 1.172231267312997
Energy: 0.739252451860354
Energy: 0.7339878050739755
Energy: 1.229618788606772
Energy: 1.0786073398560037
Energy: 1.0063362379544005
Energy: 1.2284817351338997
Energy: 1.1297398622427084
Energy: 0.9785677102684718
Energy: 0.7691771130603069
Energy: 0.9543838761400507
Energy: 0.7886576165356106
Energy: 0.7708184839817621
Energy: 1.0906910371556298
Energy: 0.780001337578458
Energy: 1.0171523285528632
Energy: 1.2475973961057398
Energy: 1.11312999459402
Energy: 1.006837286771234
Energy: 1.306800883369076
Energy: 1.1242952008793876
Energy: 1.171231765862531
Energy: 0.9277544905542839
Energy: 0.8805085130825979
Energy: 1.1408017478999777
Energy: 0.9250471428805276
Energy: 0.9455349853235727
Energy: 1.3556079289162484
Energy: 0.8812506741134192
Energy: 0.850559876773318
Energy: 1.3215034376391621
Energy: 0.8778172368083236
Energy: 1.1882359346843299
Energy: 1.333519137417809
Energy: 1.0702222814357991
Energy: 1.0724246116373384
Energy: 1.257112852785154
Energy: 1.051420512198064
Energy: 1.0823643195055659
Energy: 1.0322728030217627
Energy: 1.1166241745003032
Energy: 1.0902598244909052
Energy: 1.0336431112420823
Energy: 1.2478095267909617
Energy: 1.0849241224431863
Energy: 1.138058223475964
Energy: 1.3164116540740538
Energy: 1.2358989069581332
Energy: 1.139169873674649
Energy: 1.4326441804914587
Energy: 1.1152910917062095
Energy: 1.1489665975840404
Energy: 1.119660518331922
Energy: 0.9348537730512911
Energy: 1.1498785678719048
Energy: 1.1560787052623294
Energy: 1.0019094076539552
Energy: 1.415379612072618
Energy: 1.0835692024836368
Energy: 1.1689069393139788
Energy: 1.4172141337212605
Energy: 1.0791910432977934
Energy: 1.180633140386912

minimum gb energy = 0.6915377179480064 eV
minimum distance =  2.50911072839943 Angstroms
sigma value = 43


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

Energy: 1.295019451540615
Energy: 1.0732322952099167
Energy: 0.9999789674813392
Energy: 1.2808981737458134
Energy: 1.0986465053597072
Energy: 1.0168722697645163
Energy: 1.0344896987310201
Energy: 0.8584961460357226
Energy: 0.8163132351857175
Energy: 0.919181884191895
Energy: 0.875303578933896
Energy: 0.8102860854147566
Energy: 0.9245610099036146
Energy: 1.064342626314449
Energy: 1.0452397351417533
Energy: 0.925920819125008
Energy: 1.1277005512724394
Energy: 0.9080994355498038
Energy: 0.7622464261681493
Energy: 0.9790560414852176
Energy: 0.8046104302466592
Energy: 0.7630973361844257
Energy: 1.0606992704229534
Energy: 0.770678054274888
Energy: 1.134570862385431
Energy: 0.9154033166853156
Energy: 0.8471463058053368
Energy: 0.9276462567699482
Energy: 0.9074328634803901
Energy: 0.8505389513300223
Energy: 1.215473781283386
Energy: 0.6942931589422175
Energy: 0.9384638202128236
Energy: 1.2173575117585742
Energy: 0.693993474469995
Energy: 1.0040294108455463
Energy: 1.0171403482209174
Energy: 0.6873023497478812
Energy: 0.6873043745404311
Energy: 0.9604117381121786
Energy: 0.6935512149784077
Energy: 0.879037068885579
Energy: 0.8807974502280497
Energy: 1.0382636578468594
Energy: 1.0101015607923602
Energy: 0.8822434765038166
Energy: 1.1254027159143036
Energy: 0.9494382327343442
Energy: 0.6470564931939832
Energy: 0.7967581372655406
Energy: 0.646399516748993
Energy: 0.6487116772894587
Energy: 1.0934951547158114
Energy: 0.6460425160814514
Energy: 1.0371894781267355
Energy: 0.9245238477403588
Energy: 0.8953052673772102
Energy: 0.9780667686696938
Energy: 0.9606160246934222
Energy: 0.8273682858959086
Energy: 1.1405827075968624
Energy: 0.6242835384227013
Energy: 0.6248113703042998
Energy: 1.1422742210158265
Energy: 0.6286158456007495
Energy: 0.9412057898677437
Energy: 1.0728726939032687
Energy: 0.6140101367277959
Energy: 0.6137777384116196
Energy: 0.9790508828714953
Energy: 0.613697984940733
Energy: 0.8026252778628641
Energy: 0.9405793600654946
Energy: 1.0175508052507032
Energy: 0.9376077873609477
Energy: 0.9413440858695588
Energy: 1.1028395223353045
Energy: 0.8783957852906696
Energy: 0.590378177477758
Energy: 0.870516725218336
Energy: 0.6049053528747409
Energy: 0.5919397617929048
Energy: 0.9452342016185933
Energy: 0.6049416649392408
Energy: 1.0416983834891747
Energy: 0.936185185071815
Energy: 0.9227915366917646
Energy: 0.9660379878458583
Energy: 0.9513133022118943
Energy: 0.8696938468329074
Energy: 1.072630532345997
Energy: 0.5981005685514312
Energy: 0.5983223223419585
Energy: 1.0198722458435603
Energy: 0.6285129554348069
Energy: 0.8436216445765289
Energy: 1.021746176006496
Energy: 0.5983469843465097
Energy: 0.5987022116011687
Energy: 1.0051455093785957
Energy: 0.5981371077860163
Energy: 0.7318133160721021
Energy: 0.9981731677032879
Energy: 0.9551601450024799
Energy: 0.871050380863216
Energy: 0.8823087158503443
Energy: 1.0193606489646212
Energy: 0.8354784205288518
Energy: 0.5832063403747368
Energy: 0.8258191904265428
Energy: 0.590477599321103
Energy: 0.5841465254260992
Energy: 0.8286527598185565
Energy: 0.5832606764009749
Energy: 0.960868910834104
Energy: 0.9975737849649513
Energy: 0.8910002289074587
Energy: 0.9324844512680394
Energy: 1.0760081537611363
Energy: 0.8660889259401187
Energy: 0.9950606142107933
Energy: 0.6064091172682118
Energy: 0.8164262678217353
Energy: 0.9878086938871578
Energy: 0.635585740690975
Energy: 0.7392076451626169
Energy: 1.114292932438301
Energy: 0.6050602015260442
Energy: 0.6058897597058369
Energy: 1.0414223239845153
Energy: 0.6052074713811929
Energy: 0.879745789999011
Energy: 1.065829485645275
Energy: 0.8959037241955197
Energy: 0.8866935226555207
Energy: 1.007501194575847
Energy: 0.9466906687996105
Energy: 0.8591389581559654
Energy: 0.6126484557138066
Energy: 0.9858438166732607
Energy: 0.6199809998363238
Energy: 0.6142874098272969
Energy: 0.9736543717619958
Energy: 0.6199844958639915
Energy: 0.915457389316603
Energy: 1.0548347441538677
Energy: 0.9863227880231541
Energy: 0.91068659813099
Energy: 1.1402082218323764
Energy: 0.9274959086575009
Energy: 1.0516698389023686
Energy: 0.6388798987435219
Energy: 0.6385386652554511
Energy: 0.9886536936618041
Energy: 0.6388031151620849
Energy: 0.7833273138839353
Energy: 1.1810099630041122
Energy: 0.6465267742071071
Energy: 0.6463262727019935
Energy: 1.1825209357765791
Energy: 0.6541286379961643
Energy: 0.9828430383673993
Energy: 1.08449867936847
Energy: 0.9225100500164001
Energy: 0.9112964115714335
Energy: 1.024962509921816
Energy: 0.9604595014557682
Energy: 0.8355731712041812
Energy: 0.6885806103094317
Energy: 0.798162108012219
Energy: 0.6872126793211715
Energy: 0.6899068985408174
Energy: 1.102923014995596
Energy: 0.6873853760791363
Energy: 0.9125358046984435
Energy: 1.0801455427560014
Energy: 1.0564494708754342
Energy: 0.8667582483257616
Energy: 1.1678081315913125
Energy: 0.994565915003597
Energy: 1.0025989428269004
Energy: 0.7590321930538784
Energy: 0.7590670609786951
Energy: 1.0025303611076726
Energy: 0.7647597312097683
Energy: 0.8010631008042522
Energy: 1.2622111626951291
Energy: 0.7623572809991739
Energy: 0.9632306955749745
Energy: 1.2636102868579269
Energy: 0.7617371036108349
Energy: 1.0219410565105143
Energy: 1.1884351850436865
Energy: 0.8943094933043713
Energy: 0.8586869144226507
Energy: 0.9801668305752533
Energy: 0.8873466863721069
Energy: 0.8131262064686147
Energy: 0.8845408821711434
Energy: 0.8455090362751512
Energy: 0.8180791174368899
Energy: 0.8858704095002659
Energy: 1.1174168212322657
Energy: 0.8119845005046582
Energy: 0.9279662327348802
Energy: 1.1125814239708367
Energy: 0.8922878441968235
Energy: 0.9247042638663922
Energy: 1.0778792177959922
Energy: 0.8310761628294446
Energy: 1.0304400280151464
Energy: 0.8996088482308836
Energy: 0.8151310367404874
Energy: 0.9125570689729884
Energy: 0.9274837111168703
Energy: 0.8067258219242314

minimum gb energy = 0.5832063403747368 eV
minimum distance =  2.51445693921597 Angstroms
sigma value = 81


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

Energy: 0.2748651037820478
Energy: 0.9948280980108335
Energy: 0.25168339930975575
Energy: 0.0656804457689209
Energy: 0.8993375637257516
Energy: 0.27507361053892504
Energy: 1.3328128370624028
Energy: 0.6772622396895654
Energy: 0.48145715478250845
Energy: 0.9773065035160734
Energy: 0.623736113412286
Energy: 0.6771904418783538
Energy: 0.9744704255560886
Energy: 0.06415718887014754
Energy: 0.06434616050125315
Energy: 1.0333062723868163
Energy: 0.06406745182803128
Energy: 0.5741616713959147
Energy: 0.49538847396793617
Energy: 0.064295050482866
Energy: 0.2516725001465582
Energy: 0.4799518645120933
Energy: 0.06419659015937768
Energy: 0.2517571634790613
Energy: 0.2515495262140768
Energy: 0.9705911373963867
Energy: 1.1034418734843214
Energy: 0.25156319964396673
Energy: 1.027441266313349
Energy: 0.6868024647926144
Energy: 0.06482756420326326
Energy: 0.6688975106408931
Energy: 0.2516654796341729
Energy: 0.06608607422152211
Energy: 0.48266685492869016
Energy: 0.0641823569507623
Energy: 0.9746999202522998
Energy: 0.47955261331822546
Energy: 0.4804515616799761
Energy: 1.2027695855847391
Energy: 0.4843156952662153
Energy: 0.48233103925599874
Energy: 0.9741426418865535
Energy: 0.06412269382699794
Energy: 0.0642935009735226
Energy: 0.9587817282783364
Energy: 0.0640409920661181
Energy: 0.06417608512429263
Energy: 0.49078681283294795
Energy: 0.2517160694141665
Energy: 0.25175242767502803
Energy: 0.5021928390012685
Energy: 0.06419601366148478
Energy: 0.2516984908381831
Energy: 0.4619734418849784
Energy: 1.1608272039518623
Energy: 0.9600533684482587
Energy: 0.2516140446023278
Energy: 1.1032456145026717
Energy: 0.8695111276605875

minimum gb energy = 0.0640409920661181 eV
minimum distance =  2.5528351043151 Angstroms
sigma value = 3


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

Energy: 1.3373593038987985
Energy: 1.301623116655709
Energy: 1.034166533934883
Energy: 1.3773767595574806
Energy: 1.30930429776247
Energy: 1.1789805343900477
Energy: 0.9965257492637635
Energy: 0.8651594755203661
Energy: 0.867810800602981
Energy: 0.9472808169666609
Energy: 0.8648985171126424
Energy: 0.8909181690411491
Energy: 0.9079948558869111
Energy: 1.093376173150777
Energy: 1.0122713022981447
Energy: 0.9090063209951099
Energy: 1.175676409334274
Energy: 0.9480848266344717
Energy: 0.8262491081487647
Energy: 0.969848035324983
Energy: 0.9236137930425794
Energy: 0.8273251517734679
Energy: 1.2495639945111416
Energy: 0.986776748267698
Energy: 1.1402346401846373
Energy: 0.8939376120968913
Energy: 0.8975553694036148
Energy: 0.9104443342287469
Energy: 0.8950898877891147
Energy: 0.9818730141376366
Energy: 1.3235738681144689
Energy: 0.973813427524344
Energy: 1.0214120263766504
Energy: 1.2914418210302898
Energy: 0.8987989327202038
Energy: 1.0648177168890443
Energy: 0.8918567339187274
Energy: 0.8780307632380079
Energy: 0.8635896588258486
Energy: 0.8918618628337563
Energy: 0.8930690144575847
Energy: 0.8421203895932823
Energy: 0.8427451177588914
Energy: 0.9731262897689353
Energy: 1.0542955436648918
Energy: 0.842657890259908
Energy: 1.1332181919626578
Energy: 1.0258729281192527
Energy: 0.9219556775101916
Energy: 0.9571944537094961
Energy: 0.8956729337894692
Energy: 0.9232888391631661
Energy: 1.0664183856935237
Energy: 0.9548312383692863
Energy: 1.102908825949674
Energy: 0.7763224623653936
Energy: 0.7763216289555158
Energy: 1.0412974877384322
Energy: 0.779246001777476
Energy: 0.7576732953178766
Energy: 1.221388894269623
Energy: 0.7892891577043807
Energy: 0.944695257170856
Energy: 1.1661076993422959
Energy: 0.7917644521569882
Energy: 0.9707169507706035
Energy: 0.7770823115933633
Energy: 0.9177806384765536
Energy: 0.8486602982403896
Energy: 0.7073043566208327
Energy: 0.9281669553382471
Energy: 0.7467244238066162
Energy: 0.6651713839017243
Energy: 1.0058373604316186
Energy: 0.9775967415463636
Energy: 0.6652647174989542
Energy: 1.134320819375907
Energy: 0.9556736874378722
Energy: 0.9743651260418836
Energy: 0.7636608454383079
Energy: 0.8144638110913526
Energy: 0.9729502080081928
Energy: 0.7647849225001312
Energy: 0.8549304493141766
Energy: 1.075104947102798
Energy: 0.6398494989112694
Energy: 0.6400620479654991
Energy: 0.9888797655430479
Energy: 0.7104994491741295
Energy: 0.7565847881915281
Energy: 1.124595242095406
Energy: 0.8402650545644704
Energy: 0.8425198806497345
Energy: 1.1021240935146532
Energy: 0.8699424294956539
Energy: 0.9115729032972115
Energy: 0.6298254070830607
Energy: 0.8747054288772479
Energy: 0.9496586754776496
Energy: 0.629223688491278
Energy: 0.9200256945691245
Energy: 0.7014209118479057
Energy: 0.631822252728723
Energy: 0.9839616242740182
Energy: 0.9617753327400169
Energy: 0.6313493825423963
Energy: 1.056222804995445
Energy: 0.7886383232620454
Energy: 1.091181888374285
Energy: 0.7016130917345067
Energy: 0.8443191219670014
Energy: 1.0540528284848256
Energy: 0.6965500827698828
Energy: 0.9190785894600123
Energy: 1.06015048726679
Energy: 0.6291659762030722
Energy: 0.6294922775129098
Energy: 0.8870873669492589
Energy: 0.6324383464790813
Energy: 0.7012887706859043
Energy: 1.027086260674916
Energy: 0.9712547796032528
Energy: 0.9125663673738882
Energy: 0.970434657044175
Energy: 1.0090322563539662
Energy: 0.8807196180183817
Energy: 0.676436569036741
Energy: 0.8991320872425689
Energy: 0.7091085503411162
Energy: 0.6772473273482683
Energy: 0.9691839192642745
Energy: 0.6740488746155266
Energy: 0.7500748087987285
Energy: 0.9056794314170766
Energy: 0.8755522444600898
Energy: 0.7136943542580523
Energy: 0.9476052473647936
Energy: 0.8493704028786382
Energy: 1.1285548568482566
Energy: 0.6654785829330682
Energy: 0.9815754662718679
Energy: 1.17336460430428
Energy: 0.6654193233690995
Energy: 0.985856482539635
Energy: 0.9403317847716859
Energy: 0.6661211966637838
Energy: 0.6694441139856446
Energy: 0.9404089782847169
Energy: 0.7004520058497883
Energy: 0.7465573905337426
Energy: 0.9406317899361581
Energy: 0.9714168979889233
Energy: 0.9539682038286986
Energy: 0.9245846342120132
Energy: 1.0881265040242825
Energy: 0.9148962228580739
Energy: 0.7768138602991363
Energy: 0.9722764200374391
Energy: 0.9461189735543538
Energy: 0.778207184763269
Energy: 1.0975024759372287
Energy: 0.7762587575241059
Energy: 0.7960938634529859
Energy: 0.915285061629678
Energy: 0.8613684317770597
Energy: 0.7549327431944505
Energy: 0.8962140461433499
Energy: 0.8915474429088129
Energy: 1.2682310137597668
Energy: 0.8082238498207879
Energy: 0.800964459434819
Energy: 1.245582730920081
Energy: 0.7747428311343992
Energy: 1.0205095301241998
Energy: 1.0309620140990245
Energy: 0.8524797913239269
Energy: 0.8634232822220497
Energy: 0.9778990413070744
Energy: 0.8198411439253466
Energy: 0.8429726778494859
Energy: 0.9301194399831868
Energy: 1.085575115002769
Energy: 1.1302567183317744
Energy: 0.9303524978663937
Energy: 1.2083619407469894
Energy: 1.0686246168610247
Energy: 0.8979973083758526
Energy: 0.940358856064606
Energy: 0.9333116269591162
Energy: 0.8991492029722434
Energy: 1.1337448507669654
Energy: 0.9202228828681128
Energy: 1.0331070181232285
Energy: 0.8876666200989612
Energy: 0.8883558296237857
Energy: 0.9971139996836276
Energy: 0.8896603386622425
Energy: 0.9741503441401543

minimum gb energy = 0.6291659762030722 eV
minimum distance =  2.50419134320446 Angstroms
sigma value = 67


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

Energy: 1.3080089170071814
Energy: 1.4804658326419706
Energy: 1.308190263305792
Energy: 1.3099085554925425
Energy: 1.4788663425436572
Energy: 1.359424809143367
Energy: 1.1096101734155437
Energy: 1.0065918895128974
Energy: 1.0047339699323372
Energy: 1.188800031087301
Energy: 1.0047084610016297
Energy: 1.078419632875483
Energy: 1.0582532694311995
Energy: 1.3148855478308232
Energy: 1.1465843798748605
Energy: 1.0594967339135104
Energy: 1.3708656122651588
Energy: 1.0785313150617448
Energy: 0.9742545027697769
Energy: 1.2971939126107896
Energy: 1.3186297325795653
Energy: 0.9707861481423729
Energy: 1.3848300829582225
Energy: 1.1615033225721059
Energy: 1.2561069702359768
Energy: 1.0584249901656901
Energy: 1.1134367628270603
Energy: 1.1983057579621594
Energy: 1.0482693093671718
Energy: 1.1067136054100075
Energy: 1.2948458701630836
Energy: 1.140427723687058
Energy: 1.2214109537150704
Energy: 1.427541725200979
Energy: 1.0551068356431261
Energy: 1.1793816237190708
Energy: 1.03156137789124
Energy: 1.0964909638647427
Energy: 1.0678835741714376
Energy: 0.9857278590476409
Energy: 1.0541818613127496
Energy: 0.9626978715895762
Energy: 0.9811327533194303
Energy: 1.1786644715167682
Energy: 1.1315668347988694
Energy: 0.9331776231882359
Energy: 1.2446572842434445
Energy: 0.9967097422622332
Energy: 1.087426713448369
Energy: 1.065998081750389
Energy: 1.0712192389402704
Energy: 1.0884399178063917
Energy: 0.8744917066659557
Energy: 1.0444294988753478
Energy: 1.1949532896335786
Energy: 0.9050710365182306
Energy: 0.8217938928511246
Energy: 1.1219404074531916
Energy: 0.9009210197640292
Energy: 0.9261701878698613
Energy: 1.2537139783385716
Energy: 0.9084390748698865
Energy: 1.044245540009457
Energy: 1.2556070775760901
Energy: 0.9065141698656481
Energy: 1.1127692064082304
Energy: 0.7754721539369974
Energy: 1.0361335733881463
Energy: 1.1440724170628311
Energy: 0.7764823568981071
Energy: 1.1348310404324093
Energy: 0.8762092816297673
Energy: 0.7740147471767129
Energy: 1.1310386138120379
Energy: 1.1167572071755758
Energy: 0.7749703840960267
Energy: 1.1646273596628542
Energy: 0.9897991024523602
Energy: 1.228764159418311
Energy: 0.8906719088190442
Energy: 0.9902757186398614
Energy: 1.1814822501281559
Energy: 0.887463147033488
Energy: 1.0450236585860355
Energy: 1.1480215690261453
Energy: 0.8305690229465946
Energy: 0.7958837561086014
Energy: 1.0952493922989026
Energy: 0.8177454571279378
Energy: 0.898933728597287
Energy: 1.1359653735567143
Energy: 0.9801522553728821
Energy: 0.9901052648590982
Energy: 1.1373177960612333
Energy: 0.8870321928788928
Energy: 0.9907957316598407
Energy: 0.8536532719834449
Energy: 1.0375625182056842
Energy: 1.0807904113925757
Energy: 0.8549664240526338
Energy: 1.178958800129404
Energy: 0.8028038528868254
Energy: 0.8638218639470159
Energy: 1.0681271517954107
Energy: 1.0071807435332865
Energy: 0.8629861004182126
Energy: 1.0961437331942427
Energy: 0.9678336109151919
Energy: 1.2235495505676253
Energy: 0.9919659820260877
Energy: 1.1057893921822213
Energy: 1.3347900784188653
Energy: 0.9511064113975715
Energy: 1.1814713753611437
Energy: 1.1180577844008663
Energy: 0.9450387761064183
Energy: 0.9376560261102286
Energy: 1.073684982707216
Energy: 0.934865182524513
Energy: 1.021172542135291
Energy: 1.035243621178948
Energy: 1.2197584830603179
Energy: 1.265973480304701
Energy: 1.0133012305128444
Energy: 1.3005271169793642
Energy: 1.17289857388913
Energy: 1.0991919563085986
Energy: 1.2556254255559556
Energy: 1.226885311041841
Energy: 1.1001983014380512
Energy: 1.2864256462122046
Energy: 1.0934229246092493
Energy: 1.1335699884286778
Energy: 0.9939742547370939
Energy: 0.9889814489360382
Energy: 1.0285278230192418
Energy: 0.979969339976985
Energy: 1.07587989162167

minimum gb energy = 0.7740147471767129 eV
minimum distance =  2.50556325832948 Angstroms
sigma value = 33


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

Energy: 1.449361086016005
Energy: 1.5895176091241954
Energy: 1.3611621647096868
Energy: 1.4517519962787473
Energy: 1.584072902285526
Energy: 1.369531843568481
Energy: 1.181987697103864
Energy: 1.071486615948511
Energy: 1.0749623789929377
Energy: 1.1803927097282503
Energy: 1.0982487416345845
Energy: 1.1230858081124973
Energy: 1.142281891791997
Energy: 1.3184544843350618
Energy: 1.2620401335930087
Energy: 1.1434250626900853
Energy: 1.4569161189714244
Energy: 1.178003195525204
Energy: 1.0408816141680501
Energy: 1.2233404081887291
Energy: 1.3089969060383797
Energy: 1.0381102412445629
Energy: 1.1858769900092208
Energy: 1.2232116293576347
Energy: 1.3347933916569363
Energy: 1.1997448626352667
Energy: 1.2045675349359453
Energy: 1.1371018311295913
Energy: 1.1466716430294364
Energy: 1.2891067398457183
Energy: 1.4288588986764976
Energy: 1.2604197728176958
Energy: 1.2903706739632208
Energy: 1.3494228204396248
Energy: 1.1219037924238509
Energy: 1.2917430875392677
Energy: 0.9948325146399047
Energy: 1.1816753214773332
Energy: 1.1633820781256552
Energy: 0.99492476161899
Energy: 1.149792819835648
Energy: 1.0299396681761313
Energy: 1.0561658329638415
Energy: 1.1751566651809406
Energy: 1.1722206507227237
Energy: 0.9977832075332637
Energy: 1.2707569951213156
Energy: 1.013676408517888
Energy: 1.2108340815866274
Energy: 1.0682265783713847
Energy: 1.091093943131673
Energy: 1.1957541213358278
Energy: 0.924089540942676
Energy: 1.1311819622887256
Energy: 1.208963720555177
Energy: 0.8801039401373816
Energy: 0.8846324012957909
Energy: 1.206630209831619
Energy: 0.8758209540725569
Energy: 1.019773027943839
Energy: 1.3424342177444233
Energy: 1.0271233662066455
Energy: 1.0865147407432196
Energy: 1.312264202059646
Energy: 0.9717164137766566
Energy: 1.1371038168448235
Energy: 0.8627947601674374
Energy: 1.188438378038782
Energy: 1.1824273042563238
Energy: 0.8628002394202745
Energy: 1.2594961513018699
Energy: 1.1432100382357306
Energy: 0.8655723807051549
Energy: 1.1645728422802912
Energy: 1.146744705933942
Energy: 0.8652445473039219
Energy: 1.12432759038438
Energy: 1.0672128587017835
Energy: 1.3278424102731836
Energy: 1.0592240433283977
Energy: 1.170493390766674
Energy: 1.3296636818317162
Energy: 1.0089636172732828
Energy: 1.2024248031642097
Energy: 1.0725224916923657
Energy: 1.012407176685008
Energy: 1.005825680933439
Energy: 1.0701513157987443
Energy: 1.0082625426183598
Energy: 1.0919543264396963
Energy: 1.126789408320626
Energy: 1.1826330327709162
Energy: 1.1843145479997157
Energy: 1.1203951345067171
Energy: 0.9963147131958563
Energy: 1.3025985778552718
Energy: 1.1950586447299851
Energy: 1.2623318212275785
Energy: 1.2791620559688381
Energy: 1.1958029876535632
Energy: 1.4313977180457498
Energy: 1.0481941137970754
Energy: 1.1797870674804858
Energy: 1.0575777624082956
Energy: 1.0581207723735635
Energy: 1.1746812096881987
Energy: 1.0829471641762947
Energy: 1.1843308691760934
Energy: 1.5277875283295874
Energy: 1.158040608338517
Energy: 1.315647838337897
Energy: 1.4933486836569971
Energy: 1.0976608133831662
Energy: 1.251834755313529
Energy: 1.3139799000766519
Energy: 1.1437489295572716
Energy: 1.0803543950870034
Energy: 1.1035109237168736
Energy: 1.087962524452963
Energy: 1.2202613306462708
Energy: 1.1406490391323336
Energy: 1.2310384022999994
Energy: 1.233518611724145
Energy: 1.1416592463813515
Energy: 1.1334799947916587
Energy: 1.1782330919220538
Energy: 1.1114969163163408
Energy: 1.3392789569663714
Energy: 1.226005962960698
Energy: 1.11269458482972
Energy: 1.491813137637507
Energy: 1.2230194656820044
Energy: 1.1352651687498811
Energy: 1.1573717101040928
Energy: 1.1503829559632335
Energy: 1.1354317491382884
Energy: 1.1527522161941193
Energy: 1.166261446734621
Energy: 1.346168706127369
Energy: 1.1994539978314456
Energy: 1.2875878081178636
Energy: 1.3476124610962867
Energy: 1.1356855762939713
Energy: 1.28700326200989
Energy: 0.9950491603826417
Energy: 1.1705368135259806
Energy: 1.1698400845001409
Energy: 0.9954186560353073
Energy: 1.1504011297697627
Energy: 1.214676966071815
Energy: 1.056977409718774
Energy: 1.2413163893278654
Energy: 1.1738790474419998
Energy: 1.0580727586159555
Energy: 1.2223483109423547
Energy: 0.9941126551213705
Energy: 1.1817088912913585
Energy: 1.1235445692194104
Energy: 1.1221209714098643
Energy: 1.1644887951928
Energy: 0.9241606607923296
Energy: 1.13171675933657
Energy: 1.2074101112357483
Energy: 0.8801761727400315
Energy: 0.8739156547396415
Energy: 1.2061439158760543
Energy: 0.8763929454152607
Energy: 1.0095475429067027
Energy: 1.3420124844200287
Energy: 0.9620007586558982
Energy: 1.106501507333721
Energy: 1.2078112557805618
Energy: 0.9165845124634542
Energy: 1.1368244703610408
Energy: 0.86185288297353
Energy: 1.1742250175594888
Energy: 1.1834792723681
Energy: 0.861816238668378
Energy: 1.2237388818641506
Energy: 1.1557317322846559
Energy: 0.8677508126494973
Energy: 1.2011184452181713
Energy: 1.1961132187497334
Energy: 0.8682835500870257
Energy: 1.1817867849315877
Energy: 0.9774980544837581
Energy: 1.3147062282916964
Energy: 1.0073148346237448
Energy: 1.1498077693483522
Energy: 1.2773976559586964
Energy: 1.0098251059965413
Energy: 1.1175859995778838
Energy: 1.3148610964043004
Energy: 1.0006368710560487
Energy: 1.005739045684822
Energy: 1.112837421747339
Energy: 0.9962076648502639
Energy: 1.0728202499957402
Energy: 1.1257610044054895
Energy: 1.1299908475148273
Energy: 1.2754327045072398
Energy: 1.0951956479641405
Energy: 1.0955102837605641
Energy: 1.1326421570600176
Energy: 1.192292191857422
Energy: 1.379321772681557
Energy: 1.279070746962459
Energy: 1.132442364714665
Energy: 1.349536131986651
Energy: 1.1308797839660907
Energy: 1.178235456706895
Energy: 1.0811126479155129
Energy: 1.0580496066416694
Energy: 1.1729333097343004
Energy: 1.0841947197275392
Energy: 1.1281505711157658
Energy: 1.5533903488787024
Energy: 1.1492509053852011
Energy: 1.3174042041717935
Energy: 1.5294913767776892
Energy: 1.0971775721662318
Energy: 1.414286340124913

minimum gb energy = 0.861816238668378 eV
minimum distance =  2.51989031614675 Angstroms
sigma value = 41


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

Energy: 1.4229577515108125
Energy: 1.6984522683012242
Energy: 1.4593028437003004
Energy: 1.349221434486515
Energy: 1.717773553691308
Energy: 1.6819277844210803
Energy: 1.2083770383176728
Energy: 1.1380732379867493
Energy: 1.1408320296323229
Energy: 1.2095132635836812
Energy: 1.208067615810642
Energy: 1.3633719614279303
Energy: 1.349272444823727
Energy: 1.4178910341311621
Energy: 1.2890125178491376
Energy: 1.3504800731111715
Energy: 1.4455166638036785
Energy: 1.1920740342487435
Energy: 1.3710589463872458
Energy: 1.357562081261188
Energy: 1.4024366309917342
Energy: 1.210379263044108
Energy: 1.3074007319178667
Energy: 1.2062133234272903
Energy: 1.2010741854238935
Energy: 1.474800493425003
Energy: 1.4026676923434989
Energy: 1.2012509821581987
Energy: 1.271409306197414
Energy: 1.333294986669354
Energy: 1.3808262877016988
Energy: 1.307587219646669
Energy: 1.3215323188091879
Energy: 1.2874505858823746
Energy: 1.2119267788303034
Energy: 1.4661338124598668
Energy: 1.0027910861509204
Energy: 1.245254670717698
Energy: 1.2710117657934803
Energy: 1.00175564638119
Energy: 1.2214865898155847
Energy: 1.2397360295954032
Energy: 0.9981911431008273
Energy: 1.2811276917814751
Energy: 1.1987476580130907
Energy: 0.9993626024615341
Energy: 1.3629438686224618
Energy: 1.0553973958899479
Energy: 1.2927412146320132
Energy: 1.1262857328065166
Energy: 1.1961764529701069
Energy: 1.2950648087818002
Energy: 1.0770712894978163
Energy: 1.27512025207035
Energy: 1.2904702964017996
Energy: 1.1054995585316494
Energy: 1.0138234815656832
Energy: 1.285902833097346
Energy: 1.1009269063732308
Energy: 1.116639743315986
Energy: 1.2655526796995165
Energy: 1.1615244681764156
Energy: 1.3340691604797377
Energy: 1.2668631831105681
Energy: 1.1211269325691762
Energy: 1.2730316497703493
Energy: 1.2191685936323617
Energy: 1.3618663991151143
Energy: 1.2754797904186363
Energy: 1.2202222007957653
Energy: 1.3623845485383477
Energy: 1.161528119704701
Energy: 1.2054357207581972
Energy: 1.1749115057210398
Energy: 1.301016651281678
Energy: 1.183005491450472
Energy: 1.170709054996476
Energy: 1.214833265880259
Energy: 1.4776031913904446
Energy: 1.2488496931252346
Energy: 1.4016384664007675
Energy: 1.477686882293076
Energy: 1.1802949532003641
Energy: 1.6172648150530593

minimum gb energy = 0.9981911431008273 eV
minimum distance =  2.45853508786754 Angstroms
sigma value = 11


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

Energy: 1.6593497220895992
Energy: 1.9155448337487573
Energy: 1.6559899411055259
Energy: 1.6606596960321787
Energy: 2.0291620799325076
Energy: 1.519930465199443
Energy: 1.4236648428808936
Energy: 1.1655962493215306
Energy: 1.280538054086214
Energy: 1.4240831091184198
Energy: 1.1675808740186233
Energy: 1.3691530268697496
Energy: 1.5232074923533097
Energy: 1.568809557298765
Energy: 1.4406167980200872
Energy: 1.5064393932380244
Energy: 1.6373293101820983
Energy: 1.4065444659938051
Energy: 1.4163309352661801
Energy: 1.4057844649181923
Energy: 1.414628504351451
Energy: 1.4205889965306366
Energy: 1.3649058722094456
Energy: 1.425249575345229
Energy: 1.400281496453604
Energy: 1.216679359514746
Energy: 1.2101754093857622
Energy: 1.381479049231704
Energy: 1.2178060939577995
Energy: 1.3426333560732033
Energy: 1.5788924089935925
Energy: 1.1655460550585943
Energy: 1.2479819969106551
Energy: 1.2870471858872912
Energy: 1.1652082286920706
Energy: 1.295669151956181
Energy: 1.1433656806667065
Energy: 1.4144353053817118
Energy: 1.3271136394022622
Energy: 1.1520443878240605
Energy: 1.2579451910233186
Energy: 1.2497475454899172
Energy: 1.1610405061290656
Energy: 1.3318030187464573
Energy: 1.3865443650005134
Energy: 1.1591889792483636
Energy: 1.3198391262123195
Energy: 1.2711704471091343
Energy: 1.5740057792168796
Energy: 1.4062654286638885
Energy: 1.409132705747035
Energy: 1.5216645169400418
Energy: 1.401253967187421
Energy: 1.534296583686611
Energy: 1.5985786656447174
Energy: 1.468020724324954
Energy: 1.4681229258042958
Energy: 1.5217742863763393
Energy: 1.4816301588909446
Energy: 1.5248088958212305
Energy: 1.2742894074590396
Energy: 1.28352379740152
Energy: 1.3227181891177262
Energy: 1.2546114634851353
Energy: 1.315465076861614
Energy: 1.3668270597509606
Energy: 1.5798385342091505
Energy: 1.7557321981719476
Energy: 1.5510545546065688
Energy: 1.581004237981552
Energy: 1.6479542229462971
Energy: 1.5501335425320393
Energy: 1.2430513387543527
Energy: 1.493494576815356
Energy: 1.3953152576078454
Energy: 1.157295689400604
Energy: 1.4589644833157749
Energy: 1.327746685784301
Energy: 1.575788830599093
Energy: 1.4152805804213517
Energy: 1.4068559793210613
Energy: 1.5417807744330336
Energy: 1.3930655109237133
Energy: 1.4768149720553942
Energy: 1.1328966800132916
Energy: 1.4428907463745198
Energy: 1.422131202410746
Energy: 1.1331194909960072
Energy: 1.4262032495702415
Energy: 1.2594726149740876
Energy: 1.1877862041502762
Energy: 1.2951087453969992
Energy: 1.289018391473348
Energy: 1.1893742053584457
Energy: 1.353366800786279
Energy: 1.1067592467886245
Energy: 1.112761931941793
Energy: 1.3759747196453425
Energy: 1.2650119881770552
Energy: 1.1126656958803132
Energy: 1.4540401632031346
Energy: 1.2501199467144737
Energy: 1.3845694526809287
Energy: 1.2617606819630576
Energy: 1.304034015744166
Energy: 1.3618973417531401
Energy: 1.2375913709857054
Energy: 1.3269838090115418
Energy: 1.3635043362713632
Energy: 1.2682132718990118
Energy: 1.2555449560716416
Energy: 1.2747298403635652
Energy: 1.2693098230633464
Energy: 1.2826349157405532
Energy: 1.3317262532007792
Energy: 1.594565518971436
Energy: 1.4868481398097886
Energy: 1.3667034683827142
Energy: 1.6481298231397068
Energy: 1.5873908408410495
Energy: 1.3529021252164628
Energy: 1.4672378563777415
Energy: 1.4296724912539445
Energy: 1.424807371466233
Energy: 1.3191423536757483
Energy: 1.3548356387933411
Energy: 1.2823222602158317
Energy: 1.4880884374764807
Energy: 1.3896606419340916
Energy: 1.3513853172676153
Energy: 1.4090875033872916
Energy: 1.483898663839205
Energy: 1.7207049556311607
Energy: 1.4501742691264665
Energy: 1.4921794319533697
Energy: 1.6207274786298773
Energy: 1.408040410774049
Energy: 1.529478950691742
Energy: 1.3184561664019505
Energy: 1.2449021349716367
Energy: 1.2208538373160929
Energy: 1.3195162186677984
Energy: 1.2456665852420001
Energy: 1.2418459343705728
Energy: 1.2404363697860599
Energy: 1.4356879630637125
Energy: 1.4250354567348325
Energy: 1.2638447552401737
Energy: 1.3397190064183673
Energy: 1.370094111962175
Energy: 1.4965467098292264
Energy: 1.1550990380719672
Energy: 1.2347791635294862
Energy: 1.4624719170543383
Energy: 1.1130204112949396
Energy: 1.264797464493156
Energy: 1.395394884717103
Energy: 1.1469915289136658
Energy: 1.1472030579378167
Energy: 1.3287255579015758
Energy: 1.129983442403939
Energy: 1.2097555223244456
Energy: 1.4512532063335746
Energy: 1.1822679090739086
Energy: 1.2622916451996828
Energy: 1.3943888351357328
Energy: 1.09296081747261
Energy: 1.4324138048953077
Energy: 1.4185371755683596
Energy: 1.4770891397739214
Energy: 1.4550683754357006
Energy: 1.4335624185852063
Energy: 1.4535578416797552
Energy: 1.4153865165124306
Energy: 1.4452385353877462
Energy: 1.1343327287229428
Energy: 1.1588361316052516
Energy: 1.4680924281470906
Energy: 1.2233778072120747
Energy: 1.2635430728809758
Energy: 1.752165736859096
Energy: 1.4890690679122633
Energy: 1.562559424150696
Energy: 1.6634880099405873
Energy: 1.4765771734229536
Energy: 1.5908907027506172

minimum gb energy = 1.09296081747261 eV
minimum distance =  2.48930751904728 Angstroms
sigma value = 57


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

Energy: 1.4956145773814604
Energy: 1.8320875267126444
Energy: 1.3782476102981034
Energy: 1.4993189221969145
Energy: 1.8287181399272494
Energy: 1.49288914413779
Energy: 1.4241654325686202
Energy: 1.4140903433890228
Energy: 1.385291147141898
Energy: 1.4254087342457291
Energy: 1.410834816689188
Energy: 1.4164003214828038
Energy: 1.6525565836439686
Energy: 1.3381263991340495
Energy: 1.3041638910467508
Energy: 1.6238820404837166
Energy: 1.1184796106583097
Energy: 1.5954961445275913
Energy: 1.2403422303253224
Energy: 1.3184506971883028
Energy: 1.3674025723332937
Energy: 1.3846503819993023
Energy: 1.4768195152515253
Energy: 1.366332382831938
Energy: 1.3299373072557128
Energy: 1.5307295633991578
Energy: 1.3278449688534069
Energy: 1.318756533171876
Energy: 1.448553014627223
Energy: 1.3518289055651571
Energy: 1.541422637575607
Energy: 1.3777256996719296
Energy: 1.3781568714423096
Energy: 1.4789652872824626
Energy: 1.3732362953433734
Energy: 1.3917435544814643
Energy: 1.195131891334988
Energy: 1.2621069537835525
Energy: 1.1971557676475713
Energy: 1.196315620367579
Energy: 1.1197363560845743
Energy: 1.27652761440615
Energy: 1.3124621459755987
Energy: 1.2469770805795002
Energy: 1.3388045996171019
Energy: 1.30243072237683
Energy: 1.2398517855966897
Energy: 1.2931669229093055
Energy: 1.7044016693491066
Energy: 1.3109985836188436
Energy: 1.3639489197170114
Energy: 1.2878629261969003
Energy: 1.3084643048218048
Energy: 1.3998552115997926
Energy: 1.704527116612351
Energy: 1.3815502949142529
Energy: 1.3642141470730187
Energy: 1.287056476925772
Energy: 1.3776898710614713
Energy: 1.4001355285580752
Energy: 1.4274526124654308
Energy: 1.395064362184819
Energy: 1.369061535991521
Energy: 1.4259557487716197
Energy: 1.4106882917310903
Energy: 1.3683318527742767
Energy: 1.6675584150909635
Energy: 1.4055460497149816
Energy: 1.3045779735812302
Energy: 1.6695573555794838
Energy: 1.3079695156948474
Energy: 1.4061681389923728
Energy: 1.3295159970860089
Energy: 1.4579909818837997
Energy: 1.3959844293325372
Energy: 1.3309761131942064
Energy: 1.4483660938490097
Energy: 1.3423243391584214
Energy: 1.4430529389509394
Energy: 1.413613714738796
Energy: 1.409673267480078
Energy: 1.427866855816347
Energy: 1.4132013491013435
Energy: 1.431699343926164
Energy: 1.366283221956429
Energy: 1.3028974610862287
Energy: 1.4270050521846505
Energy: 1.3675309160660654
Energy: 1.3050138165216565
Energy: 1.2961638181377773
Energy: 1.3338367329896432
Energy: 1.1459552165461495
Energy: 1.1881488718887196
Energy: 1.3344929224851274
Energy: 1.1475332659113424
Energy: 1.2533065444438711
Energy: 1.1660852188087836
Energy: 1.3883963559833243
Energy: 1.2794259655451503
Energy: 1.1665827686478523
Energy: 1.3893982415064297
Energy: 1.3018740293887234

minimum gb energy = 1.1184796106583097 eV
minimum distance =  2.47873650142659 Angstroms
sigma value = 9


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

Energy: 1.7269192843368153
Energy: 2.112234934832422
Energy: 1.5869040593744683
Energy: 1.7297332140751007
Energy: 2.070564987433537
Energy: 1.5921815005617006
Energy: 1.5277709917332423
Energy: 1.4420257988725396
Energy: 1.4562128817542712
Energy: 1.619019518202154
Energy: 1.48134044550684
Energy: 1.4577808120423494
Energy: 1.5051054445451362
Energy: 1.3107602722634188
Energy: 1.4734312122404651
Energy: 1.5062928572786947
Energy: 1.38368148902453
Energy: 1.4632397764532636
Energy: 1.4111167341727253
Energy: 1.3670939758494987
Energy: 1.3626087816283947
Energy: 1.3839919970849863
Energy: 1.3388317768240663
Energy: 1.347822656802054
Energy: 1.2711527251212371
Energy: 1.2864258640353379
Energy: 1.2975399609205913
Energy: 1.2348608178945704
Energy: 1.287989984622339
Energy: 1.2616726633865807
Energy: 1.4275165218862207
Energy: 1.239386404461029
Energy: 1.2125796846871582
Energy: 1.2114520377419564
Energy: 1.2502240024342242
Energy: 1.2216833746056337
Energy: 1.4906415163431226
Energy: 1.3542419268152786
Energy: 1.605602154412909
Energy: 1.4908737015410587
Energy: 1.3595089191118916
Energy: 1.593195047657108
Energy: 1.3566178135471256
Energy: 1.360226060603542
Energy: 1.3499086282285035
Energy: 1.356253376348856
Energy: 1.3763477296182793
Energy: 1.3670753052551632
Energy: 1.5440459073130566
Energy: 1.453211159837055
Energy: 1.4375408158311562
Energy: 1.526405036956709
Energy: 1.450226208561227
Energy: 1.482998249739177
Energy: 1.5326772131281248
Energy: 1.3965725447047401
Energy: 1.3991345691055637
Energy: 1.5677498867998916
Energy: 1.4107653575839587
Energy: 1.4226406473108932
Energy: 1.2607687659701592
Energy: 1.3000827161806257
Energy: 1.2484452599254778
Energy: 1.2603221651729557
Energy: 1.2774497234294926
Energy: 1.2398954180868609
Energy: 1.2043897732825997
Energy: 1.2968938786017248
Energy: 1.313060851731823
Energy: 1.2043109268949157
Energy: 1.2313067045112214
Energy: 1.2490821986365348
Energy: 1.4503785144445673
Energy: 1.4514643041688788
Energy: 1.438163842298859
Energy: 1.3636583198807446
Energy: 1.392100460931324
Energy: 1.3331787522625551
Energy: 1.4561913214454436
Energy: 1.4264471987246787
Energy: 1.4268424218038682
Energy: 1.3968082374497888
Energy: 1.4358434089203793
Energy: 1.348981716753321
Energy: 1.4260255471763703
Energy: 1.2767669355298557
Energy: 1.2795165133601818
Energy: 1.555765623348547
Energy: 1.3548585071968295
Energy: 1.4823782980694686
Energy: 1.5361030330087753
Energy: 1.489405663099054
Energy: 1.4366659891046414
Energy: 1.536529375737145
Energy: 1.6386344067932457
Energy: 1.6796880374815921
Energy: 1.3638342999642592
Energy: 1.3902493618366598
Energy: 1.3494066751029792
Energy: 1.3785495379131738
Energy: 1.4100339188417828
Energy: 1.3089234244345005
Energy: 1.3093580596572167
Energy: 1.3437371565125964
Energy: 1.324725790865835
Energy: 1.3109561653404556
Energy: 1.3185642723469402
Energy: 1.3149602503788784
Energy: 1.269472076349578
Energy: 1.407597716570468
Energy: 1.3586823512689021
Energy: 1.2704123763989978
Energy: 1.3942056210833838
Energy: 1.3325335589411504
Energy: 1.3972582274880767
Energy: 1.2887932379272071
Energy: 1.295976596356113
Energy: 1.3980211029989327
Energy: 1.2873341825085747
Energy: 1.3476150175250996
Energy: 1.6360022955760123
Energy: 1.49920027775151
Energy: 1.5074048182523638
Energy: 1.528731906903806
Energy: 1.4817983691460246
Energy: 1.4157777982653772

minimum gb energy = 1.2043109268949157 eV
minimum distance =  2.51619201635075 Angstroms
sigma value = 27


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

Energy: 1.0848077697311485
Energy: 1.9294876901433506
Energy: 1.1719542063589121
Energy: 1.0872721645308965
Energy: 2.004150053209919
Energy: 1.1349924827962095
Energy: 1.398506842742179
Energy: 1.1969516265851141
Energy: 1.2150072693972132
Energy: 1.3997405574324617
Energy: 1.1957398179240661
Energy: 1.1815936616541558
Energy: 1.4465350097870087
Energy: 1.222286591615397
Energy: 1.2030811671180246
Energy: 1.447401932560846
Energy: 1.0919615154782516
Energy: 1.2010785681402254
Energy: 1.1908325055722153
Energy: 1.2147961754469263
Energy: 1.221911045665866
Energy: 1.1909300436843113
Energy: 1.3657466387239623
Energy: 1.221904765845494
Energy: 1.108813814516894
Energy: 1.1622346090741789
Energy: 1.162558867201483
Energy: 1.1097560408904799
Energy: 1.17900377264161
Energy: 1.1403527288280686
Energy: 1.301499687856069
Energy: 1.2783110021754354
Energy: 1.1927214383778109
Energy: 1.148132282883814
Energy: 1.3034383039191721
Energy: 1.173285415118129
Energy: 1.2040008139909664
Energy: 1.0913702860373806
Energy: 1.1380418066178275
Energy: 1.1781895034411247
Energy: 1.0917285743548883
Energy: 1.1716518360381383
Energy: 1.2256774423319978
Energy: 1.2561189650423803
Energy: 1.1811019543667216
Energy: 1.1955979028268326
Energy: 1.2554601176741822
Energy: 1.2179861644432655
Energy: 1.3676690344996947
Energy: 1.4779332223611035
Energy: 1.2215349096683366
Energy: 1.2454636588338635
Energy: 1.529818782844435
Energy: 1.2217517538801077
Energy: 1.3494367525583275
Energy: 1.2233442068710705
Energy: 1.2217606958173783
Energy: 1.2448050029659654
Energy: 1.4464085449065658
Energy: 1.2216874712350254
Energy: 1.2052387251068746
Energy: 1.129021412600994
Energy: 1.126942933707803
Energy: 1.1774637121578269
Energy: 1.1105363923356624
Energy: 1.140030708141206
Energy: 1.299438233099171
Energy: 1.1876920060723688
Energy: 1.1714657761885952
Energy: 1.2707625469257653
Energy: 1.1476483652760046
Energy: 1.171138403186541
Energy: 1.0850931752030055
Energy: 1.2014034911792064
Energy: 1.1676855151771552
Energy: 1.0859334783168686
Energy: 1.197144218451235
Energy: 1.1335577347897305
Energy: 1.2566715874411996
Energy: 1.1993306687605811
Energy: 1.1962804612743214
Energy: 1.25681181295498
Energy: 1.1975185774655428
Energy: 1.1160481208734183
Energy: 1.52421806802539
Energy: 1.222736949025085
Energy: 1.221699255172035
Energy: 1.5242376485941658
Energy: 1.2449899069182613
Energy: 1.2216383946304088
Energy: 1.4417022642535964
Energy: 1.2242570429503379
Energy: 1.2233023702257193
Energy: 1.441673177573082
Energy: 1.2242795760849132
Energy: 1.2215689572537864
Energy: 1.2587546118802435
Energy: 1.2381600849305043
Energy: 1.1896412091589672
Energy: 1.111157188122656
Energy: 1.195657249361499
Energy: 1.1813710299256315
Energy: 1.147003628488195
Energy: 1.2754971079175639
Energy: 1.2777669600363226
Energy: 1.1478725526769866
Energy: 1.2712369972142443
Energy: 1.1714969644495392
Energy: 1.2174104828844379
Energy: 1.087811096274737
Energy: 1.115556855948113
Energy: 1.2185198724851312
Energy: 1.0866938257301293
Energy: 1.151722394063857
Energy: 1.2251950229987478
Energy: 1.087498312268209
Energy: 1.115718856846895
Energy: 1.1953157278329496
Energy: 1.0868085771810807
Energy: 1.1518159585641932
Energy: 1.3498491838037463
Energy: 1.2997177290948725
Energy: 1.2994814424308256
Energy: 1.36543357764062
Energy: 1.2569022086805652
Energy: 1.222265324252988
Energy: 1.2538358837056895
Energy: 1.4717740514007127
Energy: 1.4783418553744052
Energy: 1.0900502135293002
Energy: 1.441486129160968
Energy: 1.2220149989115878
Energy: 1.3295621076882813
Energy: 1.1802099871871758
Energy: 1.1808925426838295
Energy: 1.3689673334287602
Energy: 1.1792883776771548
Energy: 1.1830363918375153
Energy: 1.3039124033292058
Energy: 1.1556270415689816
Energy: 1.1730407376915903
Energy: 1.2737338391459894
Energy: 1.1887305662920096
Energy: 1.190597982626832
Energy: 1.2564866324501955
Energy: 1.2232743170756477
Energy: 1.178348473457814
Energy: 1.2567834075613362
Energy: 1.219080630499594
Energy: 1.1163584437398588

minimum gb energy = 1.0848077697311485 eV
minimum distance =  2.52285872581814 Angstroms
sigma value = 19


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

Energy: 1.659838022706762
Energy: 2.1686515777535083
Energy: 1.6861867938964212
Energy: 1.6623245374408986
Energy: 2.166533437425687
Energy: 1.7444966105113737
Energy: 1.4813995346632354
Energy: 1.3352121679726001
Energy: 1.3320079318969578
Energy: 1.400144323863273
Energy: 1.362183214484643
Energy: 1.3103896771299537
Energy: 1.2819831376123585
Energy: 1.2745773425938065
Energy: 1.3221654518211479
Energy: 1.2783238859582515
Energy: 1.2650760332651134
Energy: 1.307564110418443
Energy: 1.3490842216045975
Energy: 1.3215703591915113
Energy: 1.3393407395516523
Energy: 1.353140218976731
Energy: 1.3198889594994345
Energy: 1.3394269026007268
Energy: 1.1608098694890912
Energy: 1.3281286960086505
Energy: 1.3274570295975698
Energy: 1.1630471921528478
Energy: 1.341732066861962
Energy: 1.336074920735956
Energy: 1.3288012022990252
Energy: 1.3607012776465393
Energy: 1.2706859731976354
Energy: 1.3289126699739124
Energy: 1.3617672393519125
Energy: 1.2526382757356904
Energy: 1.5909758177537716
Energy: 1.6980405870347293
Energy: 1.6532007496505698
Energy: 1.590916746171458
Energy: 1.771868655604509
Energy: 1.6141599744603945
Energy: 1.4386926151772643
Energy: 1.2966335087543672
Energy: 1.350689309217352
Energy: 1.3975480430163616
Energy: 1.3660152936153296
Energy: 1.357842985720078
Energy: 1.141442417815266
Energy: 1.2170143629789132
Energy: 1.2448757750134376
Energy: 1.1419988981437614
Energy: 1.217133036135665
Energy: 1.1632893015825096
Energy: 1.468959312852043
Energy: 1.2375576655275493
Energy: 1.2222798149203822
Energy: 1.477997361019781
Energy: 1.279170187096932
Energy: 1.2489385796687702
Energy: 1.4232741051411033
Energy: 1.4033583179704259
Energy: 1.4761120440322748
Energy: 1.4284065276226952
Energy: 1.3753001849502389
Energy: 1.4024514909246835
Energy: 1.3844614674551783
Energy: 1.3219748323104974
Energy: 1.2885699506603914
Energy: 1.3712877707774351
Energy: 1.3854648409635881
Energy: 1.2835039005131934
Energy: 1.5839304376773107
Energy: 1.3079426782260384
Energy: 1.5340495182550984
Energy: 1.5391743394796649
Energy: 1.3230100189387586
Energy: 1.5079408798617684
Energy: 1.47435846755981
Energy: 1.3148350499944397
Energy: 1.3275090198935535
Energy: 1.4911781745024668
Energy: 1.3137513879390113
Energy: 1.3503797269429991
Energy: 1.1603983312489352
Energy: 1.1060994336486818
Energy: 1.1687597299744301
Energy: 1.187654479897313
Energy: 1.0793863720138346
Energy: 1.2564152175357066
Energy: 1.211783617008919
Energy: 1.1788794872525121
Energy: 1.2144119859406106
Energy: 1.2357424969971957
Energy: 1.2013684999937828
Energy: 1.2107120202888726
Energy: 1.3890011286201316
Energy: 1.5269709308366635
Energy: 1.5521494349590665
Energy: 1.3854008988199764
Energy: 1.5276108939599051
Energy: 1.576076096996374
Energy: 1.4805322973399773
Energy: 1.373560713330151
Energy: 1.413332954884401
Energy: 1.4083651191664188
Energy: 1.3818890696493875
Energy: 1.3169463658446356
Energy: 1.2845463549547274
Energy: 1.3443419236266276
Energy: 1.4501581153561538
Energy: 1.3285722197834624
Energy: 1.3571132748268564
Energy: 1.407051324657805
Energy: 1.3746476262327243
Energy: 1.4473220059596446
Energy: 1.447452772669663
Energy: 1.3816282972991158
Energy: 1.414010018183313
Energy: 1.4236375299936765
Energy: 1.100952135628891
Energy: 1.2141842809116707
Energy: 1.2099380167213751
Energy: 1.1014419947640923
Energy: 1.2235691210351285
Energy: 1.2100053775175044
Energy: 1.1152896664934087
Energy: 1.2088735617845903
Energy: 1.2470363841807937
Energy: 1.1756352459562187
Energy: 1.222593691410738
Energy: 1.2164678601263594
Energy: 1.4559359012981785
Energy: 1.5703561522027984
Energy: 1.5765839283693759
Energy: 1.5414239351189123
Energy: 1.625463324406149
Energy: 1.566646334018868
Energy: 1.3113643114650737
Energy: 1.435982149081269
Energy: 1.5085544459984825
Energy: 1.3056963730961064
Energy: 1.4754239652962677
Energy: 1.454286456505402
Energy: 1.467581813482313
Energy: 1.3503838239457422
Energy: 1.338598545731939
Energy: 1.3435096510633093
Energy: 1.364312683960577
Energy: 1.403390118373093
Energy: 1.246371367996816
Energy: 1.3180615093386414
Energy: 1.3556415488952958
Energy: 1.2472666082812685
Energy: 1.3142577579744563
Energy: 1.3735848965973594
Energy: 1.2517328362487348
Energy: 1.1810649812206602
Energy: 1.1897769206519297
Energy: 1.2181129160510384
Energy: 1.1254989458603244
Energy: 1.2298473776098016
Energy: 1.2576798360114803
Energy: 1.138391819889145
Energy: 1.1971403043323745
Energy: 1.2567727513578073
Energy: 1.178972943560627
Energy: 1.2339899257390083
Energy: 1.778875296197757
Energy: 1.3644606173024563
Energy: 1.4415937023875836
Energy: 1.5397063256257804
Energy: 1.3968447795114556
Energy: 1.5907612902103747

minimum gb energy = 1.0793863720138346 eV
minimum distance =  2.48815822519684 Angstroms
sigma value = 101


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

Energy: 1.5396829176243831
Energy: 2.0216878308449795
Energy: 1.8763326171156733
Energy: 1.541740193594978
Energy: 2.071996300490144
Energy: 1.4565815582950128
Energy: 1.3811191718530118
Energy: 1.4316677356818093
Energy: 1.3306684174031234
Energy: 1.4500309504706073
Energy: 1.426477706474974
Energy: 1.2836134742989207
Energy: 1.3067050352834264
Energy: 1.366608741239234
Energy: 1.3551561699596357
Energy: 1.3179137694825902
Energy: 1.2841449001170535
Energy: 1.3498867837295825
Energy: 1.3067161237064153
Energy: 1.2998768927008932
Energy: 1.3577342867180153
Energy: 1.3336554399427416
Energy: 1.359941799731583
Energy: 1.396384558700186
Energy: 1.052704057479375
Energy: 1.3888600982447925
Energy: 1.4015975713310778
Energy: 1.0550025683087265
Energy: 1.3380034020443377
Energy: 1.2253442156154843
Energy: 1.2641737550411232
Energy: 1.3896006584911293
Energy: 1.2914606587295057
Energy: 1.1753847137261066
Energy: 1.3654400226496968
Energy: 1.1834096251134856
Energy: 1.763685859668497
Energy: 1.7351339858159796
Energy: 1.6938653190650526
Energy: 1.6924145146821323
Energy: 1.738059373676303
Energy: 1.604250651468943
Energy: 1.2193309267174093
Energy: 1.396182282017092
Energy: 1.37117188446982
Energy: 1.3169827072734495
Energy: 1.409246804490455
Energy: 1.3112361382787314
Energy: 1.0406638752314068
Energy: 1.2743649853158807
Energy: 1.239238191926531
Energy: 1.0417050946686013
Energy: 1.241531517757378
Energy: 1.1336733503075846
Energy: 1.3667438427575531
Energy: 1.2698928282405753
Energy: 1.2242136068993843
Energy: 1.1971849858386225
Energy: 1.3300550489590517
Energy: 1.2604288506331889
Energy: 1.617676855517286
Energy: 1.5073670092789113
Energy: 1.4729488753441573
Energy: 1.6186681107970022
Energy: 1.6078844963794061
Energy: 1.4442203188857359
Energy: 1.4406697817102847
Energy: 1.2496378491636173
Energy: 1.250243649398886
Energy: 1.4420529230863275
Energy: 1.4114034369925839
Energy: 1.3789744038527014
Energy: 1.2968313305415495
Energy: 1.5405507133456298
Energy: 1.462921955818987
Energy: 1.297709321924123
Energy: 1.5393690798611883
Energy: 1.6853888702148485
Energy: 1.5951339565737324
Energy: 1.432562335162967
Energy: 1.3500181824291937
Energy: 1.5278614947371274
Energy: 1.3583658533983303
Energy: 1.2690439755710028
Energy: 1.1700102893995923
Energy: 1.1267800006221278
Energy: 1.1387237224437008
Energy: 1.171432961835234
Energy: 1.0399763859398097
Energy: 1.2134091132498208
Energy: 1.271449082086605
Energy: 1.1855561523336398
Energy: 1.1543055774448747
Energy: 1.2721252409852277
Energy: 1.3399306689769588
Energy: 1.2902262098330022
Energy: 1.5453013754247238
Energy: 1.537720713349651
Energy: 1.7659426324818386
Energy: 1.5465586406469414
Energy: 1.5369449234719295
Energy: 1.4424063303240553
Energy: 1.548349932309015
Energy: 1.4234552333891457
Energy: 1.3599101452934756
Energy: 1.310212854320593
Energy: 1.4785576408669228
Energy: 1.3931484704653976
Energy: 1.3137918477931425
Energy: 1.3694565995854995
Energy: 1.352334977467161
Energy: 1.3059177360938892
Energy: 1.277185568794578
Energy: 1.3544602508937635
Energy: 1.317545831233256
Energy: 1.321598067662975
Energy: 1.3297471401269243
Energy: 1.3180481566588376
Energy: 1.2803393077780474
Energy: 1.3191219514429378
Energy: 1.056059332822936
Energy: 1.3861460498574412
Energy: 1.3836478371880259
Energy: 1.0555431772989388
Energy: 1.3427756840692076
Energy: 1.2395246449651256
Energy: 1.1750500768156036
Energy: 1.3252352552975883
Energy: 1.2562656678087438
Energy: 1.1753949213793955
Energy: 1.3244746673125303
Energy: 1.1775149540880885
Energy: 1.335298597057943
Energy: 1.7196673148024104
Energy: 1.6574228070627282
Energy: 1.3356834142740108
Energy: 1.7128437518815214
Energy: 1.660061773873223
Energy: 1.2810355123518993
Energy: 1.745342151760621
Energy: 1.6552793481939798
Energy: 1.321037376135197
Energy: 1.5154095442198656
Energy: 1.3256625361381646
Energy: 1.0380134821021407
Energy: 1.2403071450666199
Energy: 1.1994259798894216
Energy: 1.037873852442374
Energy: 1.2409254087871655
Energy: 1.1468452276157386
Energy: 1.037648964427801
Energy: 1.271757118189205
Energy: 1.2215930792278533
Energy: 1.0380984637775184
Energy: 1.2686442624879009
Energy: 1.1958526439657384
Energy: 1.3562109202568426
Energy: 1.4528762818154448
Energy: 1.4664571802617319
Energy: 1.354697393867656
Energy: 1.5528203255440436
Energy: 1.4593042671608893
Energy: 1.3420482098489999
Energy: 1.4693926549201164
Energy: 1.4712263732709678
Energy: 1.342860317021818
Energy: 1.427135880983871
Energy: 1.4075576723366834
Energy: 1.3532257113565944
Energy: 1.3884666265783905
Energy: 1.4138112063681836
Energy: 1.3491041179437302
Energy: 1.3819161984532444
Energy: 1.445985834170282
Energy: 1.439638669485785
Energy: 1.5530582161163053
Energy: 1.5741414593883623
Energy: 1.297555175905578
Energy: 1.4195127383203114
Energy: 1.5588153439382455
Energy: 1.1894778935680985
Energy: 1.0894704549041434
Energy: 1.1541205184448184
Energy: 1.1907558423128757
Energy: 1.0379420789838956
Energy: 1.220363247638118
Energy: 1.2717752828117388
Energy: 1.114880118028132
Energy: 1.1605391842840722
Energy: 1.2720427324175227
Energy: 1.1209456249111185
Energy: 1.2412873581208879
Energy: 1.4546525754391648
Energy: 1.3850536941958629
Energy: 1.464478516904573
Energy: 1.5916169610367688
Energy: 1.3580381524992833
Energy: 1.4429228297724668

minimum gb energy = 1.037648964427801 eV
minimum distance =  2.49660661733824 Angstroms
sigma value = 33


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

Energy: 0.01474292572598721
Energy: 0.8439200220621809
Energy: 0.015323980350195051
Energy: 0.016570177991030874
Energy: 0.84580626865834
Energy: 0.015157060974825382
Energy: 0.7054780509517083
Energy: 0.10769508699955183
Energy: 0.10651053793570416
Energy: 0.10886881489026441
Energy: 0.7343631183995879
Energy: 0.10609910978447644
Energy: 1.4527477219773683
Energy: 0.8450882919920572
Energy: 0.8438411011881989
Energy: 0.8449943902267432
Energy: 1.1254110869449723
Energy: 0.8433613753779445
Energy: 0.015477811809413421
Energy: 0.10769508699767842
Energy: 0.10651053793608735
Energy: 0.10886881488988122
Energy: 0.7343631183995879
Energy: 0.10609910978447644

minimum gb energy = 0.01474292572598721 eV
minimum distance =  2.71787436515801 Angstroms
sigma value = 1