Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Ni__MO_700541006254_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5213917642831802
cohesive_energy=4.450350014520368
mass=58.6934
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=[1.9905923153806198e-19, 2.8384161247944e-19, 3.48808272811506e-19, 4.0176822144837597e-19, 4.463071296969419e-19, 4.84454955352482e-19, 5.175110636651699e-19, 5.463662648435099e-19, 5.716694404242719e-19, 5.9391085645746e-19, 6.13462217922162e-19, 6.30637551438642e-19, 6.456932052683399e-19, 6.588246449606038e-19, 6.702097121218079e-19, 6.799926026490119e-19, 6.883014906729359e-19, 6.95245324204692e-19, 7.009234381955879e-19, 7.0541754365395795e-19, 7.088061472348679e-19, 7.11153336003678e-19, 7.125231970257479e-19, 7.1296860213e-19, 7.12491153493068e-19, 7.1094985957116e-19, 7.08162072228e-19, 7.03906691088096e-19, 6.979273678900079e-19, 6.89911678190106e-19, 6.794895191859359e-19, 6.662122814199779e-19, 6.4953842918994e-19, 6.288062635459799e-19, 6.032050831112939e-19, 5.71731925312998e-19, 5.331386945532059e-19, 4.85855257730598e-19, 4.2789812017228195e-19, 3.56721423206832e-19, 2.6902948949810996e-19, 1.6049804431094998e-19, 2.5378798317886796e-20, -1.4412588194109418e-19, -3.5915512951387797e-19, -6.36894051194412e-19, -1.005383461777974e-18, -1.51311163491594e-18, -2.2496162117994e-18, -3.3929935448871597e-18, -5.3287433540859595e-18, -8.97712385443272e-18, -1.67919326479638e-17, -3.6084061933284595e-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: 0.018089586499843026
Energy: 0.5156468315278044
Energy: 0.018495285555239785
Energy: 0.01837238264642095
Energy: 1.7075392863853807
Energy: 0.018417150559433756
Energy: 0.51564683152718
Energy: 0.15909894532572533
Energy: 0.15911067027525377
Energy: 0.1599234351634607
Energy: 0.515859952511561
Energy: 0.16074043993620196
Energy: 0.018495285555239785
Energy: 0.15911067027525377
Energy: 0.16028065908327147
Energy: 0.018510480705140855
Energy: 0.5172090456842965
Energy: 0.16014143457807706
Energy: 0.01837238264642095
Energy: 0.1599234351627997
Energy: 0.018510480705140855
Energy: 0.018401212056209357
Energy: 1.3641814585786658
Energy: 0.01849351259919206
Energy: 1.707539286386005
Energy: 0.5158599525112305
Energy: 0.517209045683966
Energy: 1.3641814585783354
Energy: 0.15915421217014425
Energy: 0.5165134454499116
Energy: 0.018417150559433756
Energy: 0.16074043993587145
Energy: 0.16014143457774654
Energy: 0.01849351259919206
Energy: 0.5165134454496177
Energy: 0.018419288596038988

minimum gb energy = 0.018089586499843026 eV
minimum distance =  2.48740837138602 Angstroms
sigma value = 1


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

Energy: 1.7862819175923164
Energy: 1.516863338739702
Energy: 1.6889278334443258
Energy: 1.5047302695128817
Energy: 1.5812317119583505
Energy: 1.6837686646639898
Energy: 1.6129958147956704
Energy: 1.224389273046377
Energy: 1.2241022113276083
Energy: 1.3275698117524086
Energy: 1.2241438661076032
Energy: 1.2233430998763375
Energy: 1.6476360146887379
Energy: 1.2237450932206284
Energy: 1.2236134497034317
Energy: 1.4964647105839
Energy: 1.2239927693120076
Energy: 1.199919428737057
Energy: 1.6729678283627594
Energy: 1.2113539882705229
Energy: 1.4322915112369243
Energy: 1.2194298902134193
Energy: 1.4603758586329356
Energy: 1.5962387171783006
Energy: 1.6157787151504628
Energy: 1.3073930974851862
Energy: 1.3064218844193776
Energy: 1.4715805267250854
Energy: 1.3084706880304215
Energy: 1.3078705369075283
Energy: 1.5668130868575787
Energy: 1.2954111123698253
Energy: 1.2955823170175664
Energy: 1.5179860022927953
Energy: 1.3113938928815791
Energy: 1.2866840921153277
Energy: 1.5872909696787547
Energy: 1.3291943234385768
Energy: 1.3230933161875802
Energy: 1.5280909007614356
Energy: 1.358976969445966
Energy: 1.291448514960308
Energy: 1.5394167150356475
Energy: 1.3955226246486296
Energy: 1.3667017411318017
Energy: 1.5389134701232334
Energy: 1.3848519879039305
Energy: 1.357453909342528
Energy: 1.3276045448571896
Energy: 1.2823253472761869
Energy: 1.281065461404541
Energy: 1.3272491796149368
Energy: 1.378693766942187
Energy: 1.281148206728694
Energy: 1.3282249259857095
Energy: 1.3483937635649692
Energy: 1.3081780372362766
Energy: 1.3283291345595882
Energy: 1.3313757897695546
Energy: 1.307843864429343
Energy: 1.6042566102242535
Energy: 1.505984646220511
Energy: 1.5060769518856396
Energy: 1.6029828334290035
Energy: 1.523003617302764
Energy: 1.6948551316177038
Energy: 1.2238843713223846
Energy: 1.2535900353937024
Energy: 1.1857896866258806
Energy: 1.2240316936361424
Energy: 1.3259831928236063
Energy: 1.2235327106385174
Energy: 1.2243077777260454
Energy: 1.2951248988054918
Energy: 1.200604029023465
Energy: 1.2243501780491555
Energy: 1.3538714962488265
Energy: 1.2234545378357877
Energy: 1.2636716243388255
Energy: 1.5963547693025282
Energy: 1.5959007707370911
Energy: 1.2626699792772804
Energy: 1.5951143035625914
Energy: 1.79749576037281
Energy: 1.26278853016728
Energy: 1.3471080678145027
Energy: 1.26315241868258
Energy: 1.262784808727378
Energy: 1.3357612604142781
Energy: 1.2636484769168752
Energy: 1.262820527607663
Energy: 1.3025574444026762
Energy: 1.216660028324317
Energy: 1.2629149940521174
Energy: 1.3320251032137853
Energy: 1.2271940540737505
Energy: 1.5348687499012594
Energy: 1.3493363541080592
Energy: 1.348873828619541
Energy: 1.5352419109534887
Energy: 1.33601001087267
Energy: 1.2203681323240942
Energy: 1.4552454074374868
Energy: 1.3668317594183732
Energy: 1.342683986555979
Energy: 1.4064485810305394
Energy: 1.347378388373991
Energy: 1.342133410903019
Energy: 1.4828217452232826
Energy: 1.326352589163994
Energy: 1.325243638229746
Energy: 1.4324675648561767
Energy: 1.3315395358067181
Energy: 1.325164031607584
Energy: 1.4815590639249092
Energy: 1.3286460325608715
Energy: 1.3272156942166862
Energy: 1.3471109493232503
Energy: 1.3271671927750737
Energy: 1.3284141771247142
Energy: 1.6215971068487687
Energy: 1.4255603473142744
Energy: 1.5145900271386095
Energy: 1.524839564844352
Energy: 1.2936589705541968
Energy: 1.522179804815912
Energy: 1.6150683326933963
Energy: 1.2622817460233242
Energy: 1.2616675267409403
Energy: 1.647452516303623
Energy: 1.262360824178942
Energy: 1.2379651497058866
Energy: 1.6773377142006018
Energy: 1.2621946092449838
Energy: 1.2624641628694433
Energy: 1.3441859731442019
Energy: 1.262001111641203
Energy: 1.2625032455098657

minimum gb energy = 1.1857896866258806 eV
minimum distance =  2.23069269637738 Angstroms
sigma value = 33


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

Energy: 2.0129973783749766
Energy: 1.3515282569075433
Energy: 1.6146867179986657
Energy: 1.6116865122737107
Energy: 1.5934065226180536
Energy: 1.6532553615443737
Energy: 1.6991845183243244
Energy: 1.2315265520747598
Energy: 1.2316492236973635
Energy: 1.6006481430706339
Energy: 1.2313008356033466
Energy: 1.2302993819813473
Energy: 1.6458686075082802
Energy: 1.2727198291912678
Energy: 1.2546098385186149
Energy: 1.6463570300276975
Energy: 1.2313036065485243
Energy: 1.2915954928302529
Energy: 1.697969010232138
Energy: 1.3024421199648268
Energy: 1.292513125448347
Energy: 1.552563781581854
Energy: 1.4598425304608216
Energy: 1.5068641150675928
Energy: 1.533868675970019
Energy: 1.3466689614689953
Energy: 1.3430985131703748
Energy: 1.3339755028808633
Energy: 1.342922573260143
Energy: 1.3470988323692985
Energy: 1.5681392899153752
Energy: 1.337487024261347
Energy: 1.3306597596427079
Energy: 1.5653799953555694
Energy: 1.3369711979344507
Energy: 1.308871528505996
Energy: 1.5688525413576546
Energy: 1.3616185195581485
Energy: 1.3373904327157908
Energy: 1.5572121839650965
Energy: 1.4844260305142554
Energy: 1.3370484846179982
Energy: 1.538532187944365
Energy: 1.3605334130173234
Energy: 1.3592322606985814
Energy: 1.4985614920040247
Energy: 1.36077517966485
Energy: 1.350182156186683
Energy: 1.362981284052516
Energy: 1.3468557316020289
Energy: 1.3539256609000567
Energy: 1.363236351541978
Energy: 1.4363824346779102
Energy: 1.3556936791104142
Energy: 1.4003940288026988
Energy: 1.3888695747321755
Energy: 1.3481826507239172
Energy: 1.4011886624192735
Energy: 1.4277616309835743
Energy: 1.3457268980722055
Energy: 1.425376972047712
Energy: 1.6117255350416666
Energy: 1.611949240290036
Energy: 1.3347266634154
Energy: 1.6122204540446254
Energy: 1.6193713871375102
Energy: 1.2909100467955599
Energy: 1.270912654230971
Energy: 1.267458207735791
Energy: 1.2909074875864042
Energy: 1.3563378780976965
Energy: 1.289001022157932
Energy: 1.2920155828017705
Energy: 1.3534159258828986
Energy: 1.278116896585075
Energy: 1.292272439385446
Energy: 1.3934554125340923
Energy: 1.291457228167287
Energy: 1.8263689934094591
Energy: 1.5074747816147718
Energy: 1.506450899071514
Energy: 1.8151307578789524
Energy: 1.5053267241246455
Energy: 1.3266524926399748
Energy: 1.3789257995791144
Energy: 1.3999746478994162
Energy: 1.350424340628951
Energy: 1.373164800814694
Energy: 1.4222029096417141
Energy: 1.335640226026964
Energy: 1.3528178357177494
Energy: 1.351639616645757
Energy: 1.3132645918448362
Energy: 1.3336971820792693
Energy: 1.3990725755887952
Energy: 1.3394332431790936
Energy: 1.536953591650918
Energy: 1.3360304318472558
Energy: 1.3307412028908208
Energy: 1.4913546525389922
Energy: 1.3362522541332047
Energy: 1.3519333907736744
Energy: 1.407312710118117
Energy: 1.396715392627198
Energy: 1.4246924270553227
Energy: 1.4069735883976016
Energy: 1.388933608644581
Energy: 1.3515632642311342
Energy: 1.4745295535501834
Energy: 1.356184833097671
Energy: 1.3626501146020231
Energy: 1.4727552011989422
Energy: 1.365378428246811
Energy: 1.341711546149909
Energy: 1.5464433805013766
Energy: 1.3481252449136882
Energy: 1.3491702655836348
Energy: 1.396386936207424
Energy: 1.3542126640248373
Energy: 1.3493722541895143
Energy: 1.6418030877629552
Energy: 1.5519649412978693
Energy: 1.4313673237838598
Energy: 1.6120872539672144
Energy: 1.3810378311121811
Energy: 1.6116896414223254
Energy: 1.7782290878822127
Energy: 1.2899710342111272
Energy: 1.2901921365267914
Energy: 1.5885457616297833
Energy: 1.2895968424955473
Energy: 1.290613461770688
Energy: 1.6668218130539827
Energy: 1.2918695360369405
Energy: 1.291047458449869
Energy: 1.395556554499137
Energy: 1.2921931952179821
Energy: 1.29159390626792
Energy: 1.6968887070965541
Energy: 1.992539054159637
Energy: 1.9938884532455141
Energy: 1.553402114065721
Energy: 1.8190372288001175
Energy: 1.5058906411843693
Energy: 1.521320057658975
Energy: 1.332877992130509
Energy: 1.335124188953197
Energy: 1.4193566289285378
Energy: 1.3322727908991407
Energy: 1.3268890583502377
Energy: 1.669100421087123
Energy: 1.3338418896576987
Energy: 1.338385112785899
Energy: 1.6605492475894608
Energy: 1.3336045857429204
Energy: 1.3125981595210836
Energy: 1.5682845690909801
Energy: 1.5322666082992114
Energy: 1.5321769430067713
Energy: 1.5469638094478375
Energy: 1.3202265363808237
Energy: 1.5313446790931997
Energy: 1.5406011332935001
Energy: 1.3316633015823145
Energy: 1.3326856847028354
Energy: 1.5193176895371123
Energy: 1.3600425984558473
Energy: 1.3835581071446292
Energy: 1.4114607860832677
Energy: 1.3426346534872253
Energy: 1.342371826960205
Energy: 1.412366955996429
Energy: 1.3589263209222098
Energy: 1.3344434731966042
Energy: 1.3685505071402204
Energy: 1.3750712761655268
Energy: 1.3491909438353515
Energy: 1.3675957688869063
Energy: 1.3978388659006644
Energy: 1.3484321588312844
Energy: 1.5060694233871477
Energy: 1.612537789701915
Energy: 1.6125095648388255
Energy: 1.511820029813985
Energy: 1.1669918983212841
Energy: 1.4225772244980703
Energy: 1.299876164978263
Energy: 1.2119340489598824
Energy: 1.189994517948506
Energy: 1.2994965977098878
Energy: 1.3042288913048963
Energy: 1.3105637494575715
Energy: 1.288033994667976
Energy: 1.3494816631063562
Energy: 1.2864042851440671
Energy: 1.2885513936888955
Energy: 1.383990509468146
Energy: 1.2878633963618733
Energy: 1.8187391306407275
Energy: 1.5079447294499462
Energy: 1.5070861035490126
Energy: 1.8140075579313952
Energy: 1.507924214445089
Energy: 1.4896552957238525
Energy: 1.3801750759722142
Energy: 1.397682084762627
Energy: 1.3142966727290444
Energy: 1.37334209384344
Energy: 1.3947586655955657
Energy: 1.3089782261122418
Energy: 1.3516796999604759
Energy: 1.3386934689703485
Energy: 1.31260785016992
Energy: 1.3333130195952532
Energy: 1.3820561015446766
Energy: 1.3307368666383483
Energy: 1.3788856238069576
Energy: 1.535587169932983
Energy: 1.5331886315552576
Energy: 1.3739457980914005
Energy: 1.5330787293010224
Energy: 1.5340739246750346
Energy: 1.474798739004285
Energy: 1.3572012586256768
Energy: 1.3506865942701232
Energy: 1.4486046685833036
Energy: 1.4205383920065053
Energy: 1.3541089591108035
Energy: 1.4063834900584269
Energy: 1.367318661623237
Energy: 1.276600353991946
Energy: 1.4065506156324927
Energy: 1.362468876562042
Energy: 1.3528231709572516
Energy: 1.5913986089996006
Energy: 1.3389865956583815
Energy: 1.2976170176754078
Energy: 1.4257026183101016
Energy: 1.2979624795841813
Energy: 1.364163941083277
Energy: 1.693439122241617
Energy: 1.2158390606499188
Energy: 1.1812702798299035
Energy: 1.6404260272610476
Energy: 1.3436863531327154
Energy: 1.2207426508614843

minimum gb energy = 1.1669918983212841 eV
minimum distance =  2.25344956275581 Angstroms
sigma value = 51


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

Energy: 1.8213100517501537
Energy: 1.5582177902084806
Energy: 1.924709302960321
Energy: 1.5789776892476723
Energy: 1.4605454167471066
Energy: 1.577987283252478
Energy: 1.4774030950848338
Energy: 1.2582009272412977
Energy: 1.2583793212693122
Energy: 1.4861438775609492
Energy: 1.258136616374232
Energy: 1.2587805124755738
Energy: 1.6661025445308995
Energy: 1.3134967316855137
Energy: 1.2807674903625863
Energy: 1.4396839423999042
Energy: 1.3133382206079356
Energy: 1.1725398837765129
Energy: 1.65120529628813
Energy: 1.3531316405163576
Energy: 1.2933557095638406
Energy: 1.5492119391444354
Energy: 1.4615552907030036
Energy: 1.498657688945495
Energy: 1.4765778300786148
Energy: 1.3986059357663487
Energy: 1.3381803058640174
Energy: 1.160340989755396
Energy: 1.3982583643827524
Energy: 1.3604580606612662
Energy: 1.4293833726781162
Energy: 1.3791713049403176
Energy: 1.3420625291476125
Energy: 1.4263921689355417
Energy: 1.3793019349610347
Energy: 1.3674534399062386
Energy: 1.4488752159707576
Energy: 1.3281233077407182
Energy: 1.3824486419498974
Energy: 1.4498667320745138
Energy: 1.3290986611035016
Energy: 1.3972828109244493
Energy: 1.4891960470513566
Energy: 1.340154393562199
Energy: 1.3371483102810582
Energy: 1.4899935593376636
Energy: 1.2356963025942098
Energy: 1.2715075734468413
Energy: 1.3139936205155953
Energy: 1.2050878916315702
Energy: 1.1869827593272932
Energy: 1.314093834998901
Energy: 1.270915602958522
Energy: 1.1729133998535162
Energy: 1.2588749399215833
Energy: 1.1565103093168307
Energy: 1.2072676510807536
Energy: 1.2588800602408536
Energy: 1.1863347926002472
Energy: 1.2585284013440325
Energy: 1.283212573317849
Energy: 1.7535245600164435
Energy: 1.7532501463156203
Energy: 1.2833938815184496
Energy: 1.75402514848383
Energy: 1.7532645353655814
Energy: 1.3363750920669923
Energy: 1.1575282731093974
Energy: 1.2060427221757304
Energy: 1.3365189117825333
Energy: 1.2890861935355453
Energy: 1.20641760369154
Energy: 1.3400738623856496
Energy: 1.2938506622180477
Energy: 1.21974202630905
Energy: 1.3410886930398482
Energy: 1.291551884356954
Energy: 1.3135295177502866
Energy: 1.3427127078335528
Energy: 1.5008671199199832
Energy: 1.5005055891418881
Energy: 1.342632137672429
Energy: 1.5014353577743946
Energy: 1.4998704195659351
Energy: 1.5278107854535072
Energy: 1.3472694870947113
Energy: 1.3295101509079394
Energy: 1.528176284817941
Energy: 1.4354845588863516
Energy: 1.2195158746497843
Energy: 1.479370431605608
Energy: 1.3576203902792123
Energy: 1.3575511385040047
Energy: 1.4796052076062085
Energy: 1.3432922915293977
Energy: 1.4043590313252288
Energy: 1.6105129176792172
Energy: 1.3251536585235928
Energy: 1.3241673130808385
Energy: 1.453531178971649
Energy: 1.3243013268405448
Energy: 1.324490578337236
Energy: 1.6187509675270004
Energy: 1.257955034275989
Energy: 1.2351168778190205
Energy: 1.6214734921400797
Energy: 1.3446417207452726
Energy: 1.1820843493952133

minimum gb energy = 1.1565103093168307 eV
minimum distance =  2.32235732803696 Angstroms
sigma value = 19


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

Energy: 1.4852094400003029
Energy: 1.3506437020224937
Energy: 1.3662664695115947
Energy: 1.4902802438940561
Energy: 1.5530055591620295
Energy: 1.366971042142349
Energy: 1.336731634537318
Energy: 1.213782485085113
Energy: 1.2141082796493743
Energy: 1.2617812007424323
Energy: 1.209361909507614
Energy: 1.2141613880824897
Energy: 1.6406603199569618
Energy: 1.2139437530175134
Energy: 1.2139385247816166
Energy: 1.1848425407860503
Energy: 1.2138947055408942
Energy: 1.2245523871233348
Energy: 1.3299821534239322
Energy: 1.2161285678356033
Energy: 1.3756250887562003
Energy: 1.3293651099413182
Energy: 1.3144946531094943
Energy: 1.375894508312275
Energy: 1.3366531430065594
Energy: 1.2140321290977094
Energy: 1.2139319615614519
Energy: 1.411659227365365
Energy: 1.1844764685372289
Energy: 1.1840587099328823
Energy: 1.3370400087031453
Energy: 1.1761147872315605
Energy: 1.1853033757539178
Energy: 1.337095032558761
Energy: 1.1759677573495073
Energy: 1.2954882242722452
Energy: 1.3874302467034452
Energy: 1.1907488802747874
Energy: 1.1906089430117637
Energy: 1.3396883268973008
Energy: 1.3202189552781216
Energy: 1.1907538874452788
Energy: 1.3139014212319873
Energy: 1.367229482967929
Energy: 1.3670879136177856
Energy: 1.314333007522402
Energy: 1.3672167342786608
Energy: 1.3038228584267282
Energy: 1.2143519823436113
Energy: 1.0098578681766532
Energy: 1.00961721453911
Energy: 1.21418885017601
Energy: 1.0099996007757297
Energy: 1.0974306675476764
Energy: 1.2125070223049705
Energy: 1.2251680861130532
Energy: 1.2245856645848368
Energy: 1.2133873556135368
Energy: 1.2672051497457844
Energy: 1.2245049853329069
Energy: 1.7202938679735895
Energy: 1.2885153621036727
Energy: 1.28840790937969
Energy: 1.7208266771037686
Energy: 1.3339832503686566
Energy: 1.814823564530066
Energy: 1.401453211580789
Energy: 1.3004618674153288
Energy: 1.2997809674898542
Energy: 1.225295354847604
Energy: 1.2250812687226322
Energy: 1.2247074282797257
Energy: 1.1743043948710887
Energy: 1.1854276208476406
Energy: 1.2156503178751323
Energy: 1.174433657330868
Energy: 1.1859929243344414
Energy: 1.2943455617035406
Energy: 1.3375861143221088
Energy: 1.294553636211716
Energy: 1.3180248363861142
Energy: 1.2179272362665587
Energy: 1.294482568302297
Energy: 1.3189001261425402
Energy: 1.488133419499433
Energy: 1.1402839936137816
Energy: 1.1401354891122426
Energy: 1.4868180756165843
Energy: 1.140721334258563
Energy: 1.0976303440893544
Energy: 1.4866524028076458
Energy: 1.2160126085211456
Energy: 1.3039025520015766
Energy: 1.4881951442497765
Energy: 1.2158070773703111
Energy: 1.3669906093653168
Energy: 1.6413869348059884
Energy: 1.2091990442484863
Energy: 1.2141552840100183
Energy: 1.3372632808881875
Energy: 1.2094312561776728
Energy: 1.2141495710197179
Energy: 1.3484952514628021
Energy: 1.2139107909973508
Energy: 1.2139645568609878
Energy: 1.349255392054887
Energy: 1.2139511783750803
Energy: 1.1411290540783459
Energy: 1.3293234128658844
Energy: 1.2142700095747179
Energy: 1.1402888098504602
Energy: 1.3293567251499134
Energy: 1.2138372167283067
Energy: 1.3011188707410384
Energy: 1.3373771971326922
Energy: 1.1749547791214383
Energy: 1.29482428919989
Energy: 1.3368546533994028
Energy: 1.174684924818367
Energy: 1.184598836050959
Energy: 1.3346012295237444
Energy: 1.2183885978813287
Energy: 1.295272287054204
Energy: 1.3371191956075994
Energy: 1.1853921754978127
Energy: 1.293824753991036
Energy: 1.338297739372765
Energy: 1.268485571314594
Energy: 1.190747445567244
Energy: 1.3379696477845306
Energy: 1.1413591757101489
Energy: 1.193737527681631
Energy: 1.136016095577125
Energy: 1.3663564858280235
Energy: 1.3663402934708129
Energy: 1.1347523836199866
Energy: 1.3665344076412274
Energy: 1.3658348355480319
Energy: 1.2104690668175728
Energy: 1.1402643444048288
Energy: 1.2144081958440391
Energy: 1.2096869948336617
Energy: 1.009793482068832
Energy: 1.2140695272307283
Energy: 1.2136959937399994
Energy: 1.300673671477401
Energy: 1.2249198270610075
Energy: 1.2138103959915085
Energy: 1.2263658018223085
Energy: 1.2144914491754992
Energy: 1.3141870612777078
Energy: 1.2889577064389992
Energy: 1.288782760449897
Energy: 1.314201932186937
Energy: 1.3297695364355266
Energy: 1.3757593341075571
Energy: 1.3394096920222844
Energy: 1.2672167722667387
Energy: 1.259419932682635
Energy: 1.1844344280378183
Energy: 1.1841367167894086
Energy: 1.213785430327494
Energy: 1.1750104386432487
Energy: 1.29498109635021
Energy: 1.1852549226683051
Energy: 1.17501165366353
Energy: 1.295209686544404
Energy: 1.1843628116780451
Energy: 1.3374470802137486
Energy: 1.1848258653292767
Energy: 1.1934182322604896
Energy: 1.2057205453350184
Energy: 1.295093131965568
Energy: 1.191780675973962
Energy: 1.4865615262728016
Energy: 1.3757283493912844
Energy: 1.3064571732237913
Energy: 1.4875099506446756
Energy: 1.3139046274598292
Energy: 1.367231789968015

minimum gb energy = 1.00961721453911 eV
minimum distance =  2.24699032027526 Angstroms
sigma value = 27


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

Energy: 1.2704821517678355
Energy: 1.2998175445679447
Energy: 1.7616306010783498
Energy: 1.274345211269634
Energy: 1.1425096561963155
Energy: 1.7610447274874097
Energy: 1.3132472988270514
Energy: 1.157629847582526
Energy: 1.1577859140712798
Energy: 1.2421684752079973
Energy: 1.1574130551604782
Energy: 1.1578845630581145
Energy: 1.1882206170053131
Energy: 1.1421467653692274
Energy: 1.1396171182411938
Energy: 1.1011198103548427
Energy: 1.1413320645738034
Energy: 1.1394491576528716
Energy: 1.6907639769431342
Energy: 1.0661756773200797
Energy: 1.1690727589898393
Energy: 1.1004980656343075
Energy: 1.4470912761401877
Energy: 1.3509320772023055
Energy: 1.4000724795836803
Energy: 1.2300687633479064
Energy: 1.279063740004559
Energy: 1.18925360076117
Energy: 1.2305942230067364
Energy: 1.1138448514868418
Energy: 1.1411145761908494
Energy: 1.2383010953399238
Energy: 1.2383932926305221
Energy: 1.141214332074595
Energy: 1.2383448835855557
Energy: 1.0247496251355852
Energy: 1.201825806727418
Energy: 0.9975212361032826
Energy: 1.069461353740605
Energy: 1.141842350101678
Energy: 1.1092335844901757
Energy: 1.1425907215540114
Energy: 1.174822911772898
Energy: 1.5058857762650362
Energy: 1.5056070744176187
Energy: 1.1585359466234704
Energy: 1.505555283125006
Energy: 1.4354065047619229
Energy: 1.380039600913807
Energy: 1.3272322829809369
Energy: 1.0844890060768115
Energy: 1.1579452061165452
Energy: 1.0932795561818276
Energy: 1.0815366761758174
Energy: 1.1018761667536263
Energy: 1.1223218204729375
Energy: 1.0799811061094184
Energy: 1.1758013524516713
Energy: 1.1794294518756099
Energy: 1.1756006338231249
Energy: 1.187208832334882
Energy: 1.1737465008219727
Energy: 1.1750330883249926
Energy: 1.1795467761781686
Energy: 1.1723457031001185
Energy: 1.1746551196812391
Energy: 1.1007284329686047
Energy: 1.1976518814845565
Energy: 1.1555467338225407
Energy: 1.2446461714759285
Energy: 1.1974855365935173
Energy: 1.155793901373063

minimum gb energy = 0.9975212361032826 eV
minimum distance =  2.31413032811532 Angstroms
sigma value = 9


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

Energy: 1.9501268252104405
Energy: 2.424488308184064
Energy: 1.510584975886282
Energy: 1.6579375228101514
Energy: 1.8739668516228418
Energy: 1.6601175955160765
Energy: 1.0424875740431612
Energy: 1.0298926906666266
Energy: 1.0297735778404753
Energy: 1.0494381183313484
Energy: 1.0297060948482601
Energy: 1.0300105012232337
Energy: 0.9836928537678904
Energy: 0.9613601801262208
Energy: 0.9616545013420551
Energy: 0.9241095453626617
Energy: 0.9609137833236644
Energy: 0.962062764782288
Energy: 1.2720864912248275
Energy: 0.9648488202839856
Energy: 1.0448622459197257
Energy: 0.9330405010291165
Energy: 1.149885766940308
Energy: 1.1457582320039656
Energy: 1.1323780225203206
Energy: 1.262332400097523
Energy: 0.925767086561558
Energy: 1.1325193950157124
Energy: 1.1493745726723932
Energy: 0.9992178714976243
Energy: 0.9773663475460169
Energy: 1.3195913334148328
Energy: 0.9422858276961464
Energy: 0.9772190722657065
Energy: 1.3415275393093047
Energy: 0.9952916673515141
Energy: 1.016955941772519
Energy: 0.9566964458491141
Energy: 1.0712650419108818
Energy: 1.0180199354369261
Energy: 0.9747547446826348
Energy: 1.016950742158285
Energy: 0.9354364525226788
Energy: 1.1872850239050399
Energy: 0.9502679585100813
Energy: 0.935534892543472
Energy: 1.1834380974147973
Energy: 0.9350663044440809
Energy: 0.9376378294440425
Energy: 1.1229208705232168
Energy: 1.1711521379179937
Energy: 0.937761530194954
Energy: 1.0813581764901306
Energy: 0.9516471551250067
Energy: 1.5073322889572756
Energy: 1.0885543385648793
Energy: 0.9316145869248228
Energy: 0.8331327181606393
Energy: 1.1097685829961528
Energy: 1.2729098546325832
Energy: 0.9316987899709503
Energy: 0.9623003783202354
Energy: 0.9608962370169772
Energy: 0.8331491655772214
Energy: 0.9770180419047666
Energy: 0.9779008686122748
Energy: 0.9351006107581331
Energy: 1.0047385621111777
Energy: 1.002372558441542
Energy: 1.086874218953052
Energy: 1.0033232849424005
Energy: 1.00180649994409
Energy: 1.7149036343963402
Energy: 1.519967286632479
Energy: 1.4294038921353815
Energy: 1.5018503239448855
Energy: 1.5204655167672878
Energy: 1.5013167683495101
Energy: 1.081740036287565
Energy: 1.0749367499349032
Energy: 0.9849379826974584
Energy: 1.0497775012076307
Energy: 1.0759850117120329
Energy: 1.1196231541083623
Energy: 1.0612082746144265
Energy: 1.020895435901643
Energy: 1.0189116303618655
Energy: 1.0615834260921317
Energy: 1.0192865240538453
Energy: 1.186586573718546
Energy: 0.9873758300425629
Energy: 0.9804456131550249
Energy: 1.030236817441977
Energy: 0.989764845951776
Energy: 0.9797449043863153
Energy: 0.987170954135054
Energy: 0.9880202481381087
Energy: 1.261523114598787
Energy: 0.9958584480136502
Energy: 0.9876418383200088
Energy: 1.2170337733436516
Energy: 0.9868997616003706
Energy: 0.9860380194100733
Energy: 1.243022336113924
Energy: 0.9761409654103098
Energy: 0.9858283929394384
Energy: 1.2335500723506594
Energy: 0.9781291991543879
Energy: 0.9816619457580696
Energy: 0.9260594107041733
Energy: 1.0329645010618411
Energy: 1.01756824402683
Energy: 0.9387569825823502
Energy: 1.0764311900541574
Energy: 0.9822016871650859
Energy: 0.9797154095689569
Energy: 0.9799629083376069
Energy: 0.9796162711732086
Energy: 0.9803215947022955
Energy: 0.980190276374295
Energy: 0.9816826566380844
Energy: 1.0168772121781622
Energy: 1.0170062873307513
Energy: 0.9754758488273781
Energy: 1.0164543598583946
Energy: 1.0109176933793134
Energy: 1.008194160951797
Energy: 1.030393332029607
Energy: 1.0308188238868414
Energy: 1.2760545584866503
Energy: 1.1711454838647388
Energy: 1.1156361955591119
Energy: 1.0018451567080031
Energy: 1.0296392704124562
Energy: 1.0298701828967427
Energy: 1.1399658464539832
Energy: 1.0294310161804936
Energy: 1.0347113420217362
Energy: 0.9831194399799668
Energy: 0.9618818729700246
Energy: 0.9621865117706939
Energy: 0.9722350845226487
Energy: 0.961385129400624
Energy: 0.9625397799143293
Energy: 1.2550099299275184
Energy: 0.9666625657139488
Energy: 1.1762588652306016
Energy: 1.1852244439159967
Energy: 0.9664563816472284
Energy: 1.186980121496296
Energy: 1.132102396350288
Energy: 0.9463143680453551
Energy: 0.945163107698398
Energy: 0.9972095491248167
Energy: 0.9743942531274901
Energy: 1.0437785706120923
Energy: 1.2851149057087403
Energy: 1.345201594903417
Energy: 1.3410715360367496
Energy: 1.2854204335866888
Energy: 1.3409767562239712
Energy: 1.659835992253798
Energy: 1.0028110271221504
Energy: 1.014430014358241
Energy: 1.132952312831759
Energy: 1.0032865526661254
Energy: 0.9981252638563276
Energy: 1.0018271240368293
Energy: 0.9687582271412988
Energy: 1.0688687832593362
Energy: 0.9523428550455441
Energy: 0.9692778600787018
Energy: 1.0621830345952405
Energy: 0.9385417518680709
Energy: 0.9383754695120553
Energy: 1.1745045029830488
Energy: 0.8930617349200505
Energy: 0.9352021012291838
Energy: 1.1733727086837165
Energy: 0.9319109760823806
Energy: 0.9315453677545846
Energy: 0.9835423361861951
Energy: 0.983278250677948
Energy: 0.8330450378301626
Energy: 0.99240809518605
Energy: 1.2446647029490907
Energy: 1.5066631259939687
Energy: 0.9355346109722202
Energy: 0.9346120784375243
Energy: 0.8331991734820081
Energy: 0.9344907151442107
Energy: 1.273929964779595
Energy: 0.9726491065896764
Energy: 1.014828802063848
Energy: 1.0148965957065688
Energy: 0.9707976853467581
Energy: 1.015086033539546
Energy: 1.014845848708089
Energy: 1.2563025715987648
Energy: 0.9776233589790754
Energy: 0.9783943448129581
Energy: 1.0738346381662538
Energy: 0.9773949767186508
Energy: 1.0576748878597866
Energy: 0.9692040003370258
Energy: 0.9967684581543248
Energy: 0.9967282064335782
Energy: 0.9168940051094391
Energy: 0.9967440016404006
Energy: 1.0061905395787594
Energy: 0.9691545727694827
Energy: 1.0105758033731875
Energy: 0.9310221225901208
Energy: 0.9689983288054397
Energy: 1.0102174837129485
Energy: 1.043153594739693
Energy: 0.9606139721100236
Energy: 0.9230943223735039
Energy: 0.9153736179997127
Energy: 0.9622458433266255
Energy: 0.9254662797820566
Energy: 0.9620338240242836
Energy: 1.030047319676214
Energy: 0.9710569154919689
Energy: 1.1668642970904233
Energy: 1.0297340861187476
Energy: 0.98124969016125
Energy: 0.9875211691796809
Energy: 2.1434661254083354
Energy: 1.5000300305188303
Energy: 1.5011723166919764
Energy: 2.142695191975867
Energy: 1.4996495352135515
Energy: 1.8041036306713847
Energy: 1.1700579218558653
Energy: 0.9712944015059253
Energy: 1.0408480882204139
Energy: 1.0293072288844956
Energy: 1.0226331093033436
Energy: 1.0761008664964402
Energy: 0.9808195158727405
Energy: 0.972582896777479
Energy: 0.9303335910847428
Energy: 0.9765354597826907
Energy: 0.972390909875791
Energy: 0.9784870339000465
Energy: 0.981383554502306
Energy: 0.979606906635186
Energy: 0.9799931134761882
Energy: 0.9710437160649907
Energy: 0.9800609404688897
Energy: 0.9798401306258097
Energy: 1.0017965501802113
Energy: 1.0301463852443862
Energy: 1.0301335369188191
Energy: 1.1296986932689494
Energy: 1.0302757509144833
Energy: 1.0327926477594747

minimum gb energy = 0.8330450378301626 eV
minimum distance =  2.29364877010711 Angstroms
sigma value = 57


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

Energy: 0.509688277628938
Energy: 1.125235766353737
Energy: 0.5108009307694605
Energy: 0.3891577800665056
Energy: 0.8750443729699569
Energy: 0.5105871767422632
Energy: 0.7346917568253885
Energy: 0.8401800897446879
Energy: 0.732616484915883
Energy: 0.6485073876820993
Energy: 0.6525056342118115
Energy: 0.6900236038616221
Energy: 0.7376231837098423
Energy: 0.6861346554056158
Energy: 0.6858597334662206
Energy: 0.7571796460353104
Energy: 0.6858866617094244
Energy: 0.6859308832907131
Energy: 0.7676188787004614
Energy: 0.675456699627807
Energy: 0.680249402228677
Energy: 0.6860274159120376
Energy: 0.7671499336634621
Energy: 0.6751530321106008
Energy: 0.738808701051794
Energy: 0.3862592743129408
Energy: 0.515797712539957
Energy: 0.7516679991095713
Energy: 0.38597056473634955
Energy: 0.674186416609295
Energy: 0.6798809971114549
Energy: 0.38594657013674033
Energy: 0.3862511728962802
Energy: 0.6790101937525928
Energy: 0.38582604361991385
Energy: 0.43500413018800604
Energy: 0.6746758386339592
Energy: 0.629363086233794
Energy: 0.6894714662315159
Energy: 0.6751422704520715
Energy: 0.6682183991781017
Energy: 0.6901189637407507
Energy: 0.6799672854328727
Energy: 0.7565808429281695
Energy: 0.7563320588223105
Energy: 0.6798286740248831
Energy: 0.7563600874712746
Energy: 0.679816513399493
Energy: 0.7434354787374495
Energy: 0.7516210089438582
Energy: 0.6686749603014553
Energy: 0.6693363364223537
Energy: 0.6772289205001253
Energy: 0.6690551761716111
Energy: 0.38560576004705205
Energy: 0.6666408974454693
Energy: 0.4371501025317642
Energy: 0.38575905027413165
Energy: 0.7605351725121596
Energy: 0.5027296278796213
Energy: 0.38573542431938407
Energy: 0.6274651759606966
Energy: 0.6325547682256527
Energy: 0.38593167519549726
Energy: 0.6802228218087636
Energy: 0.4354591151492407
Energy: 0.7466417950448022
Energy: 0.6779918321695407
Energy: 0.6917029542981799
Energy: 0.7460071182992272
Energy: 0.678015670057582
Energy: 0.6920505558973871
Energy: 1.729731719403909
Energy: 1.404296233481002
Energy: 1.4461928339800454
Energy: 1.4461389006634127
Energy: 1.4069495720422607
Energy: 1.4427780190738744
Energy: 0.7425118006696935
Energy: 0.668000537109456
Energy: 0.6677495798954589
Energy: 0.7433873517966859
Energy: 0.6681929218217794
Energy: 0.6690187914368503
Energy: 0.7459046695093655
Energy: 0.38575168050529973
Energy: 0.38564489930370793
Energy: 0.7658275905322448
Energy: 0.3857705685568178
Energy: 0.3862833215582026
Energy: 0.6751394988056343
Energy: 0.673249977828264
Energy: 0.6985004355664971
Energy: 0.6856827136731938
Energy: 0.3861329175951227
Energy: 0.696294801094775
Energy: 0.6901581950870286
Energy: 0.6756960294802121
Energy: 0.7033392768736897
Energy: 0.6871388039100543
Energy: 0.6875664561572715
Energy: 0.680618277086342
Energy: 0.7369341200899716
Energy: 0.7608657978877337
Energy: 0.7585688830208341
Energy: 0.7564585106226726
Energy: 0.7587631763597852
Energy: 0.673470804919436
Energy: 0.5104117397515697
Energy: 0.902252224707249
Energy: 0.8020122069854242
Energy: 0.38590434647750455
Energy: 0.8480689516537415
Energy: 0.6723615543818686

minimum gb energy = 0.38560576004705205 eV
minimum distance =  2.35689169531909 Angstroms
sigma value = 11


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

Energy: 1.585299083568157
Energy: 2.236736399725537
Energy: 1.0909117082622917
Energy: 1.4681496810631867
Energy: 2.239573301859655
Energy: 1.0911514705804093
Energy: 0.767243828338337
Energy: 0.7664985846019539
Energy: 0.7952145043285614
Energy: 0.8272228766431301
Energy: 0.7685386672524194
Energy: 0.8821371528976437
Energy: 0.7723444697793295
Energy: 0.770226415415559
Energy: 0.7725086227718433
Energy: 0.7734514824264994
Energy: 0.7680470597703455
Energy: 0.77269380192985
Energy: 0.7718490132308031
Energy: 0.898301956052304
Energy: 0.9171516700803161
Energy: 0.7728003554694777
Energy: 0.7700922081627926
Energy: 0.7679446271733046
Energy: 0.7669511636657445
Energy: 0.9086007785555597
Energy: 0.87749409678797
Energy: 0.7673585923048958
Energy: 0.8967573759722931
Energy: 0.8273433380621668
Energy: 1.0637706166145418
Energy: 1.219169107628753
Energy: 1.2188834274915232
Energy: 1.0639099799519198
Energy: 1.494090392550398
Energy: 0.7701838006399719
Energy: 1.0561423522987876
Energy: 0.7688545084781646
Energy: 0.919837313184302
Energy: 0.7680790429011574
Energy: 0.8283274968018851
Energy: 0.8720462438481879
Energy: 0.7960866650900419
Energy: 0.8631159078973615
Energy: 0.8642237360071529
Energy: 0.7970617041774773
Energy: 0.8625298003463961
Energy: 1.063149718979152
Energy: 1.0639225286700336
Energy: 0.7709091263095188
Energy: 0.7679883830994372
Energy: 0.7685509639361083
Energy: 0.7691180949413706
Energy: 0.9381104783491802
Energy: 1.354959258063444
Energy: 0.7715710614650084
Energy: 0.7708330616845585
Energy: 1.3166548342045004
Energy: 0.771709939824719
Energy: 0.8946963966672601
Energy: 1.1933880309225446
Energy: 0.7708297165391469
Energy: 0.878489778274916
Energy: 1.1096623045167668
Energy: 1.356708357726667
Energy: 0.8453809174476472
Energy: 1.0630512467600246
Energy: 0.7434272752009357
Energy: 0.8265307043319602
Energy: 1.0643009178107177
Energy: 0.7429501075197553
Energy: 0.9201402205953498
Energy: 0.9867919578199718
Energy: 0.7390398776108498
Energy: 0.9655700900325593
Energy: 0.9872496593063044
Energy: 0.7446903925984163
Energy: 0.9881675179513916
Energy: 0.9801318365809661
Energy: 0.823954889776618
Energy: 0.9391120600319233
Energy: 0.8945329617628005
Energy: 0.9837537063351142
Energy: 0.8937124898379706
Energy: 0.8943644581683636
Energy: 1.3155132718051492
Energy: 1.3258088469830625
Energy: 0.8944754721310912
Energy: 1.328895695460598
Energy: 0.8944583992093803
Energy: 1.3870377450675835
Energy: 0.8947960713399171
Energy: 0.8005744416886736
Energy: 1.3892098714498005
Energy: 1.0060130393346045
Energy: 0.9124225792011218
Energy: 1.198743439305518
Energy: 1.2645923862868318
Energy: 1.4090179429696224
Energy: 1.1770922460034
Energy: 1.325923674063877
Energy: 0.9912613234927257
Energy: 1.1674616610289874
Energy: 0.8951695084200134
Energy: 0.8949665516390384
Energy: 1.2269294117340912
Energy: 0.8954596548396095
Energy: 0.9711929160611988
Energy: 1.1064563356528152
Energy: 0.9755719513735075
Energy: 0.8938448895309546
Energy: 0.9836644445118256
Energy: 0.9748855368053303
Energy: 0.9546587541628541
Energy: 1.0287860031588822
Energy: 1.127154926930851
Energy: 1.3105081649224573
Energy: 0.9955628442800896
Energy: 1.126508165352196
Energy: 1.29944838923208
Energy: 1.3887352830347588
Energy: 0.8948530624367734
Energy: 0.8485803935756773
Energy: 1.3887254842373704
Energy: 0.9906922754954259
Energy: 0.8018608479409814
Energy: 0.7681860243769356
Energy: 1.4817866849378503
Energy: 1.4514351871226305
Energy: 0.7677539652610489
Energy: 1.4905600602132483
Energy: 1.2872914374825735
Energy: 0.7711515943661897
Energy: 0.8010459498463635
Energy: 0.949440173464638
Energy: 0.7709649698499702
Energy: 1.01125863366131
Energy: 0.8023145296142675
Energy: 0.8584977850045812
Energy: 0.7671831440202743
Energy: 0.9459628771576769
Energy: 0.859665743427067
Energy: 0.7756028912854074
Energy: 0.8579694805908519
Energy: 0.7673907729590749
Energy: 0.7679932111046499
Energy: 0.7676973272453642
Energy: 0.7686157976137651
Energy: 0.7724357554614778
Energy: 0.9812161370469175
Energy: 1.4810945889384624
Energy: 0.7674760481696632
Energy: 0.8278516539579062
Energy: 0.9938726196132533
Energy: 1.0657910141434246
Energy: 0.8051602509499857

minimum gb energy = 0.7390398776108498 eV
minimum distance =  2.32424956700392 Angstroms
sigma value = 41


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

Energy: 1.6037721255422224
Energy: 0.9440052546906488
Energy: 1.577111754070062
Energy: 1.211421023003842
Energy: 1.606310201520496
Energy: 1.2176321703523074
Energy: 0.8640699651272776
Energy: 0.8641622095252531
Energy: 0.8968061478134338
Energy: 0.9325917155889024
Energy: 0.864150251389693
Energy: 0.8970710529277697
Energy: 0.8698992286537487
Energy: 0.8697824030605901
Energy: 0.8684969359325928
Energy: 0.8652834360146856
Energy: 0.8647724886251082
Energy: 0.9434172812245255
Energy: 0.8650058965785943
Energy: 0.9878050450466452
Energy: 1.0522810314796942
Energy: 0.8700222969885956
Energy: 0.8676381714850565
Energy: 0.8674864933376415
Energy: 0.8644738536558014
Energy: 0.9815251708718324
Energy: 0.9942626444975785
Energy: 0.8643970651041819
Energy: 0.947001550969031
Energy: 0.9059052527298861
Energy: 1.3787523486185127
Energy: 1.5120526464323079
Energy: 1.017983513287259
Energy: 1.378726345041808
Energy: 1.556530231227773
Energy: 1.5052173496921402
Energy: 0.9792768116579185
Energy: 0.8992439751319826
Energy: 1.0559893076305844
Energy: 0.8659486728887137
Energy: 0.911283338887663
Energy: 0.9043903210991963
Energy: 0.9126852590156834
Energy: 1.0181275604749198
Energy: 1.0191154203171875
Energy: 0.9136570815307873
Energy: 1.0184810089740834
Energy: 1.0656400050391865
Energy: 1.2507757631711833
Energy: 0.9471523618102035
Energy: 0.9489799968003829
Energy: 0.8647792021515742
Energy: 0.9470801102346154
Energy: 0.9539407719931663
Energy: 1.1930330853337232
Energy: 1.0013876080637691
Energy: 1.0012394495567
Energy: 1.2000538394156037
Energy: 1.0009452724493748
Energy: 0.8705811684187217
Energy: 1.2707785067496828
Energy: 0.9356587255785604
Energy: 0.9359198940273343
Energy: 0.8716766336744853
Energy: 1.25142770451128
Energy: 0.9934263963770681
Energy: 1.251515226754334
Energy: 0.8561868482960083
Energy: 0.9441385573011891
Energy: 1.251456204885109
Energy: 0.8226067594648564
Energy: 0.9689233488046365
Energy: 1.0009313883637823
Energy: 0.9444698198498451
Energy: 1.1696474543983078
Energy: 1.0010108410458523
Energy: 0.8226624280003115
Energy: 1.1693320127313294
Energy: 0.9498253059913035
Energy: 0.9696662583509938
Energy: 1.0514616347092995
Energy: 0.9472595435680543
Energy: 0.8961223836762937
Energy: 0.9496823714323723
Energy: 1.0164325376397838
Energy: 1.1478558999445194
Energy: 1.1580251073043022
Energy: 1.0166116059970196
Energy: 1.1965968554994808
Energy: 1.0165720649952257
Energy: 0.8642753023624462
Energy: 0.8651881988175313
Energy: 0.9543704864863195
Energy: 0.8642748031952484
Energy: 0.8650831319745927
Energy: 1.044398270889404
Energy: 1.4778539986665296
Energy: 1.2841665737095702
Energy: 0.8179380706939311
Energy: 1.448102472484485
Energy: 1.2846912268371098
Energy: 1.2029883235452783
Energy: 1.536502882860732
Energy: 0.8645019645569771
Energy: 0.8958539765259456
Energy: 1.4542998757049665
Energy: 0.8643195394662978
Energy: 0.8559671247103611
Energy: 0.8656265520701406
Energy: 0.8679674592117265
Energy: 0.8651028180826046
Energy: 0.865712654805468
Energy: 0.868080451292065
Energy: 0.9557751870710941
Energy: 0.8647572490599752
Energy: 0.8668169238144845
Energy: 0.9567577693440479
Energy: 0.8649759952466552
Energy: 0.8672071969066143
Energy: 0.8670160499281472
Energy: 0.8643434013999663
Energy: 0.9542152110868662
Energy: 0.9953497129999049
Energy: 0.86437868305537
Energy: 0.9470893758190007
Energy: 0.9044358443098001
Energy: 1.4998368506000002
Energy: 1.421521254163228
Energy: 1.3864849299439301
Energy: 1.4258495479626978
Energy: 1.5569693774067115
Energy: 1.3877169934204312
Energy: 1.250579939710341
Energy: 0.9473487877344335
Energy: 1.056890794233917
Energy: 0.8645510979495488
Energy: 0.9873419779519464
Energy: 0.9043624445470131
Energy: 0.9139351457439086
Energy: 1.0304373979242165
Energy: 1.0133974146676439
Energy: 0.9091179214599584
Energy: 1.0307108823205176
Energy: 1.0662970901151776
Energy: 0.9794832044260967
Energy: 0.8712328173205464
Energy: 0.9113478600971635
Energy: 0.8670809895714282
Energy: 0.947682784716422
Energy: 0.9365211155346469
Energy: 1.2691170945383763
Energy: 0.870308836355332
Energy: 0.9355184852892302
Energy: 0.8718871675273336
Energy: 0.9476555319747364
Energy: 0.9533207737861469
Energy: 1.1931421613425652
Energy: 0.8704249590493089
Energy: 0.8704106397875768
Energy: 1.2010232950157265
Energy: 1.251982745774204
Energy: 0.9358078191414574
Energy: 1.2513562110765417
Energy: 0.8549959344789853
Energy: 0.9539388610835333
Energy: 1.2513696790557114
Energy: 0.8250592139875522
Energy: 0.9814955205880822
Energy: 1.0009635897294336
Energy: 1.2411825537150878
Energy: 1.1849921330477138
Energy: 1.0009388628066522
Energy: 1.4511524673072824
Energy: 1.18496452260253
Energy: 0.9460997339534333
Energy: 1.0168407292748918
Energy: 0.9915024209976221
Energy: 0.9462254861452457
Energy: 0.9763930735470616
Energy: 0.9871213166738665
Energy: 1.0020809805080741
Energy: 1.1344785466415823
Energy: 1.0022277156275325
Energy: 1.001917997261939
Energy: 1.199266091164698
Energy: 1.002576313116944
Energy: 0.8653165129153576
Energy: 0.8678182220051088
Energy: 0.867184885911404
Energy: 0.8651505112501875
Energy: 0.8679356957308257
Energy: 1.0445740821719087
Energy: 1.4776691369096402
Energy: 0.8644155576921249
Energy: 0.8177332041135918
Energy: 1.4478153888132426
Energy: 1.2512560143997042
Energy: 0.8655965209527142

minimum gb energy = 0.8177332041135918 eV
minimum distance =  2.28494742075645 Angstroms
sigma value = 33


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

Energy: 1.18935962077471
Energy: 2.1071024119013857
Energy: 1.4718903278359186
Energy: 1.1924410361086482
Energy: 2.1067504514750164
Energy: 1.4730765073400716
Energy: 0.9690369559217842
Energy: 0.9698766737959151
Energy: 0.9834818105598875
Energy: 1.0236809314605224
Energy: 0.9695345625829587
Energy: 0.940832689716413
Energy: 0.9709610444156094
Energy: 0.9708836954064461
Energy: 0.97082876564351
Energy: 0.971108020307246
Energy: 0.9697938470518818
Energy: 0.9718360484483999
Energy: 0.9700401009836606
Energy: 0.9806877804713092
Energy: 0.9712929425569952
Energy: 0.9701509424753019
Energy: 0.9691090876833838
Energy: 0.9701262531940069
Energy: 0.9685976073975313
Energy: 0.9391674085116541
Energy: 1.0216444289241773
Energy: 0.9690194360431835
Energy: 1.0361964191761688
Energy: 1.0871803653419931
Energy: 1.0733640466270173
Energy: 1.0388734848625758
Energy: 1.2943240602556274
Energy: 1.073343036525175
Energy: 1.2942085462594828
Energy: 1.294852200719614
Energy: 1.1267023255410655
Energy: 0.9051745537163013
Energy: 1.0239707561237248
Energy: 0.9717683836233801
Energy: 0.945026263267187
Energy: 1.0869783547403087
Energy: 1.0289268289110354
Energy: 0.9069650062018433
Energy: 0.9975573212198372
Energy: 1.028711469577218
Energy: 1.212637024256816
Energy: 1.0537402943394711
Energy: 1.032977682674985
Energy: 0.9058838421430586
Energy: 0.9050026615045964
Energy: 1.0146491462502896
Energy: 0.9049743996514927
Energy: 1.0216945675178914
Energy: 1.126052986278184
Energy: 1.2024095755002109
Energy: 1.2030485893975966
Energy: 0.9696427791894375
Energy: 1.2014917874532904
Energy: 0.9048868300550427
Energy: 1.1270366673669425
Energy: 1.0957339643725488
Energy: 1.027689295924155
Energy: 0.9718766411407027
Energy: 0.9694273309603217
Energy: 1.024606491897665
Energy: 1.0340705384844202
Energy: 0.9146997667055845
Energy: 1.114512837170076
Energy: 1.033430215709146
Energy: 0.9708270370811873
Energy: 1.1160518462634363
Energy: 0.9725134731296058
Energy: 1.024288395594605
Energy: 0.940313037581265
Energy: 0.9724682220162075
Energy: 0.9202272880382077
Energy: 1.3286514930554858
Energy: 0.970340673120439
Energy: 1.0227190331288114
Energy: 0.9426812548099698
Energy: 0.9704621033218049
Energy: 1.0082016275069505
Energy: 0.9766015091680202
Energy: 0.9103442010291928
Energy: 0.9700824642590945
Energy: 0.9717458290015915
Energy: 0.968128252678021
Energy: 0.9689132272458351
Energy: 0.9411790313865543
Energy: 0.9697366564830294
Energy: 0.9676787546299173
Energy: 0.9686463497081091
Energy: 0.9887797209727096
Energy: 0.9709976243313564
Energy: 0.9696214455616466
Energy: 1.4231161944583257
Energy: 1.1595123775050387
Energy: 1.2026726771256708
Energy: 1.2955221415115374
Energy: 1.0133502053170524
Energy: 1.1831977287365332
Energy: 1.031885665446252
Energy: 1.0116944587131411
Energy: 1.085356973265723
Energy: 1.0314552331856768
Energy: 1.1177737593627572
Energy: 1.020857639024278
Energy: 0.9699104117934878
Energy: 1.0329802473393785
Energy: 1.0262232939818878
Energy: 0.9699034318662754
Energy: 1.0298865709047973
Energy: 1.0874616626276092
Energy: 1.062115259903085
Energy: 1.032710298680191
Energy: 1.0020466424748322
Energy: 0.904371299936124
Energy: 1.030157813336864
Energy: 1.0304574994635036
Energy: 0.9059664446382686
Energy: 1.1179672790739916
Energy: 1.0203155210393182
Energy: 0.9062492151760322
Energy: 0.9896181191872998
Energy: 0.9043598492149122
Energy: 1.200652755063915
Energy: 1.0038214491259856
Energy: 0.9081236812703637
Energy: 1.201292652024431
Energy: 1.2837841802346226
Energy: 1.1937078451605143
Energy: 0.9679633438559317
Energy: 0.9702113484478132
Energy: 1.024291613852674
Energy: 0.9441025304413695
Energy: 0.9700744540778056
Energy: 1.0191941572547685
Energy: 1.042133142269015
Energy: 1.5816382691930209
Energy: 1.4748252894866216
Energy: 1.47164673234235
Energy: 1.5815831143506003
Energy: 1.4667062497563168
Energy: 1.1276282323543687
Energy: 0.9696761774696323
Energy: 0.9424162964330057
Energy: 0.9379469170224617
Energy: 0.9694461732603465
Energy: 0.9407320888866053
Energy: 0.9702938038949946
Energy: 0.9712339585802106
Energy: 0.9704671444543783
Energy: 0.9706562626173143
Energy: 0.9703294148210002
Energy: 0.9430925957249732
Energy: 0.970628660429421
Energy: 0.9444157054019724
Energy: 0.9532029122258756
Energy: 0.9712296304776482
Energy: 0.9708822459459316
Energy: 0.9705716320445441
Energy: 0.9678635644839547
Energy: 0.905482909649888
Energy: 1.0202727361865593
Energy: 0.9681273708895953
Energy: 1.0085454792828832
Energy: 0.9690013613889151
Energy: 1.3062785326084836
Energy: 1.2922478644055058
Energy: 1.0400284343255755
Energy: 1.2983898299477254
Energy: 1.2927138387950232
Energy: 1.1818600043828136
Energy: 1.0307406113294322
Energy: 0.904991132156641
Energy: 1.0209984468696691
Energy: 0.9699388017739685
Energy: 0.947006541538986
Energy: 1.0855458125961053
Energy: 1.029468130068389
Energy: 1.2027903580690689
Energy: 0.9351869059584564
Energy: 1.0287121400812191
Energy: 1.2022764139818274
Energy: 1.0406724883429779
Energy: 1.0296485397203272
Energy: 0.90566189023859
Energy: 0.905520617570824
Energy: 0.9715977664740809
Energy: 0.9050425860768492
Energy: 1.0227828076856316
Energy: 1.1279111364788872
Energy: 0.9039811077272779
Energy: 0.9055593489559798
Energy: 0.9701483747650556
Energy: 0.9041087668167159
Energy: 1.0564265371676433
Energy: 1.1278929643271838
Energy: 0.9456898030279601
Energy: 1.0561274411598183
Energy: 0.9707430497671395
Energy: 1.1902008955623042
Energy: 1.0871327699384488
Energy: 1.0307660376876993
Energy: 1.0474225574452039
Energy: 1.1125765254250222
Energy: 1.0306589059116342
Energy: 0.9701378381228879
Energy: 1.0203611515149194
Energy: 1.2547048379437256
Energy: 1.4522645989404253
Energy: 1.4691763976373335
Energy: 1.2556815295569053
Energy: 1.4524358229140708
Energy: 1.4662481316093492
Energy: 0.9696027225944153
Energy: 1.0214948142861353
Energy: 0.9426258115818915
Energy: 0.970258142385022
Energy: 1.025619083319024
Energy: 0.9773032730613932
Energy: 0.943312391567207
Energy: 0.9695870262761954
Energy: 0.9699994566005845
Energy: 0.9434260566308426
Energy: 0.9682949094207389
Energy: 0.9427043990709979
Energy: 0.9704596158867035
Energy: 0.9688146865186122
Energy: 0.9688625037901871
Energy: 0.9717450617074231
Energy: 0.9683444190392669
Energy: 0.9693268417049682
Energy: 1.4231555371283593
Energy: 1.0918174297453227
Energy: 1.125292844324474
Energy: 1.2947629818436004
Energy: 1.011171733191164
Energy: 0.9402243520036808
Energy: 1.4233263919231516
Energy: 1.119313874343773
Energy: 1.0846093677413164
Energy: 1.290766884556668
Energy: 1.0920019190012547
Energy: 1.085420662227493
Energy: 0.9752817708882501
Energy: 1.0325647160520388
Energy: 1.0213764665597704
Energy: 0.9687026341199912
Energy: 1.0306346415590926
Energy: 1.0870686427986964
Energy: 0.9060691504119271
Energy: 1.0327188991412297
Energy: 1.00206392695529
Energy: 0.9083822347321984
Energy: 1.0298559173899675
Energy: 0.9139986910329368
Energy: 0.905427050083205
Energy: 1.121806629032217
Energy: 1.02114173940163
Energy: 0.9050867315326532
Energy: 0.989323888755737
Energy: 0.905001815108129
Energy: 1.2304676835409079
Energy: 1.3008459699393287
Energy: 1.2027419125354613
Energy: 1.2324689650113487
Energy: 1.2840008056704455
Energy: 1.2107204158275864
Energy: 0.9697161326900601
Energy: 0.9704345816379691
Energy: 1.085928580762597
Energy: 0.9696629943741163
Energy: 0.9700941860387288
Energy: 1.0248048455957097
Energy: 1.4276405762994253
Energy: 1.252134631649292
Energy: 1.4658616486788552
Energy: 1.2373946789443087
Energy: 1.252105875451539
Energy: 1.4611722275581027

minimum gb energy = 0.9039811077272779 eV
minimum distance =  2.3296990462064 Angstroms
sigma value = 67


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

Energy: 1.4027127395230408
Energy: 1.992528838220437
Energy: 0.9044090105701434
Energy: 1.4050417887389923
Energy: 1.9909412128751176
Energy: 0.9029105206531232
Energy: 1.181745693276229
Energy: 1.0038749552908455
Energy: 0.8623947128175368
Energy: 1.2628726315539038
Energy: 1.0038157866133366
Energy: 0.8626047154059994
Energy: 1.0056758783522366
Energy: 0.8126804354724823
Energy: 0.8656484387284082
Energy: 1.0059994036608566
Energy: 0.8125062435858914
Energy: 0.8664007795743406
Energy: 1.0058944108155603
Energy: 0.8653969782031398
Energy: 0.8655230027502209
Energy: 1.0056220113936343
Energy: 0.9442452700882509
Energy: 0.8661719133005039
Energy: 1.0066317431674692
Energy: 0.8655859041643175
Energy: 0.8650750096234048
Energy: 1.006375546886895
Energy: 0.9443771359938313
Energy: 1.0061611863383715
Energy: 1.0091081428559265
Energy: 0.8591192050128599
Energy: 1.0083577226349976
Energy: 1.0099737095767098
Energy: 1.129943029560077
Energy: 1.0083991845384848
Energy: 1.366836892596059
Energy: 1.0039567516515224
Energy: 0.8636348494778598
Energy: 1.3679377103419068
Energy: 1.0031724628855367
Energy: 0.863834274300969

minimum gb energy = 0.8125062435858914 eV
minimum distance =  2.39853237139164 Angstroms
sigma value = 3


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

Energy: 1.903048847848807
Energy: 1.9290194517280368
Energy: 1.269823612526358
Energy: 1.88715935224208
Energy: 1.9998977846053134
Energy: 1.2781921903556235
Energy: 1.085886869060483
Energy: 1.3294948839693534
Energy: 1.123960367649718
Energy: 1.298986311292555
Energy: 1.3220144064939068
Energy: 1.0202361352131162
Energy: 1.0192759510578009
Energy: 1.0085419054541693
Energy: 1.0081077125522753
Energy: 1.0190828313212834
Energy: 1.0082673767795598
Energy: 1.0612257898269342
Energy: 1.022572012034885
Energy: 1.0167973259070495
Energy: 1.0163900506916896
Energy: 1.0223368154877401
Energy: 1.2069444295289906
Energy: 1.0166420349324843
Energy: 1.0156391180954931
Energy: 1.0172745818595266
Energy: 1.0168472348647568
Energy: 1.0159531825225645
Energy: 1.116872859635153
Energy: 1.016302040745722
Energy: 1.3196711467670421
Energy: 1.0864255491056987
Energy: 1.0779123205723526
Energy: 1.3213779496718199
Energy: 1.1175531284646885
Energy: 1.0246358399426698
Energy: 1.0165500478038816
Energy: 1.2141293253005507
Energy: 1.1592446487201167
Energy: 1.231782263730283
Energy: 1.1964259889150033
Energy: 1.039191085676258
Energy: 1.7567373657454124
Energy: 1.4902932173984442
Energy: 1.2089989129486052
Energy: 1.7600947470734798
Energy: 1.4592278785523953
Energy: 1.1628519252858425
Energy: 1.0191098841393533
Energy: 1.2139120423299696
Energy: 1.1272036895807094
Energy: 1.2355030669885507
Energy: 1.244854771084988
Energy: 1.0386176786272991
Energy: 1.6232528951718166
Energy: 1.0644026552106027
Energy: 1.0616186866308988
Energy: 1.450478054289535
Energy: 1.0587804516791224
Energy: 1.2847490892254811
Energy: 1.212132658428331
Energy: 1.0783262269960168
Energy: 1.0689309892483951
Energy: 1.2137684903971822
Energy: 1.2235174571196827
Energy: 1.1083120657718561
Energy: 1.1765981792893612
Energy: 1.2526254685549103
Energy: 1.0223566985654127
Energy: 1.1766506963380186
Energy: 1.0999310469642163
Energy: 1.019797946181972
Energy: 1.442466345065175
Energy: 1.0207317373202642
Energy: 1.0215388131777248
Energy: 1.0724955339767048
Energy: 1.0204745189165114
Energy: 1.021610956019156
Energy: 1.1759350003914089
Energy: 1.019849613493185
Energy: 1.0195241588553816
Energy: 1.1761194532419355
Energy: 1.0256074019013268
Energy: 1.0200983711770788
Energy: 1.5447104373517013
Energy: 1.0214726213879644
Energy: 1.0225413570293727
Energy: 1.547657041418932
Energy: 1.0214093227748835
Energy: 1.1685750494062168
Energy: 1.2117415545188075
Energy: 1.0994968360704278
Energy: 1.0843316717449407
Energy: 1.213546620011309
Energy: 1.2082302432145355
Energy: 1.0857381399768042
Energy: 1.4563768468321283
Energy: 1.1284922628215595
Energy: 1.129196997912578
Energy: 1.4924661103395034
Energy: 1.0913521578253638
Energy: 1.3108913949742487
Energy: 1.2974334552790725
Energy: 1.1169349795479149
Energy: 1.085708107625702
Energy: 1.299221799446831
Energy: 1.2904055563533496
Energy: 1.0849580787750146
Energy: 1.238020369083295
Energy: 1.3129755489181847
Energy: 1.109380758714309
Energy: 1.3412486946265643
Energy: 1.231668359470077
Energy: 1.0676779027179055
Energy: 1.1814951925421993
Energy: 1.1020020987928134
Energy: 1.1097881757080843
Energy: 1.1816467260941983
Energy: 1.101358490789351
Energy: 1.0580085496973648
Energy: 1.1508554797643173
Energy: 1.0847965449515387
Energy: 1.085627694488877
Energy: 1.1507231299972218
Energy: 1.0688555918390172
Energy: 1.0853566511061672
Energy: 1.3339704347452115
Energy: 1.303684788077858
Energy: 1.2089609741936436
Energy: 1.336258408765361
Energy: 1.2698630305579504
Energy: 1.1049532400501187
Energy: 1.149138954209942
Energy: 1.0021928125941595
Energy: 1.001762575781991
Energy: 1.1520432978109758
Energy: 1.2151450212479376
Energy: 0.9994540019031758
Energy: 1.1212484284003832
Energy: 1.0196207171041922
Energy: 1.1157098722494905
Energy: 1.1213643978028174
Energy: 1.7449468805742472
Energy: 1.1221074836659988
Energy: 1.4999554960720176
Energy: 1.0017580846933711
Energy: 0.9990269729453265
Energy: 1.499387486789573
Energy: 1.2179170588217285
Energy: 0.9986876919611817
Energy: 1.5862684517729477
Energy: 1.464288869437928
Energy: 1.368567409502409
Energy: 1.1275779240320822
Energy: 1.4642460352972366
Energy: 1.16096989280466
Energy: 1.3313336346145823
Energy: 1.3408526616717822
Energy: 1.368405279992649
Energy: 1.1241642385741588
Energy: 1.3822715009304252
Energy: 1.1213004124290509
Energy: 1.368832181729293
Energy: 1.0000220343853272
Energy: 0.9990334846576086
Energy: 1.3710319785283167
Energy: 1.2169472682160987
Energy: 0.9988293939730336
Energy: 1.04033504623859
Energy: 1.0095467982346773
Energy: 1.0087987641771747
Energy: 1.040170902856241
Energy: 1.0086199398872961
Energy: 1.0414203325345268
Energy: 1.0492123943856413
Energy: 1.0002807605906112
Energy: 0.9997213100989694
Energy: 1.0519375377756086
Energy: 1.1888072738923374
Energy: 1.0033229603587792
Energy: 1.0434962194196153
Energy: 1.222086419629087
Energy: 1.0886381187342242
Energy: 1.04325455704986
Energy: 1.500416823206165
Energy: 1.08190639962347
Energy: 1.0583050367756093
Energy: 1.1628449305952733
Energy: 1.0912663032248033
Energy: 1.049555073461987
Energy: 1.1698942775910157
Energy: 1.0869409882753056
Energy: 1.7644023121001087
Energy: 1.261062719617924
Energy: 1.2834376258154976
Energy: 1.0187356245197492
Energy: 1.2611733129102896
Energy: 1.1279016616422708
Energy: 1.2968267463818635
Energy: 1.3095074290665676
Energy: 1.207669319408569
Energy: 1.0211837665758705
Energy: 1.4192982398380067
Energy: 1.1798799181602804
Energy: 1.3672440646104431
Energy: 1.0721372108807026
Energy: 1.0686825979424621
Energy: 1.3684840287948972
Energy: 1.2110607991052547
Energy: 1.0838761789642768
Energy: 1.2418958407205394
Energy: 1.059175320798155
Energy: 1.0573765285323697
Energy: 1.2688416616568916
Energy: 1.057751906322565
Energy: 1.2748396614537143
Energy: 1.2104025211494638
Energy: 1.2209956689143293
Energy: 1.1793115792661635
Energy: 1.2128299011050023
Energy: 1.1702074563793083
Energy: 1.0855045882038155
Energy: 1.448398907579202
Energy: 1.0202115741431532
Energy: 1.0222593948691059
Energy: 1.4499067619390513
Energy: 1.019850403415441
Energy: 1.0216038960823126
Energy: 1.2143372471757516
Energy: 1.02002605742845
Energy: 1.0199858738371566
Energy: 1.2155789408971198
Energy: 1.025027673083665
Energy: 1.0202604734279361
Energy: 1.5444182451966209
Energy: 1.020599844587057
Energy: 1.0212862725329352
Energy: 1.5284137826319497
Energy: 1.0200718723762667
Energy: 1.0220152833102296
Energy: 1.1975487526044974
Energy: 1.1624631518115733
Energy: 1.0204383940439885
Energy: 1.2004948986006643
Energy: 1.3569619019711439
Energy: 1.021042869238163
Energy: 1.237348580542656
Energy: 1.0846768041620467
Energy: 1.3113703129176526
Energy: 1.2384985949076552
Energy: 1.1718666732170915
Energy: 1.1692643793578543
Energy: 1.4628760145723492
Energy: 1.1276434070508694
Energy: 1.130179753566781
Energy: 1.6032066054463003
Energy: 1.0887337603504903
Energy: 1.393352100599571
Energy: 1.1186305859441665
Energy: 1.1183873872722
Energy: 1.0203713724826209
Energy: 1.1694427920980341
Energy: 1.3595402613191692
Energy: 1.022929343625734
Energy: 1.6504160990193775
Energy: 1.0980776453670686
Energy: 1.1093507930320305
Energy: 1.6530941769701606
Energy: 1.0962492523806837
Energy: 1.1072490957054375
Energy: 1.1189337776807078
Energy: 1.1181312503081335
Energy: 1.0207299538004204
Energy: 1.1699949796092597
Energy: 1.1081671885984157
Energy: 1.023010524626478
Energy: 1.350352521529091
Energy: 1.062769209199018
Energy: 1.1147827772765653
Energy: 1.3540090909490905
Energy: 1.0980405365120636
Energy: 1.069456658590194
Energy: 1.1321837604077016
Energy: 1.258842215952556
Energy: 1.0596215547429078
Energy: 1.1172600900966139
Energy: 1.0975701790391033
Energy: 1.0180795914513425
Energy: 1.1016532785562438
Energy: 1.0186547364204672
Energy: 1.0170123319380227
Energy: 1.1028325064294338
Energy: 1.0184654172347827
Energy: 1.0171337221127825
Energy: 1.2467877614991991
Energy: 1.0191639819793443
Energy: 1.0188161010989711
Energy: 1.2472409563730182
Energy: 1.0184873067414326
Energy: 1.0174050069456284
Energy: 1.0782245537687316
Energy: 1.210226858364825
Energy: 1.3642849226316724
Energy: 1.3265718062999525
Energy: 1.4045671760967338
Energy: 1.0204704471192259

minimum gb energy = 0.9986876919611817 eV
minimum distance =  2.33797380538916 Angstroms
sigma value = 81


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

Energy: 1.8511332183019282
Energy: 1.1160747235840036
Energy: 1.039676211518684
Energy: 1.85494601667292
Energy: 1.9163070343996078
Energy: 1.0394471367905356
Energy: 1.2487048768459161
Energy: 1.025936933511386
Energy: 1.157070189817183
Energy: 1.024901979742169
Energy: 1.0256484878715038
Energy: 1.0591375627168287
Energy: 1.1043246085146268
Energy: 1.007300081421964
Energy: 1.2880173473787278
Energy: 1.1052899059564327
Energy: 1.006611083645954
Energy: 1.165855006411525
Energy: 1.015711808334585
Energy: 1.0097988535080555
Energy: 1.0174545970786324
Energy: 1.0156468101264513
Energy: 1.006792958279375
Energy: 1.0163299568087163
Energy: 1.0171572330135281
Energy: 1.164820036978324
Energy: 1.0544991266375046
Energy: 1.0173939536740817
Energy: 1.1647361826696108
Energy: 1.1556260327514114
Energy: 1.246989054290131
Energy: 1.1652706362504754
Energy: 1.165338267226332
Energy: 1.246762207610241
Energy: 1.0609869400110854
Energy: 1.1681046656431804
Energy: 1.248732904344965
Energy: 1.025784086132314
Energy: 1.1582347680267957
Energy: 1.0245055087001482
Energy: 1.025610537529573
Energy: 1.0606803984004887
Energy: 1.5599133913608798
Energy: 1.2601845826182954
Energy: 1.6322800989926036
Energy: 1.5604711459594454
Energy: 1.258081720241128
Energy: 1.2271311748592246
Energy: 1.2466873208471119
Energy: 1.0243624694503661
Energy: 1.0602374503176575
Energy: 1.2469791546050222
Energy: 1.026042356539264
Energy: 1.0590250536286328
Energy: 1.1062936049447514
Energy: 1.0069816909931393
Energy: 1.0068519190693945
Energy: 1.1060209890558121
Energy: 1.0075679257957237
Energy: 1.0069807972119034
Energy: 1.025821001716257
Energy: 1.0065260814852655
Energy: 1.0061819489957105
Energy: 1.0265448269038064
Energy: 1.0058273292336608
Energy: 1.1576653023400192
Energy: 1.0073285415759725
Energy: 1.1599861215796794
Energy: 1.158181734047049
Energy: 1.0074584045176547
Energy: 1.2484557336148183
Energy: 1.164535786227987
Energy: 1.0075788981793397
Energy: 1.0165918367139308
Energy: 1.15601860901478
Energy: 1.0065365097154797
Energy: 1.0164240246750715
Energy: 1.2917025523256618
Energy: 1.0250122008666087
Energy: 1.0150715709539613
Energy: 1.0151956285756196
Energy: 1.025307096564006
Energy: 1.0159817638247746
Energy: 1.0166930605602749
Energy: 1.4696942057281035
Energy: 1.2074835688821162
Energy: 1.204938990439077
Energy: 1.4700952566015588
Energy: 1.0177071495447068
Energy: 1.1655163161988316
Energy: 1.025068096860489
Energy: 1.0161575741804394
Energy: 1.0602429926293928
Energy: 1.024829388953455
Energy: 1.0247425277347457
Energy: 1.0587347207726185
Energy: 1.2408935931514902
Energy: 1.163036376615869
Energy: 1.2032023580834217
Energy: 1.2405362301365424
Energy: 1.559418461286744
Energy: 1.18484256421553
Energy: 1.2474227247138359
Energy: 1.0246455874289535
Energy: 1.0608197464599085
Energy: 1.247859073005579
Energy: 1.0240491775358829
Energy: 1.0616816184559732
Energy: 1.0071482745765465
Energy: 1.2474633716335013
Energy: 1.0065202068800438
Energy: 1.009399263375859
Energy: 1.2562637937469157
Energy: 1.0065412924559305
Energy: 1.0071761144517701
Energy: 1.0269309063719092
Energy: 1.006895666140068
Energy: 1.0471519436775838
Energy: 1.0261743698546437
Energy: 1.0069494694778973
Energy: 1.2464162763752806
Energy: 1.0244897685272807
Energy: 1.060296642088563
Energy: 1.2472805417382655
Energy: 1.0247041963148407
Energy: 1.0620577573448013
Energy: 1.0180005251305766
Energy: 1.006018494109535
Energy: 1.3667617506373437
Energy: 1.0179806266451619
Energy: 1.0068069363021142
Energy: 1.3615772684265328
Energy: 1.013807024470749
Energy: 1.0521704922695563
Energy: 1.0173541126619445
Energy: 1.0149318533826848
Energy: 1.0249010676586134
Energy: 1.0140946987131583
Energy: 1.016562391688843
Energy: 1.1657581814247662
Energy: 1.1559996275127262
Energy: 1.015924066841223
Energy: 1.063657852003099
Energy: 1.1551943345427502
Energy: 1.2571796576681722
Energy: 1.059974770338644
Energy: 1.06127230077386
Energy: 1.256601319223492
Energy: 1.0246731895737835
Energy: 1.060083869138276
Energy: 1.467004233755834
Energy: 1.0266377223949215
Energy: 1.1585856203976992
Energy: 1.4659726474206094
Energy: 1.0254593912353118
Energy: 1.0605287506522958
Energy: 1.0237375034571847
Energy: 1.0264232335800347
Energy: 1.1579404775682782
Energy: 1.0236617392881109
Energy: 1.2475974652374124
Energy: 1.0610050800910709
Energy: 1.2585000316827042
Energy: 1.0061838994149792
Energy: 1.0612757356546825
Energy: 1.2592855611348472
Energy: 1.0062261462329694
Energy: 1.157759796847236
Energy: 1.0264033769891485
Energy: 1.007344456424837
Energy: 1.007293712180282
Energy: 1.0271927425565022
Energy: 1.0079522810921184
Energy: 1.0075887264911612
Energy: 1.024112563620953
Energy: 1.0608276104957983
Energy: 1.059770775068897
Energy: 1.0245244469776633
Energy: 1.0257791334024189
Energy: 1.058757557963075
Energy: 1.0067384299537
Energy: 1.107210578900129
Energy: 1.1589392928202895
Energy: 1.0076740403244253
Energy: 1.0157143210996784
Energy: 1.2884543282029806
Energy: 1.0244291557408693
Energy: 1.0143613947797636
Energy: 1.0144868348385752
Energy: 1.024523110183187
Energy: 1.0149213879582029
Energy: 1.015341340439034
Energy: 1.0257733194595298
Energy: 1.155977178492615
Energy: 1.1560701636415958
Energy: 1.0615102181688127
Energy: 1.0163692992382243
Energy: 1.053642090979987
Energy: 1.0258204506512572
Energy: 1.159029259709456
Energy: 1.0157335045580083
Energy: 1.0261150186229977
Energy: 1.3675796162416214
Energy: 1.1648000707322475
Energy: 1.025873690609835
Energy: 1.0607612815629746
Energy: 1.061260639675959
Energy: 1.0258388073422235
Energy: 1.023460907567035
Energy: 1.0601094655549663
Energy: 1.2449657435601553
Energy: 1.0564568671618442
Energy: 1.1626346079553573
Energy: 1.2450723156892427
Energy: 1.0565311003872933
Energy: 1.237357771866405
Energy: 1.247254214972876
Energy: 1.0253100451716117
Energy: 1.028107584807961
Energy: 1.0251030123890512
Energy: 1.0253417715918096
Energy: 1.070196554174144
Energy: 1.8521146693008215
Energy: 1.1716141315087714
Energy: 1.040492253829023
Energy: 1.8549006881756793
Energy: 1.1709127992791946
Energy: 1.0404605577427468

minimum gb energy = 1.0058273292336608 eV
minimum distance =  2.35534326236083 Angstroms
sigma value = 43


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

Energy: 1.9453608571716787
Energy: 1.50136553342335
Energy: 1.2345885182285727
Energy: 1.9489144915128178
Energy: 1.501230376800266
Energy: 1.1125451764780467
Energy: 1.2929395991136035
Energy: 1.1473332052516407
Energy: 1.2648315452528598
Energy: 1.2242873753974706
Energy: 1.147153725559877
Energy: 1.2145160923976512
Energy: 1.2012663617700898
Energy: 1.0455952816134857
Energy: 1.0504428843429976
Energy: 1.2015140810207248
Energy: 1.047841247346687
Energy: 1.1554848891534186
Energy: 1.0684157257679094
Energy: 1.050733102494088
Energy: 1.069611434510851
Energy: 1.0692416651452201
Energy: 1.2404352288569187
Energy: 1.0689777138299725
Energy: 1.081903027092917
Energy: 1.1732232239291833
Energy: 1.0961004054638137
Energy: 1.0824251614628613
Energy: 1.0851035489171053
Energy: 1.0838886518470752
Energy: 1.0827053847121177
Energy: 1.0703988742090584
Energy: 1.0847269886216484
Energy: 1.0702545800691083
Energy: 1.0824871194201597
Energy: 1.0704004540633834
Energy: 1.1106833612741462
Energy: 1.0815095924505858
Energy: 1.0815278397785286
Energy: 1.1105893937413818
Energy: 1.0821492769790642
Energy: 1.0817965337432252
Energy: 1.6584731553740675
Energy: 1.0705792262508156
Energy: 1.3844871175974554
Energy: 1.6597518292408895
Energy: 1.0707030328154967
Energy: 1.2344102807295245
Energy: 1.146869538442481
Energy: 1.0852019294631072
Energy: 1.0854700472226146
Energy: 1.146789391309206
Energy: 1.233449562923441
Energy: 1.0853064651804378
Energy: 1.3545020819902167
Energy: 1.3391505708978648
Energy: 1.1866292899037925
Energy: 1.3547132615889097
Energy: 1.2991425986966487
Energy: 1.3345846891831088
Energy: 1.2155051702543223
Energy: 1.178774262678948
Energy: 1.1745514376440296
Energy: 1.2183385110605038
Energy: 1.146140683495224
Energy: 1.1387041940810514
Energy: 1.237410650007349
Energy: 1.2330905651147828
Energy: 1.086069615323939
Energy: 1.0440942138976572
Energy: 1.4632621158275179
Energy: 1.0856302673732663
Energy: 1.237528923413338
Energy: 1.1570337677847033
Energy: 1.0902442580469043
Energy: 1.0504791758926304
Energy: 1.1568431535807862
Energy: 1.0904395296004101
Energy: 1.0451822109583935
Energy: 1.1680970635747772
Energy: 1.2086092249093525
Energy: 1.0445645832661028
Energy: 1.1681462618669856
Energy: 1.1390612845138428
Energy: 1.047097722119208
Energy: 1.1374657650785747
Energy: 1.0468501141214028
Energy: 1.0506322437799844
Energy: 1.1187512468271636
Energy: 1.0464973326220286
Energy: 1.0490871723782578
Energy: 1.048992078147246
Energy: 1.0459175665432892
Energy: 1.0415850587099698
Energy: 1.1674794404144087
Energy: 1.0445544980175425
Energy: 1.0482058942488837
Energy: 1.0478306222051876
Energy: 1.0493484680877525
Energy: 1.0480939748256792
Energy: 1.2147028006711083
Energy: 1.0481231877311288
Energy: 1.2206331195060645
Energy: 1.2812219849502646
Energy: 1.1766823959187358
Energy: 1.3871290268505039
Energy: 1.2312754347286894
Energy: 1.0489937253946613
Energy: 1.1518430335827774
Energy: 1.2314504345369388
Energy: 1.1867902163930453
Energy: 1.1491326237360602
Energy: 1.2304967474299737
Energy: 1.0678074383585139
Energy: 1.147656153580162
Energy: 1.3460254587273623
Energy: 1.1870071128782433
Energy: 1.256682281545019
Energy: 1.3772061351913547
Energy: 1.068728123092677
Energy: 1.4237425297605955
Energy: 1.2645063040176563
Energy: 1.1778561300631718
Energy: 1.4241326748078942
Energy: 1.2392202917486872
Energy: 1.177036554660022
Energy: 1.2987641462428559
Energy: 1.0830236915001823
Energy: 1.1656830535998928
Energy: 1.2993670283117176
Energy: 1.0499264480861195
Energy: 1.2584572058815657
Energy: 1.2291106772582234
Energy: 1.1795635630240953
Energy: 1.179022989038572
Energy: 1.2302682311265518
Energy: 1.2303355989199318
Energy: 1.1768400241246653
Energy: 1.5686855141775367
Energy: 1.4142114154517162
Energy: 1.2624890723794924
Energy: 1.0502176116613544
Energy: 1.0499952414902909
Energy: 1.0478864562849644
Energy: 1.2301185775165524
Energy: 1.0458100852113408
Energy: 1.04675995246773
Energy: 1.230356329492504
Energy: 1.0458399201833013
Energy: 1.0502257331416691
Energy: 1.168397415712229
Energy: 1.041917840266626
Energy: 1.0460214515583115
Energy: 1.1718485286596736
Energy: 1.0428433697182125
Energy: 1.0459749209356115
Energy: 1.168328965358683
Energy: 1.3331552500040742
Energy: 1.0461921427374874
Energy: 1.168447805571434
Energy: 1.0418827246720854
Energy: 1.0461920452855211
Energy: 1.1679082936453522
Energy: 1.229504518917573
Energy: 1.0730034469640943
Energy: 1.167645070810758
Energy: 1.1464979270441196
Energy: 1.085107948620183
Energy: 1.1864653644991896
Energy: 1.065378890889684
Energy: 1.1505685226666835
Energy: 1.1867101137318572
Energy: 1.1937366172759296
Energy: 1.1985292763023938
Energy: 1.4623051010265804
Energy: 1.146925016456929
Energy: 1.2310561276856014
Energy: 1.4084590946413944
Energy: 1.14683988950968
Energy: 1.0851015925148595
Energy: 1.9492160925566033
Energy: 1.3871967530362712
Energy: 1.5129518956831274
Energy: 1.0852474846257067
Energy: 1.3878140879328071
Energy: 1.4698016860437475

minimum gb energy = 1.0415850587099698 eV
minimum distance =  2.29219370227359 Angstroms
sigma value = 57


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

Energy: 1.5046801319815926
Energy: 1.0894755863779961
Energy: 1.235220555085097
Energy: 1.5079308620412528
Energy: 1.089521842118752
Energy: 1.155280691810886
Energy: 1.2778676767380288
Energy: 1.0965696109549292
Energy: 1.0970804397095957
Energy: 1.0968763544264029
Energy: 1.096612008799675
Energy: 1.0884637909997346
Energy: 1.2225379764165911
Energy: 0.9953132150803491
Energy: 0.9960737292478214
Energy: 1.2238501379166098
Energy: 1.1323955531311805
Energy: 0.9951519543530402
Energy: 1.0877998254765686
Energy: 0.9966565663871787
Energy: 0.9950025657694975
Energy: 1.0875012610669081
Energy: 1.1308872210394292
Energy: 1.0878160041171954
Energy: 1.0881676451282416
Energy: 1.0400005004758233
Energy: 1.0391780713738907
Energy: 1.0884561545993485
Energy: 1.039955459157129
Energy: 1.0396416733496439
Energy: 0.9960670387375525
Energy: 1.0393751508310254
Energy: 1.0395526484263384
Energy: 1.0436241438826368
Energy: 1.0888143415079974
Energy: 1.0388920256971133
Energy: 1.1776677451587698
Energy: 1.0868862194974638
Energy: 1.0868506666930344
Energy: 1.1793075080447772
Energy: 1.0909669843797012
Energy: 1.086930182429778
Energy: 1.086865993747412
Energy: 1.0726901931049162
Energy: 1.2601649393287093
Energy: 1.088053621986989
Energy: 1.08382663487918
Energy: 1.0889089092713236
Energy: 1.0959883061293327
Energy: 1.0877903983382446
Energy: 1.0880718914799339
Energy: 1.0967473938208276
Energy: 1.0976340372433102
Energy: 1.0906108855725363
Energy: 1.1765508862947867
Energy: 1.0864831086655466
Energy: 1.0871004644505178
Energy: 1.1762151162924521
Energy: 1.0866258140999216
Energy: 1.2527191096055998
Energy: 1.27525602718974
Energy: 1.087653245269349
Energy: 1.0887853725205283
Energy: 1.2752911624733902
Energy: 1.095591410969811
Energy: 1.0875656856512335
Energy: 0.9950183593075338
Energy: 1.0969807577109496
Energy: 1.09712937588243
Energy: 0.9972107644281419
Energy: 1.2781978235004527
Energy: 1.1778751344750216
Energy: 0.9969472474056195
Energy: 1.0879441591466028
Energy: 1.1788346443009161
Energy: 1.1645446459219992
Energy: 1.1027869074915024
Energy: 1.1790866516366363
Energy: 1.2763245154371472
Energy: 1.0956203965763238
Energy: 1.154616007614809
Energy: 1.276165111239894
Energy: 1.097156106729751
Energy: 1.0878529837681497
Energy: 1.0784527876622907
Energy: 1.0611026150105147
Energy: 1.060787346710489
Energy: 1.085555605213498
Energy: 1.5108432673133954
Energy: 1.0608664645160373
Energy: 1.0867157020811538
Energy: 1.0989044609666234
Energy: 1.1007127765296856
Energy: 1.0887326951751302
Energy: 1.178529338819599
Energy: 1.087156576323087
Energy: 1.0881846530076462
Energy: 1.0397599589723103
Energy: 1.0394434233838261
Energy: 1.088372002215708
Energy: 1.0403268052559906
Energy: 1.0393050909098744
Energy: 1.1781487411224572
Energy: 1.0884868032724506
Energy: 1.0421755887039585
Energy: 1.0886364230114154
Energy: 1.0884759369016166
Energy: 1.0415673139027102
Energy: 1.1784685168479043
Energy: 1.0882033848519423
Energy: 1.0882617002800479
Energy: 1.096046909104674
Energy: 1.0878734819348879
Energy: 1.0879691143620598
Energy: 1.0965026885410887
Energy: 1.2551021514186467
Energy: 1.0884659224826632
Energy: 1.0961977709332185
Energy: 1.246318484678538
Energy: 1.0918022725044199
Energy: 1.0967202878823143
Energy: 1.1547674140295878
Energy: 1.1546778064141523
Energy: 1.0966347020400153
Energy: 1.097397887889474
Energy: 1.0875829646313673
Energy: 1.5920603937247693
Energy: 1.0870537497433541
Energy: 1.1480308619764925
Energy: 1.5857964579077666
Energy: 1.2223151582931386
Energy: 1.1484222380351279
Energy: 1.2759431515302204
Energy: 1.0958764728262838
Energy: 1.154625613781685
Energy: 1.276857215717396
Energy: 1.0982821590265195
Energy: 1.2553422409548918
Energy: 0.9971459183933715
Energy: 1.2555002267023374
Energy: 1.1789289790560489
Energy: 1.179655748578801
Energy: 1.2792084684860623
Energy: 1.1791402873067305

minimum gb energy = 0.9950025657694975 eV
minimum distance =  2.32680379693161 Angstroms
sigma value = 17


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

Energy: 1.681927434126964
Energy: 1.7530079781262784
Energy: 1.2855130664067906
Energy: 1.6856462417600964
Energy: 1.7365140190868258
Energy: 1.0655074142729966
Energy: 1.2596977722699996
Energy: 1.1228615342076922
Energy: 1.1222986310949918
Energy: 1.337644866675471
Energy: 1.279034893509958
Energy: 1.1518943797518542
Energy: 1.3850793825742156
Energy: 1.0379085993398043
Energy: 1.0092891902307064
Energy: 1.3868952133843602
Energy: 1.0660567143068684
Energy: 1.0093665842192505
Energy: 1.1220288346846181
Energy: 1.0394297675519863
Energy: 1.009343379713848
Energy: 1.1222197342574778
Energy: 0.9488409214250858
Energy: 1.1218376637182104
Energy: 1.119401337245496
Energy: 1.1328023247833294
Energy: 1.1329786294496602
Energy: 1.118915613724277
Energy: 1.1320252606679295
Energy: 1.1602583314321842
Energy: 1.476439327786173
Energy: 0.981027823248506
Energy: 0.9805075145683587
Energy: 0.9498655105182074
Energy: 0.9801497746766124
Energy: 0.9498754948592628
Energy: 0.996708339067661
Energy: 0.9794624813561548
Energy: 0.979443051382845
Energy: 0.9974233119566481
Energy: 0.9807607279079847
Energy: 1.1068208548974228
Energy: 1.424467032241052
Energy: 1.0812326119666047
Energy: 1.0280953687005325
Energy: 0.9808438297856442
Energy: 1.0775723270588722
Energy: 1.0277475292837919
Energy: 0.9836609269383703
Energy: 1.184527580227293
Energy: 1.0831166271845811
Energy: 0.980526035833494
Energy: 0.9811105763790636
Energy: 0.9798136935742495
Energy: 0.9797205900751502
Energy: 0.9809961784550779
Energy: 0.9799535602756847
Energy: 0.9798569496239832
Energy: 1.1177227315450802
Energy: 0.9806460553752646
Energy: 1.1748252352839306
Energy: 1.1666739385244091
Energy: 1.1312070057847259
Energy: 1.292309288204387
Energy: 1.1184475667596794
Energy: 1.1315525626319047
Energy: 1.1319043554151174
Energy: 1.1214041886328625
Energy: 1.121470890048036
Energy: 1.1319566746179326
Energy: 1.1220079213673806
Energy: 1.1215271723495903
Energy: 0.9971766745608871
Energy: 1.2338990019018985
Energy: 1.1227765318740652
Energy: 1.0558966868237307
Energy: 1.387709450266304
Energy: 1.1223865159257573
Energy: 1.281327071413788
Energy: 1.122479054802709
Energy: 1.1227815286845828
Energy: 1.2806743200583763
Energy: 1.1226798402291982
Energy: 1.11794710863168
Energy: 1.5069425406500316
Energy: 1.122716995050454
Energy: 1.1226083936313322
Energy: 1.5070619744413751
Energy: 1.1233515642111378
Energy: 1.2324423132808062
Energy: 1.3874355320037814
Energy: 1.1385264581819758
Energy: 1.2786314463550374
Energy: 1.3876400357579988
Energy: 1.139938598403452
Energy: 1.1223577768361435
Energy: 1.1015005091055026
Energy: 1.2334882876006776
Energy: 1.2334592116841074
Energy: 1.101022741436746
Energy: 1.3866856702916035
Energy: 1.2337074124306653

minimum gb energy = 0.9488409214250858 eV
minimum distance =  2.30486319142059 Angstroms
sigma value = 17


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

Energy: 1.7925361113303102
Energy: 1.261163605320844
Energy: 1.0498079254721584
Energy: 1.066872812200774
Energy: 1.1606183156255425
Energy: 1.0832322543007873
Energy: 1.3748926866757478
Energy: 1.1553366913058116
Energy: 1.15522906610121
Energy: 1.2508360932302902
Energy: 1.1602537839717304
Energy: 1.214874940359679
Energy: 1.3799692439864462
Energy: 0.9391674288272915
Energy: 1.0407653766743015
Energy: 1.292423920284243
Energy: 1.1012028063729475
Energy: 1.041166074288521
Energy: 1.1865780078984678
Energy: 1.0407763465137618
Energy: 1.0415222752784559
Energy: 1.1544303879732296
Energy: 0.9549813146796989
Energy: 1.0413004007029905
Energy: 1.158975099265793
Energy: 1.1544371861627782
Energy: 1.1483308234451017
Energy: 1.1670938813761236
Energy: 1.0178232871971962
Energy: 1.1473343042614186
Energy: 1.576124061797491
Energy: 1.007095407355654
Energy: 0.939803976215124
Energy: 1.101652860166261
Energy: 1.0069485921524073
Energy: 0.9399410356437257
Energy: 1.170866838145882
Energy: 1.0069663514820963
Energy: 1.0069689553015435
Energy: 1.107016226737946
Energy: 1.0105444096915783
Energy: 1.060084121607979
Energy: 1.1073772193913956
Energy: 1.1107033582893038
Energy: 1.1034460033042968
Energy: 1.072873812005911
Energy: 1.0918994888942815
Energy: 1.065887925136156
Energy: 0.9488890395623112
Energy: 1.1210708916083367
Energy: 1.0570376935703194
Energy: 0.9481357784985912
Energy: 1.0580723849418707
Energy: 0.9446402504542286
Energy: 0.9449388491672451
Energy: 1.1380018578050206
Energy: 1.1442228910193162
Energy: 0.9450009763509871
Energy: 1.1452646920010712
Energy: 1.1426123118199285
Energy: 0.9830890244175606
Energy: 0.9456516475079639
Energy: 1.1503762137795697
Energy: 1.1366260482378776
Energy: 0.9450305241131685
Energy: 1.1521225359387715
Energy: 1.2166180875558112
Energy: 0.9448537060875442
Energy: 0.9448274427518102
Energy: 1.2157892895084434
Energy: 0.9448290756555907
Energy: 1.00416912606448
Energy: 1.0053711368711928
Energy: 1.0507308726843585
Energy: 1.0427066002560808
Energy: 1.0933138399448252
Energy: 1.2052112765628706
Energy: 1.0445446267027279
Energy: 1.008486702557253
Energy: 1.0402284100116381
Energy: 1.172454942328142
Energy: 1.0100524350218048
Energy: 1.3229351146508719
Energy: 1.0073402357849812
Energy: 1.0069121217554555
Energy: 1.166181806304904
Energy: 1.1636852003264764
Energy: 1.0071613437876488
Energy: 1.022307761864428
Energy: 1.0073287087107008
Energy: 1.294279667080164
Energy: 1.1488148929151096
Energy: 1.0991587534414655
Energy: 1.1952860596376051
Energy: 1.1488922934911563
Energy: 1.099903333987071
Energy: 1.0915929911415279
Energy: 1.1582619832014267
Energy: 1.1584712627515288
Energy: 1.0935329973944228
Energy: 1.1582757763258285
Energy: 0.9870983557721927
Energy: 1.2139690574386195
Energy: 1.248652862182587
Energy: 1.1635314748335766
Energy: 1.2144936017810952
Energy: 1.3094567255043308
Energy: 0.9864940304773572
Energy: 1.298257373491743
Energy: 1.1634628853839692
Energy: 1.1044260831097945
Energy: 1.1964592253299198
Energy: 1.2021991318895697
Energy: 1.0650266550907126
Energy: 1.5791329908030702
Energy: 1.1250006854000791
Energy: 1.124777469819801
Energy: 1.5419590128335716
Energy: 0.9863403762642633
Energy: 1.142463683572156
Energy: 1.330472853084537
Energy: 1.1629069121431705
Energy: 1.1628215388103955
Energy: 1.254357078444071
Energy: 1.1634417336742864
Energy: 1.1245598143898885
Energy: 1.2229775764542008
Energy: 1.2663941155987983
Energy: 1.2047001983950754
Energy: 1.0996563444494067
Energy: 1.2684047357000803
Energy: 1.0028973069059401
Energy: 1.3106299383153053
Energy: 1.1818262649751519
Energy: 1.1818820680544375
Energy: 1.3116826787797415
Energy: 1.2707862127717056
Energy: 1.2038760823159667
Energy: 1.3361619391123423
Energy: 0.9398133455496934
Energy: 1.1188185310220333
Energy: 1.2578951751306902
Energy: 1.2640865452390595
Energy: 1.1250441737081542
Energy: 1.1730808715237078
Energy: 0.9398134588126491
Energy: 1.0407826241676406
Energy: 1.070312038997165
Energy: 1.0262253948551743
Energy: 1.042125862964253
Energy: 1.1682625811475895
Energy: 1.0173217742343348
Energy: 1.1186108495569527
Energy: 1.158337075916389
Energy: 1.0191410610063532
Energy: 1.1004431343368308
Energy: 1.0481336743652683
Energy: 1.0195498371728566
Energy: 1.0153078871459473
Energy: 1.1017061862218493
Energy: 1.233682605749627
Energy: 0.939776797554301
Energy: 1.1011712739177242
Energy: 1.0098374646093888
Energy: 1.0098217471593407
Energy: 1.0998468207315881
Energy: 1.0152752560515634
Energy: 1.0098230493116427
Energy: 1.2991707215545671
Energy: 1.1522908402834642
Energy: 1.161807988590607
Energy: 1.2912052439180395
Energy: 1.0487584257810656
Energy: 1.159219230433481
Energy: 0.9454399785972362
Energy: 1.1104954698385214
Energy: 1.1345844673553676
Energy: 0.9457195539525312
Energy: 1.0919861938175772
Energy: 1.0586291059025277
Energy: 0.9529672916255991
Energy: 1.1403820762304766
Energy: 1.1381476841667788
Energy: 0.9458464095347603
Energy: 1.1300240377125235
Energy: 1.0385444854586672
Energy: 1.3713747288296074
Energy: 1.1338663346043245
Energy: 1.1407336322452455
Energy: 1.0386866483060053
Energy: 1.1013895145111556
Energy: 1.1469254897943735
Energy: 1.2902537037426465
Energy: 0.944695200041681
Energy: 0.9448330097486543
Energy: 1.0861092119211773
Energy: 0.9494061477766312
Energy: 0.9446254271351765
Energy: 1.5044396992658817
Energy: 1.0506398294518744
Energy: 1.0586872124369517
Energy: 1.109503143559624
Energy: 0.9447975994163411
Energy: 1.042633891095077
Energy: 1.0062500757740676
Energy: 1.042428789016107
Energy: 1.1659796834365046
Energy: 1.0063272658937585
Energy: 1.1778987617028995
Energy: 1.1680921452899837
Energy: 1.0066019337224341
Energy: 1.0225957995786248
Energy: 1.0892707000555497
Energy: 1.0065050755178762
Energy: 1.0909953265105787
Energy: 1.0065642023022083
Energy: 1.2881508727753421
Energy: 1.076549152444779
Energy: 1.0560262360297281
Energy: 1.2280184141868482
Energy: 1.0286066319015192
Energy: 1.0567581036871294
Energy: 1.206515843623259
Energy: 1.1548841508778467
Energy: 1.154953655687253
Energy: 1.2727378123808863
Energy: 1.1573900887323227
Energy: 1.1549411835244758
Energy: 1.6792036759315943
Energy: 1.2494692987276879
Energy: 0.9876749259834472
Energy: 1.0662894340318896
Energy: 1.3492808962109215
Energy: 0.9870884826849253
Energy: 1.2831728707619414
Energy: 1.1649218311504839
Energy: 1.1619996167692364
Energy: 1.2876492109463746
Energy: 1.2459255018525992
Energy: 1.0844486813796455
Energy: 1.2894359002354405
Energy: 0.9877028945583767
Energy: 1.142852270914418
Energy: 1.292829913022055
Energy: 1.0665976504169774
Energy: 1.1424305497142988
Energy: 1.38137639293417
Energy: 1.0772449884451971
Energy: 1.1424814602778768
Energy: 1.2945173674635608
Energy: 1.2400625403852226
Energy: 1.1637197233875414
Energy: 1.2782036700647958
Energy: 1.2404451539018366
Energy: 1.1554257117233968
Energy: 1.3106765517847574
Energy: 1.2432044107933318
Energy: 1.1606735618827884

minimum gb energy = 0.9391674288272915 eV
minimum distance =  2.29401793118017 Angstroms
sigma value = 57


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

Energy: 1.577072345612199
Energy: 1.0707103361793568
Energy: 1.016103141049585
Energy: 1.5806533770081217
Energy: 1.5350938842400872
Energy: 1.0180136037391763
Energy: 1.2373436717144208
Energy: 1.1146502177428577
Energy: 1.108004377408737
Energy: 1.0677813273898822
Energy: 1.1118153932373518
Energy: 1.0343033159244603
Energy: 1.2442758772842586
Energy: 0.9006519874704346
Energy: 0.8826186535200569
Energy: 1.2460305153525353
Energy: 1.009038165010565
Energy: 0.9695831685698753
Energy: 1.112013687876473
Energy: 0.9023365726347722
Energy: 0.969516450140754
Energy: 1.1131546086310462
Energy: 1.0640565151310866
Energy: 0.9777295845830227
Energy: 1.0570289014971173
Energy: 0.939774734453575
Energy: 0.9307608468159153
Energy: 1.0572342544349678
Energy: 0.9350572892547465
Energy: 1.0335397327897653
Energy: 1.4252030518519492
Energy: 0.932512692062336
Energy: 0.883231437638241
Energy: 1.0036944259908793
Energy: 0.9322312141387368
Energy: 0.8833256314082157
Energy: 1.1388122169393302
Energy: 0.9320247596780554
Energy: 0.9318515584696947
Energy: 1.139553018061158
Energy: 0.9385254589504674
Energy: 1.0064421408257829
Energy: 1.1367773374650436
Energy: 0.9900502742308201
Energy: 0.8321899751421549
Energy: 1.1383384576550035
Energy: 0.9907313898314144
Energy: 0.8673440898904445
Energy: 0.8626069928607221
Energy: 0.9929261178878477
Energy: 0.8592462149311846
Energy: 0.8634985848646147
Energy: 0.8175613999297572
Energy: 0.8591677378596185
Energy: 0.8638111547405215
Energy: 1.056675378343955
Energy: 1.0549648247185448
Energy: 0.863813428751353
Energy: 1.046515783921598
Energy: 1.0466806643355926
Energy: 0.8333627188166844
Energy: 0.8259956592797287
Energy: 1.0241972889290134
Energy: 0.9876621404635274
Energy: 0.825865028734417
Energy: 1.007755513255246
Energy: 1.1350090044560066
Energy: 0.825579198303072
Energy: 0.8256651753074473
Energy: 1.1358424411325296
Energy: 0.8313737607897705
Energy: 1.0187820860588293
Energy: 0.9895191598813744
Energy: 1.0254455702720968
Energy: 1.0232773904250212
Energy: 0.9870193541930594
Energy: 1.0130442403077469
Energy: 1.0266678338749662
Energy: 0.8265295227785925
Energy: 0.9686163610737275
Energy: 0.825515828686944
Energy: 0.8288920229187706
Energy: 1.1588153517543227
Energy: 0.8253750872238533
Energy: 0.8253069013074723
Energy: 0.989379154216307
Energy: 1.0194890207048162
Energy: 0.8258778167627746
Energy: 0.9753627487301826
Energy: 1.019087415370628
Energy: 1.1520156204471788
Energy: 0.859067033224498
Energy: 1.0304983261365033
Energy: 1.0207633129616995
Energy: 0.8586702959795172
Energy: 1.0330794413218716
Energy: 0.8732825009767629
Energy: 0.8591470315619822
Energy: 0.859436255637962
Energy: 0.8689728358983194
Energy: 0.8680518456070704
Energy: 0.8593897397113082
Energy: 1.0038539906496229
Energy: 0.8620360963601348
Energy: 0.9445616816082103
Energy: 1.1394744111987045
Energy: 1.1065354333656134
Energy: 1.0060532301238507
Energy: 0.9326163734329579
Energy: 0.9514155008559803
Energy: 0.9323451598142429
Energy: 0.9352527157744006
Energy: 1.1421269178621503
Energy: 0.9323475879319303
Energy: 1.179981002847139
Energy: 0.8763420401630361
Energy: 0.8619530904150534
Energy: 1.1815051544626645
Energy: 0.8778285473205714
Energy: 0.9321653576411679
Energy: 1.1773475340951394
Energy: 1.079200707957649
Energy: 1.0563026927445378
Energy: 1.1043791077919214
Energy: 1.0747500669974088
Energy: 1.0474432735989878
Energy: 0.9381674951668334
Energy: 1.0673369457141542
Energy: 0.932354236078056
Energy: 0.9910268953672495
Energy: 1.0673888887472718
Energy: 0.9310252291430159
Energy: 1.1382767827638747
Energy: 1.1417901400290817
Energy: 1.0575344173263501
Energy: 1.139063386383871
Energy: 1.2493314866701877
Energy: 1.0572657088003445
Energy: 1.2182261029080275
Energy: 0.9312195874980516
Energy: 1.0071596698012097
Energy: 1.2195300929205684
Energy: 1.1776538148590912
Energy: 0.9356609989870576
Energy: 1.25042729480055
Energy: 0.9310054127773126
Energy: 0.9310844099605857
Energy: 1.250026454189923
Energy: 0.9301029780807437
Energy: 1.0663740124355332
Energy: 1.2532118354329544
Energy: 1.0669830253895551
Energy: 1.067010024039037
Energy: 1.2451514341126184
Energy: 1.0772188383650836
Energy: 1.0668233681624864
Energy: 0.9817121318876973
Energy: 1.135476931977789
Energy: 0.978347952457665
Energy: 0.9022689044070867
Energy: 1.2491887831007251
Energy: 0.9781535364959888

minimum gb energy = 0.8175613999297572 eV
minimum distance =  2.28954106436966 Angstroms
sigma value = 43


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

Energy: 1.4515903824601102
Energy: 1.0307170912146046
Energy: 0.9247518045762171
Energy: 0.8063195221645827
Energy: 1.0907389836366008
Energy: 0.8496762196868046
Energy: 1.0767718022703072
Energy: 0.9733959163032452
Energy: 0.8422272381852702
Energy: 0.9456399039071492
Energy: 0.9785460058650884
Energy: 0.8573760725597664
Energy: 1.0813646774864667
Energy: 0.8392605176981106
Energy: 0.8878496307200887
Energy: 1.083838956124602
Energy: 0.9352655467555502
Energy: 0.799983775288212
Energy: 0.973986936015782
Energy: 0.8745830306162121
Energy: 0.8455209322655545
Energy: 0.9737659378467827
Energy: 0.9130540219441511
Energy: 0.8783791437401172
Energy: 0.9773162267309282
Energy: 0.8396121315292511
Energy: 0.8796582072570491
Energy: 0.9772214216419864
Energy: 0.9267271354473176
Energy: 0.8965152141443027
Energy: 0.7534491510592016
Energy: 0.839614695002076
Energy: 0.8001606112464057
Energy: 0.8372170814324227
Energy: 0.8395737339220248
Energy: 0.749484883894855
Energy: 0.9918161738132878
Energy: 0.840954529747246
Energy: 0.8408783571062725
Energy: 0.8938137402436931
Energy: 0.8421566760067701
Energy: 0.918447274026469
Energy: 0.9902687838313707
Energy: 0.8346672399417742
Energy: 0.8515196672326908
Energy: 0.9918756000983193
Energy: 0.834961180127597
Energy: 0.7599430684870742
Energy: 0.7777017785588733
Energy: 0.8360525347046572
Energy: 0.774818704480094
Energy: 0.7800630776742373
Energy: 0.9613381329727132
Energy: 0.7750239368200056
Energy: 0.8666814475247923
Energy: 0.8700741933831114
Energy: 0.8430023075498186
Energy: 0.7771405848816281
Energy: 0.7358320633834097
Energy: 0.8373718451926674
Energy: 0.7228623126190405
Energy: 0.7337478319269711
Energy: 0.8162076597312659
Energy: 0.8295474107089883
Energy: 0.7335243569318265
Energy: 0.8543462173006163
Energy: 0.9699726466103735
Energy: 0.7339855070804011
Energy: 0.7355290924380468
Energy: 0.967716252525999
Energy: 0.7340566866495991
Energy: 0.8508401369856807
Energy: 0.9583331156061016
Energy: 0.8289043410832925
Energy: 0.8164379741917168
Energy: 0.9595622179431497
Energy: 0.8258945149000704
Energy: 0.8167722817739242
Energy: 0.7092368686447169
Energy: 0.9643939713482552
Energy: 0.7089703687288392
Energy: 0.7113739550960073
Energy: 0.9644404641490751
Energy: 0.7091010961006413
Energy: 0.7110046882152026
Energy: 0.8234056350165494
Energy: 0.7993343550172077
Energy: 0.7108854307025413
Energy: 0.8507369388027916
Energy: 0.8282576540937562
Energy: 0.8403024971812861
Energy: 0.6989841269168906
Energy: 0.6970609322498958
Energy: 0.9088677191819787
Energy: 0.6966524695532167
Energy: 0.842590659191513
Energy: 0.9623620302161164
Energy: 0.6976033855060945
Energy: 0.6975102263061878
Energy: 0.9624740346754869
Energy: 0.697351164526722
Energy: 0.8644731635632786
Energy: 0.9557421057506955
Energy: 0.8609712123954327
Energy: 0.8024707315643587
Energy: 0.9560489617258463
Energy: 0.8424976573273855
Energy: 0.8411105424976223
Energy: 0.6974679055218059
Energy: 0.8982369130047573
Energy: 0.6974325118816641
Energy: 0.6992126519127879
Energy: 0.9804520933955968
Energy: 0.6972406657749661
Energy: 0.953128637628493
Energy: 0.8732225440461227
Energy: 0.8107960867100409
Energy: 0.9554778937392591
Energy: 0.8732910055587777
Energy: 0.8516452044229198
Energy: 0.9713633821929512
Energy: 0.708755269254537
Energy: 0.7088516615966084
Energy: 0.9714588668244191
Energy: 0.7086049524088255
Energy: 0.8643864449174313
Energy: 0.8332444039757296
Energy: 0.7091738286341466
Energy: 0.7090885277189974
Energy: 0.8389180655050897
Energy: 0.7090620103277999
Energy: 0.8395055936152283
Energy: 0.7384688020046325
Energy: 0.8589635923951816
Energy: 0.8453283569208393
Energy: 0.7383066789723101
Energy: 0.8574899335315345
Energy: 0.8325109345394784
Energy: 0.7338625982227086
Energy: 0.9219006165138042
Energy: 0.733856912286742
Energy: 0.7361804857695599
Energy: 0.9579826668404682
Energy: 0.7339885759620389
Energy: 0.9697770148665782
Energy: 0.833547346604349
Energy: 0.8310168793102187
Energy: 0.9724846119723648
Energy: 0.8307740514494786
Energy: 0.8316990031355727
Energy: 0.9702819408025318
Energy: 0.7754286435069023
Energy: 0.7755333087028208
Energy: 0.9702655764562204
Energy: 0.7753901305368494
Energy: 0.8717753225700988
Energy: 0.738006212189654
Energy: 0.7748564908437516
Energy: 0.774799693168882
Energy: 0.8319487762240834
Energy: 0.7748622332503419
Energy: 0.8641933214386298
Energy: 0.8911283152940903
Energy: 0.835845791860089
Energy: 0.8589447316188576
Energy: 0.8912044293443522
Energy: 0.8834979540229946
Energy: 0.8687871786653729
Energy: 0.8422058702006265
Energy: 0.8541771420653197
Energy: 0.8399151260385398
Energy: 0.844497552639082
Energy: 0.9698123556646571
Energy: 0.8400022491275468
Energy: 1.0262337679309748
Energy: 0.8457684391691479
Energy: 0.8697933718740998
Energy: 1.028177244760004
Energy: 0.845472767461307
Energy: 0.8339328847889755
Energy: 1.0243798475586154
Energy: 0.9442377584601018
Energy: 0.839252554777223
Energy: 0.8435690905985708
Energy: 0.9446880759862266
Energy: 0.9896761367408926
Energy: 0.7806261402844408
Energy: 0.945996921357561
Energy: 0.8401852770130989
Energy: 0.850444693318671
Energy: 0.9457932752804875
Energy: 0.777846614451354
Energy: 0.9906113206774243
Energy: 0.9461422091855107
Energy: 0.9455715908243897
Energy: 0.9905831587001463
Energy: 1.079143544438769
Energy: 0.9323093085955598
Energy: 1.0577106068843138
Energy: 0.9105201639265812
Energy: 0.829545330115982
Energy: 1.0557920498440858
Energy: 0.8450018399728392
Energy: 0.9455182679599856
Energy: 1.079991622026985
Energy: 0.8599731635655035
Energy: 0.8871683450054115
Energy: 1.0825798742735515
Energy: 0.9509009853772191
Energy: 0.8412747576781375
Energy: 1.0433819654762528
Energy: 0.946619686663426
Energy: 0.9462347261882671
Energy: 1.0279748565785307
Energy: 0.9968864995558937
Energy: 0.9696478428922961

minimum gb energy = 0.6966524695532167 eV
minimum distance =  2.28132156393049 Angstroms
sigma value = 81


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

Energy: 0.05220058184701565
Energy: 0.5270598932380417
Energy: 0.05307140969742676
Energy: 0.05505257693608387
Energy: 0.08851145526388231
Energy: 0.05319890233897175
Energy: 0.11017732282496584
Energy: 0.053236241317657994
Energy: 1.162836071404967
Energy: 0.05340616406682312
Energy: 0.05424523760312295
Energy: 0.14122200261816514
Energy: 0.10786540685656884
Energy: 0.05306579965738229
Energy: 0.05294103522045695
Energy: 0.1079037866452725
Energy: 0.05283425908165313
Energy: 0.10934342966188484
Energy: 0.05536060516273965
Energy: 0.052904024663556516
Energy: 0.05297706070018689
Energy: 0.05469265361366801
Energy: 0.053022030833755965
Energy: 0.11027404326000724
Energy: 0.1093917598357296
Energy: 0.10783401787059409
Energy: 0.10824125259841276
Energy: 0.11108541571788262
Energy: 0.56814055677332
Energy: 0.08680767119809367
Energy: 0.05401968170472218
Energy: 0.1411209170302139
Energy: 0.0532036956600387
Energy: 0.05254392314299271
Energy: 0.14122999272742265
Energy: 0.05325647395870322
Energy: 0.10828253995856815
Energy: 0.14285483819516204
Energy: 0.14288083856210812
Energy: 0.1079690266556283
Energy: 0.05467717032744534
Energy: 0.1423682659855351
Energy: 0.10787144544398533
Energy: 0.05285647436522302
Energy: 0.05287573388384482
Energy: 0.10798931583624792
Energy: 0.05271859990992876
Energy: 0.1096990381520187
Energy: 0.054474683506963266
Energy: 0.05302601715215164
Energy: 0.10903342464040791
Energy: 0.05605202550468332
Energy: 0.052955888834325324
Energy: 0.10848482094456045
Energy: 0.052863902040285
Energy: 0.10781722477482049
Energy: 0.10790798791335153
Energy: 0.05309186399503948
Energy: 0.5652979902719576
Energy: 0.10818747441877878

minimum gb energy = 0.05220058184701565 eV
minimum distance =  2.46655061913823 Angstroms
sigma value = 3


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

Energy: 1.0011145558356542
Energy: 1.1401635173325746
Energy: 0.9871807822560213
Energy: 0.9436976160076122
Energy: 1.1578992697708836
Energy: 0.9662120368301756
Energy: 1.040707360380905
Energy: 0.942465392946658
Energy: 0.9401444445380678
Energy: 1.041585645535174
Energy: 1.0426942055502466
Energy: 0.9500606128065948
Energy: 1.0094499877108416
Energy: 0.9221683039757773
Energy: 0.9221945829602047
Energy: 1.0099556456987422
Energy: 0.9224124736684572
Energy: 0.9091328664447339
Energy: 0.9491748582510241
Energy: 0.9209680878741401
Energy: 0.9215531805994295
Energy: 0.9515298984270739
Energy: 0.7907013250377523
Energy: 0.9435273218036513
Energy: 0.7973998832571602
Energy: 0.942760907871908
Energy: 0.9515231723322475
Energy: 0.7972824211486502
Energy: 1.0422601759580348
Energy: 0.9499409712545253
Energy: 0.9701702452788589
Energy: 0.9490727207307466
Energy: 0.9570478228486824
Energy: 0.9098591999964444
Energy: 1.1093394955431812
Energy: 0.8902587204288515
Energy: 0.9043446296274074
Energy: 0.8038973626621357
Energy: 0.8837439365216726
Energy: 0.9042992099621546
Energy: 0.8076349904039828
Energy: 0.9848122678929743
Energy: 0.9492740673092693
Energy: 0.9162645825478181
Energy: 0.9155777945493777
Energy: 0.9481893656369523
Energy: 0.8835539404308821
Energy: 0.8697965473181969
Energy: 0.916067179385656
Energy: 0.9144958361703808
Energy: 0.9334372175116734
Energy: 0.9370522296428213
Energy: 0.7481256345934947
Energy: 0.9335737500627015
Energy: 0.7517870760742733
Energy: 0.8071879610402906
Energy: 0.8080080217560375
Energy: 0.751738975261178
Energy: 0.8362702359815992
Energy: 0.8357176352541348
Energy: 0.7174586037937619
Energy: 0.9222014209863267
Energy: 0.9227287675032418
Energy: 0.8894869265163864
Energy: 0.8940229864028955
Energy: 0.8889465953353578
Energy: 0.7538110580369402
Energy: 0.922204370732561
Energy: 0.9212535065186129
Energy: 0.7540263838928283
Energy: 0.9269380243622191
Energy: 0.7509794765921081
Energy: 0.7758411156304758
Energy: 0.8719153867267607
Energy: 0.8938226667863567
Energy: 0.7757758744241885
Energy: 0.8723755818944003
Energy: 0.7740662269763363
Energy: 0.8781330722029316
Energy: 0.7191801612749705
Energy: 0.8950712149184453
Energy: 0.8934949051181887
Energy: 0.7185023686536459
Energy: 0.897306020448923
Energy: 0.8987888756466316
Energy: 0.7120257271253482
Energy: 0.7124069182754396
Energy: 0.8983703953455341
Energy: 0.7112758109660348
Energy: 0.7133772247420095
Energy: 0.7045920528970442
Energy: 0.8766651077673564
Energy: 0.8768140910918053
Energy: 0.8785402237044269
Energy: 0.8841876001627765
Energy: 0.8755469042667058
Energy: 0.7057029571296622
Energy: 0.8826051043146639
Energy: 0.8862193705844565
Energy: 0.7066506697832929
Energy: 0.9313095504002645
Energy: 0.7033512233378173
Energy: 0.7081132816601505
Energy: 0.8703219482761149
Energy: 0.8840358094907933
Energy: 0.7082561467367613
Energy: 0.8755290698118829
Energy: 0.8720317370333095
Energy: 0.9036714400055567
Energy: 0.8960058492551607
Energy: 0.8848340301452126
Energy: 0.8824900821921254
Energy: 0.8969997541828361
Energy: 0.8844300256483439
Energy: 0.8882792177759441
Energy: 0.7042252917771364
Energy: 0.7038559760373266
Energy: 0.8904909426817097
Energy: 0.706316083100287
Energy: 0.7035846188455277
Energy: 0.880243991356317
Energy: 0.8763517445015487
Energy: 0.8764380561835404
Energy: 0.8796248991864217
Energy: 0.7048824669575823
Energy: 0.8766132468169611
Energy: 0.731388732713463
Energy: 0.8750394386945334
Energy: 0.8031038663906024
Energy: 0.7320867391982581
Energy: 0.7044722733384242
Energy: 0.7312449461706689
Energy: 0.7189537422618769
Energy: 0.8951159950134124
Energy: 0.8943640818853473
Energy: 0.7189076528110969
Energy: 0.893518944044375
Energy: 0.8949076533454077
Energy: 0.959676789544795
Energy: 0.7743350524915459
Energy: 0.77456914306213
Energy: 0.8815795589239707
Energy: 0.7745554090854545
Energy: 0.8792081843458792
Energy: 0.8232429561383993
Energy: 0.7518622418443831
Energy: 0.7515921976587765
Energy: 0.8234975822793524
Energy: 0.754280771637231
Energy: 0.7513961384820502
Energy: 0.893428228367056
Energy: 0.9032295553497044
Energy: 0.902560458653942
Energy: 0.8934839109758097
Energy: 0.877266605971103
Energy: 0.9211115687545892
Energy: 0.8480240528167915
Energy: 0.9025619559274949
Energy: 0.903321946689556
Energy: 0.8500470427535203
Energy: 0.7300625162338601
Energy: 0.8476313207144697
Energy: 0.7701401182084731
Energy: 0.9581038570122797
Energy: 0.9316599888535737
Energy: 0.7702549649696162
Energy: 0.856096893666638
Energy: 0.9322086363882206
Energy: 0.729317831558306
Energy: 0.9476219122019932
Energy: 0.915063482054762
Energy: 0.8952935053575816
Energy: 0.9476824873948677
Energy: 0.8284243384815525
Energy: 0.8068564711231838
Energy: 0.8736026158750368
Energy: 0.8831587638022268
Energy: 0.8037825395911007
Energy: 0.8796294361449309
Energy: 0.9573593090207382
Energy: 0.9156060780501492
Energy: 0.9289907985894992
Energy: 0.9287010348367467
Energy: 0.9160146817034368
Energy: 0.8898452887813517
Energy: 0.9092730851588996
Energy: 1.0115706641650675
Energy: 0.926107673651294
Energy: 0.9295122720560254
Energy: 1.0119165310323257
Energy: 0.7659845876632249
Energy: 0.9492974692150753
Energy: 0.8221151470912347
Energy: 0.9504056102123021
Energy: 0.9500798600994801
Energy: 0.8220736179821413
Energy: 0.9513668984414321
Energy: 0.9226504570098529

minimum gb energy = 0.7033512233378173 eV
minimum distance =  2.27597703080658 Angstroms
sigma value = 67


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

Energy: 1.0163160610692745
Energy: 1.4561235516429982
Energy: 1.204590362416061
Energy: 1.016451392668209
Energy: 1.596178204767315
Energy: 1.2069041258153967
Energy: 1.2096214562938499
Energy: 1.1077298708555112
Energy: 1.103620273813245
Energy: 1.209575116052994
Energy: 1.2131810651198676
Energy: 1.103361304855188
Energy: 1.1460405281325161
Energy: 1.0921002913362299
Energy: 1.1430278916721615
Energy: 1.1466728847547512
Energy: 1.0931923493458489
Energy: 1.1430952735943634
Energy: 1.0536146654313414
Energy: 1.1436609763008152
Energy: 1.1423704117305291
Energy: 1.0543846006888082
Energy: 1.0699704919110538
Energy: 1.1415901399957433
Energy: 1.0085544423301052
Energy: 1.1075371498485584
Energy: 1.1034350330274179
Energy: 1.0086007437202436
Energy: 1.1444114561512513
Energy: 1.1467387206983115
Energy: 1.0647510904005206
Energy: 1.171801945993346
Energy: 1.1202843853400555
Energy: 1.1252949138935766
Energy: 1.1204629164190871
Energy: 1.1171786712094327
Energy: 1.0118511896239413
Energy: 1.0563021087974378
Energy: 1.052545551060565
Energy: 1.0121251705847776
Energy: 1.0201578752784022
Energy: 1.0505453830609859
Energy: 1.0566226034195785
Energy: 1.095017798163108
Energy: 1.0050163027129269
Energy: 1.0550083196402227
Energy: 1.0950978793175479
Energy: 1.066748592915396
Energy: 1.0863234022383725
Energy: 1.1237677435080564
Energy: 1.1234333776318355
Energy: 1.1220433612261014
Energy: 0.9181362293924447
Energy: 1.124865787802581
Energy: 0.8760753551536155
Energy: 0.9359204145076518
Energy: 0.9357723053111121
Energy: 0.8761135873367428
Energy: 0.938833324466118
Energy: 0.9356179702447205
Energy: 0.87956434037281
Energy: 1.0863278431656083
Energy: 1.1063450927772565
Energy: 1.093605821180015
Energy: 1.0972266659450067
Energy: 1.1091732662603966
Energy: 0.8778905550847554
Energy: 1.081803004419187
Energy: 1.0836905948899274
Energy: 0.8762356486638924
Energy: 1.0747184099089788
Energy: 0.8768804259220704
Energy: 0.8804863891134073
Energy: 1.0814082934244384
Energy: 1.089709132620213
Energy: 0.8807047477659262
Energy: 1.0790829831730282
Energy: 0.8800340141881967
Energy: 1.0980262268304026
Energy: 0.9801168473892936
Energy: 1.0791440269746067
Energy: 1.0781933830649941
Energy: 0.9795140022071693
Energy: 1.0783664327364837
Energy: 1.0655740456814777
Energy: 0.8875639548634255
Energy: 0.8819896910685306
Energy: 0.9765907356049245
Energy: 0.8821933189355048
Energy: 0.8819034162635934
Energy: 1.0701333242522084
Energy: 1.0867100408508814
Energy: 1.0895437401768309
Energy: 1.0887714220901974
Energy: 0.8763054946576659
Energy: 1.085932426227519
Energy: 0.9366597102487285
Energy: 1.087837324918631
Energy: 1.096958131757035
Energy: 0.9380135985920328
Energy: 1.0810102226033849
Energy: 0.9350226635168377
Energy: 0.9208808915244997
Energy: 1.1205490204538795
Energy: 1.1244149556083871
Energy: 0.9210415289820725
Energy: 0.9902946651446944
Energy: 1.0479650111346994
Energy: 1.1242852775346759
Energy: 1.1607053740458437
Energy: 1.0437638115762735
Energy: 1.0953216022410805
Energy: 1.1651853135905574
Energy: 1.0931536440014846
Energy: 0.9200060376393664
Energy: 1.0158903458720816
Energy: 1.011670003789793
Energy: 0.9199251166023013
Energy: 1.0140911984899148
Energy: 1.0543571885028034
Energy: 1.0892458003766656
Energy: 1.149680326361494
Energy: 1.1497058693621998
Energy: 1.042498764582298
Energy: 0.882826449374372
Energy: 1.1503131203154278
Energy: 1.1458845483417217
Energy: 1.096426424204794
Energy: 1.150302587495739
Energy: 1.1466420806725073
Energy: 1.0983785593963873
Energy: 1.148828213253644
Energy: 1.0625110014438248
Energy: 1.0164619292853276
Energy: 1.011206989223827
Energy: 1.0625799285065807
Energy: 1.0139824910268984
Energy: 1.1032051567722048

minimum gb energy = 0.8760753551536155 eV
minimum distance =  2.29894065301412 Angstroms
sigma value = 33


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

Energy: 1.670515168152734
Energy: 1.3843390537051523
Energy: 1.4101574102661179
Energy: 1.66422555850057
Energy: 1.3848993513962773
Energy: 1.3069401335401434
Energy: 1.2784655713911677
Energy: 1.2040014377647694
Energy: 1.2009326834903105
Energy: 1.278407700483728
Energy: 1.2817158028610873
Energy: 1.2010715803278542
Energy: 1.2699489776803288
Energy: 1.257289266717171
Energy: 1.2566132769634213
Energy: 1.2701226968624566
Energy: 1.2577562017504773
Energy: 1.2083160672550242
Energy: 1.0879198814457154
Energy: 1.2581478237064176
Energy: 1.2571450532313087
Energy: 1.0890961735545923
Energy: 1.0806665315196016
Energy: 1.2569255032907174
Energy: 1.0813927903024876
Energy: 1.201019605156223
Energy: 1.1997932837419787
Energy: 1.0813511729837402
Energy: 1.281970141828827
Energy: 1.2528984813168988
Energy: 1.1457524050395997
Energy: 1.3366108173359745
Energy: 1.3480873389956682
Energy: 1.2397064245684999
Energy: 1.3368577236398145
Energy: 1.1938382435512385
Energy: 1.0811598257966
Energy: 1.1351869405296857
Energy: 1.266896547429923
Energy: 1.0810855691851775
Energy: 1.114351580484815
Energy: 1.083627323509043
Energy: 1.0875482165730417
Energy: 1.2412956867506502
Energy: 1.242358863977951
Energy: 1.0860289927092364
Energy: 1.2405044657546282
Energy: 1.0855344437835406
Energy: 1.198973758248509
Energy: 1.2332318780387377
Energy: 1.237988086903776
Energy: 1.2223911055312415
Energy: 0.9855115382929698
Energy: 1.2335040005046933
Energy: 1.1947465835180013
Energy: 0.9809122255927923
Energy: 0.9807678455932529
Energy: 1.1969312462321435
Energy: 0.9819526508717168
Energy: 0.9801368224253808
Energy: 1.197514694837079
Energy: 1.1082396083427033
Energy: 1.2047211875189445
Energy: 1.202323424666101
Energy: 1.0674331652432187
Energy: 1.203406008137659
Energy: 0.9781471194621856
Energy: 1.2060386910438223
Energy: 1.21264474555104
Energy: 0.9783682894686455
Energy: 1.1920214357363927
Energy: 0.978897925348756
Energy: 0.9799436855829843
Energy: 1.2358714022028239
Energy: 1.2396925461132884
Energy: 0.9803094887489879
Energy: 1.2021680349072286
Energy: 0.985155824671248
Energy: 0.9526308361684765
Energy: 1.2593398276273506
Energy: 1.2329573016411117
Energy: 1.2083771041128124
Energy: 1.2132910637895735
Energy: 1.206175484775951
Energy: 1.0950603314513818
Energy: 1.0871262635082939
Energy: 1.0819684249303103
Energy: 1.0951072455304565
Energy: 1.0893804009029124
Energy: 1.1393269112519844
Energy: 1.1078133171456814
Energy: 1.265094680019675
Energy: 1.2643191990638187
Energy: 1.1387747005244415
Energy: 1.0125665148681817
Energy: 1.1391791450242108
Energy: 1.2686676931243541
Energy: 1.264908703927722
Energy: 1.2650083789627695
Energy: 1.266022072286611
Energy: 1.2651402902797033
Energy: 1.2197351756883752
Energy: 1.2789414347401804
Energy: 1.2015707349780895
Energy: 1.2003608001389663
Energy: 1.2788907075907296
Energy: 1.0817291603430614
Energy: 1.1901394047411034
Energy: 1.3257481118973202
Energy: 1.2920227635067962
Energy: 1.40726985958259
Energy: 1.3119328522454354
Energy: 1.2935529106803438
Energy: 1.2184910696019178
Energy: 1.148493776421988
Energy: 1.2022332155985755
Energy: 1.2027910948768719
Energy: 1.1484523572205683
Energy: 1.2803029378543642
Energy: 1.201460985319789
Energy: 1.2879323386846484
Energy: 1.257802561592932
Energy: 1.2572091105738554
Energy: 1.2891779708783044
Energy: 1.0778296462708168
Energy: 1.207688633245333
Energy: 1.0876715658367486
Energy: 1.2572059506110873
Energy: 1.256705987422163
Energy: 1.0881385486604935
Energy: 1.258235515875937
Energy: 1.2568294451917323
Energy: 1.0814930636774756
Energy: 1.2012977779047154
Energy: 1.2009700563175454
Energy: 1.0814575602275414
Energy: 1.2820678610354226
Energy: 1.2555089183102341
Energy: 1.538959866290522
Energy: 1.3367528573038179
Energy: 1.3492151647692507
Energy: 1.5390012922618357
Energy: 1.3380860233599217
Energy: 1.186315925658269
Energy: 1.0809090396837757
Energy: 1.2657599175156113
Energy: 1.2669570447445513
Energy: 1.0809495040819945
Energy: 1.1125630133933972
Energy: 1.2675991646066747
Energy: 1.0851821886132045
Energy: 1.2326888871211763
Energy: 1.1382793182665838
Energy: 1.08698283982125
Energy: 1.2329479643897556
Energy: 1.085521800993529
Energy: 1.2204158047898037
Energy: 1.2326968867458143
Energy: 1.2344839964869365
Energy: 1.2221787984654113
Energy: 0.9851343142234193
Energy: 1.23411692347606
Energy: 1.1988215114089762
Energy: 0.9811216206563728
Energy: 0.9785513791695094
Energy: 1.2010480226204305
Energy: 0.9835815009694551
Energy: 0.980011786879229
Energy: 1.0681266256948347
Energy: 1.0675976616143035
Energy: 1.1983819639552438
Energy: 1.2027339836754083
Energy: 1.067731814550982
Energy: 1.2021364377047612
Energy: 0.9782204623378417
Energy: 1.2112089168373827
Energy: 1.2152156746524063
Energy: 0.9784436369766986
Energy: 1.2064374517428902
Energy: 0.9785174551508488
Energy: 0.9798432540250778
Energy: 1.2219929348039635
Energy: 0.9797794955440217
Energy: 0.9801426828199062
Energy: 1.2013603897377432
Energy: 0.9846174457617834
Energy: 0.9523174357880527
Energy: 1.2325362289336732
Energy: 1.2330773857001935
Energy: 1.2078367169615094
Energy: 1.2138433966066284
Energy: 1.2062054188660467
Energy: 1.0960090801404858
Energy: 1.087898114152737
Energy: 1.0873511304447505
Energy: 1.095921494719686
Energy: 1.088373036517842
Energy: 1.1391631258440904
Energy: 1.1096358106550495
Energy: 1.0035853950787241
Energy: 1.1390900434734026
Energy: 1.111243402669391
Energy: 1.009815975522204
Energy: 1.1396456091735807
Energy: 1.2344683639279321
Energy: 1.2672228259491198
Energy: 1.2664378017473072
Energy: 1.2352386973633425
Energy: 1.2069483164692414
Energy: 1.2192907156412678
Energy: 1.281169109037602
Energy: 1.081643039504608
Energy: 1.2028647015749065
Energy: 1.2796434033016035
Energy: 1.0819065279781415
Energy: 1.2009942299662024
Energy: 1.3255004339729968
Energy: 1.211643891218143
Energy: 1.2435362714120883
Energy: 1.2664122921541512
Energy: 1.2115437273210938
Energy: 1.2183226085406478

minimum gb energy = 0.9523174357880527 eV
minimum distance =  2.27238991232931 Angstroms
sigma value = 41


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

Energy: 1.5434583599197738
Energy: 1.5004196777969314
Energy: 1.437617990075993
Energy: 1.5463825335343224
Energy: 1.5039743068223477
Energy: 1.437804919958398
Energy: 1.3590320987822788
Energy: 1.2774771434723182
Energy: 1.3374327322492623
Energy: 1.3592521726118416
Energy: 1.3663116603646568
Energy: 1.3323584608121395
Energy: 1.3593378184371632
Energy: 1.3495059636222395
Energy: 1.3570757042148758
Energy: 1.3600476458301043
Energy: 1.397861569399052
Energy: 1.2726344255517683
Energy: 1.2755281804689946
Energy: 1.397808894268019
Energy: 1.3515781194094205
Energy: 1.276479206593172
Energy: 1.1150595950001465
Energy: 1.2812367401290028
Energy: 1.1160895916791818
Energy: 1.2780256722392491
Energy: 1.2778861245492075
Energy: 1.1159050817852367
Energy: 1.3610974278273542
Energy: 1.2764696929547137
Energy: 1.4409863130136256
Energy: 1.3381631621986032
Energy: 1.366282450418432
Energy: 1.4429001397868464
Energy: 1.4202762630837367
Energy: 1.3682176977159892
Energy: 1.1162298732795723
Energy: 1.3548868545611652
Energy: 1.3988234489366822
Energy: 1.116409365287002
Energy: 1.355279392919614
Energy: 1.117303402572595
Energy: 1.1172837494596828
Energy: 1.3410536127259793
Energy: 1.1167185166570213
Energy: 1.1188094850682408
Energy: 1.342591917796874
Energy: 1.1168660962730612
Energy: 1.3098232478108671
Energy: 1.34130570237552
Energy: 1.3400512295442066
Energy: 1.3425366146865882
Energy: 1.176343756985514
Energy: 1.3428317381189072
Energy: 1.2173968702820603
Energy: 1.1187361716264568
Energy: 1.1171946847780254
Energy: 1.2174715654152042
Energy: 1.1193179844698244
Energy: 1.1177413495778563
Energy: 1.2057469927310844
Energy: 1.1190675051984005
Energy: 1.404363889522935
Energy: 1.2043884665979094
Energy: 1.0573895473056907
Energy: 1.401984171016239
Energy: 1.2613666419473568
Energy: 1.3480097482403468
Energy: 1.262450478562998
Energy: 1.2622854622474864
Energy: 1.347978129298213
Energy: 1.2624371542657957
Energy: 1.2650132413110236
Energy: 1.2772154432966192
Energy: 1.2765091390481313
Energy: 1.2648697463383443
Energy: 1.27715874621598
Energy: 1.3325641120559348
Energy: 1.4817345523367231
Energy: 1.283591063536628
Energy: 1.3587987760621296
Energy: 1.4792707762847916
Energy: 1.2785229547376922
Energy: 1.359899491791406

minimum gb energy = 1.0573895473056907 eV
minimum distance =  2.30822512266856 Angstroms
sigma value = 11


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

Energy: 1.9175184036936084
Energy: 2.112886337957034
Energy: 1.8209284571307256
Energy: 1.9203490615652048
Energy: 2.11420768987904
Energy: 1.5963694242520308
Energy: 1.498232564236668
Energy: 1.212884722538283
Energy: 1.2104024595347802
Energy: 1.4985038916364222
Energy: 1.2409940515330402
Energy: 1.2581496272874633
Energy: 1.5790259171982024
Energy: 1.5193342088171404
Energy: 1.494959867826281
Energy: 1.5758677321794325
Energy: 1.3949215372442907
Energy: 1.497728616308419
Energy: 1.4994306460798803
Energy: 1.1713335386733479
Energy: 1.4023567391899463
Energy: 1.4973020619632063
Energy: 1.1705383609888942
Energy: 1.4221419893786036
Energy: 1.346808980981435
Energy: 1.2119434391236674
Energy: 1.2104526440690557
Energy: 1.3468142112482737
Energy: 1.2401579878588498
Energy: 1.2111989321623529
Energy: 1.4896119520890951
Energy: 1.2367103497123868
Energy: 1.2372705714785845
Energy: 1.4892877476380595
Energy: 1.2360564064717778
Energy: 1.236555528509119
Energy: 1.2359273064971426
Energy: 1.4221513431290722
Energy: 1.237614763443155
Energy: 1.2360423109177556
Energy: 1.4326253959911348
Energy: 1.2372257611107267
Energy: 1.2469540222080382
Energy: 1.366730246829351
Energy: 1.2832175212268646
Energy: 1.2401894914962193
Energy: 1.346342865896006
Energy: 1.2116612441991916
Energy: 1.2018064984816927
Energy: 1.532870965132754
Energy: 1.5053666026578651
Energy: 1.2027814783737478
Energy: 1.5004565583827767
Energy: 1.3843134175861185
Energy: 1.2016497319058643
Energy: 1.5021808774765657
Energy: 1.5016959882583405
Energy: 1.2023124694628389
Energy: 1.5110353819666802
Energy: 1.411935890238669
Energy: 1.2470505346987544
Energy: 1.3432248633619825
Energy: 1.2579351056269596
Energy: 1.2401026225409193
Energy: 1.3273281470704081
Energy: 1.2109461621656956
Energy: 1.512848730829279
Energy: 1.7248609207336125
Energy: 1.7427453383554887
Energy: 1.514300742628337
Energy: 1.4742470674418733
Energy: 1.71949853360839
Energy: 1.2118983072340905
Energy: 1.4221409941682797
Energy: 1.4164469631968055
Energy: 1.2118449536810336
Energy: 1.4665903242652245
Energy: 1.2582530312028342
Energy: 1.6346694404504014
Energy: 1.5125012014963881
Energy: 1.5213353516133183
Energy: 1.4021170609970293
Energy: 1.5767148344797195
Energy: 1.5209020725490479
Energy: 1.1731447692438992
Energy: 1.1745027410031545
Energy: 1.1739281006860782
Energy: 1.1733317411752187
Energy: 1.4136393787273929
Energy: 1.1742103747884247
Energy: 1.1764006350914573
Energy: 1.379451449072641
Energy: 1.1737662114803773
Energy: 1.1745061382418116
Energy: 1.3730442838048205
Energy: 1.1731900902935313
Energy: 1.1719209195888747
Energy: 1.1726829016919889
Energy: 1.1721332869765821
Energy: 1.1718900301879196
Energy: 1.4028140448390745
Energy: 1.1723013294235134
Energy: 1.5468218963816425
Energy: 1.374833755382906
Energy: 1.3516417017022173
Energy: 1.5484823548436255
Energy: 1.3791013274925275
Energy: 1.287972101966154
Energy: 1.2682579069055389
Energy: 1.2912572511624059
Energy: 1.2902552634774558
Energy: 1.2671879384330165
Energy: 1.3605674559960974
Energy: 1.3457543989733376
Energy: 1.341310151633351
Energy: 1.5926759331652411
Energy: 1.5927283876039988
Energy: 1.34321814935869
Energy: 1.4461123419937199
Energy: 1.4269550835672673
Energy: 1.3649583658976585
Energy: 1.1690579594385087
Energy: 1.3775238674394414
Energy: 1.3597819307923416
Energy: 1.168956391175485
Energy: 1.3082548731745964
Energy: 1.2398121868110974
Energy: 1.2701497269692232
Energy: 1.2900138536431143
Energy: 1.2403030488578635
Energy: 1.361661696302861
Energy: 1.3083954710921362
Energy: 1.8192863367354186
Energy: 1.529902480796444
Energy: 1.7246597137971882
Energy: 1.4825848410195852
Energy: 1.5171545985673522
Energy: 1.7373206470055016
Energy: 1.360202722009744
Energy: 1.267597885951258
Energy: 1.3195593965542054
Energy: 1.3591344888066987
Energy: 1.2674564212811399
Energy: 1.3445628513640304
Energy: 1.374224376441538
Energy: 1.365348765680486
Energy: 1.3506858948315892
Energy: 1.375733136054824
Energy: 1.4815869181920214
Energy: 1.3503896377646218
Energy: 1.389138921535384
Energy: 1.1725941190603149
Energy: 1.1720801740556346
Energy: 1.4108086597300027
Energy: 1.1723124138189491
Energy: 1.1719665623127142
Energy: 1.3616876420750277
Energy: 1.1739153515636012
Energy: 1.173477340244849
Energy: 1.3647981174137376
Energy: 1.1739705971245415
Energy: 1.1734822395486182
Energy: 1.4058228542964384
Energy: 1.174277833509374
Energy: 1.1747972031505656
Energy: 1.4026749773864473
Energy: 1.1735716718884541
Energy: 1.1737079451451917
Energy: 1.5763253769207057
Energy: 1.4340028489392145
Energy: 1.4345127985399262
Energy: 1.5766291365489515
Energy: 1.531867090312974
Energy: 1.4348827924648022
Energy: 1.506058873393788
Energy: 1.2124424941781677
Energy: 1.259893903763904
Energy: 1.507845919948769
Energy: 1.2124206412389609
Energy: 1.2577165457978743
Energy: 1.921971746120486
Energy: 1.5355398080288727
Energy: 1.8143232111956724
Energy: 1.5809071123809275
Energy: 1.5290880027406568
Energy: 1.826930649406655

minimum gb energy = 1.168956391175485 eV
minimum distance =  2.25074309233295 Angstroms
sigma value = 57


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

Energy: 1.7098864090745878
Energy: 1.661736805273352
Energy: 1.5271005294461832
Energy: 1.7126018878747589
Energy: 2.0183498517346967
Energy: 1.5318203235387287
Energy: 1.3109924570345572
Energy: 1.1708548604148532
Energy: 1.1451940886662795
Energy: 1.3120596482679292
Energy: 1.279672909450679
Energy: 1.1583364751046845
Energy: 1.3390369388803867
Energy: 1.378289215242679
Energy: 1.3103228379760867
Energy: 1.3411125382925355
Energy: 1.4708506913066848
Energy: 1.3189847113016264
Energy: 1.3030963106466553
Energy: 1.1398637693816747
Energy: 1.1375321518002757
Energy: 1.3049923307509135
Energy: 1.1917236856596194
Energy: 1.137491393130739
Energy: 1.213545043305971
Energy: 1.1580359616386746
Energy: 1.1579177481849385
Energy: 1.2140146332681039
Energy: 1.323608550879237
Energy: 1.139927297506538
Energy: 1.5074942444121762
Energy: 1.3057856549982778
Energy: 1.3258521982982614
Energy: 1.426371703115978
Energy: 1.3051801105104897
Energy: 1.3252914500322621
Energy: 1.3045675221142385
Energy: 1.2926436361173295
Energy: 1.1106268776910826
Energy: 1.3061687785111893
Energy: 1.2957235590259415
Energy: 1.3258188214291418
Energy: 1.2819245507188133
Energy: 1.20571431273802
Energy: 1.1399123021941604
Energy: 1.2798884843400418
Energy: 1.2150697085390036
Energy: 1.1389427642619425
Energy: 1.1051505501103702
Energy: 1.3213716223467993
Energy: 1.519270337766208
Energy: 1.1065107605829105
Energy: 1.3051707698171129
Energy: 1.5144606196993085
Energy: 1.1049353303705516
Energy: 1.3209029652776776
Energy: 1.520395234946819
Energy: 1.1059423403026498
Energy: 1.3442008707123918
Energy: 1.514827043368307
Energy: 1.2817584869153513
Energy: 1.1387909832159775
Energy: 1.1381434564349386
Energy: 1.2806990938023537
Energy: 1.2148621427892365
Energy: 1.138328853924796
Energy: 1.648395775909152
Energy: 1.3799902396583381
Energy: 1.3104381489962211
Energy: 1.649182741130242
Energy: 1.501767336774764
Energy: 1.6717811706511532
Energy: 1.2140467105414119
Energy: 1.1714268602175955
Energy: 1.1602125472687381
Energy: 1.2159418962398891
Energy: 1.3098194639859277
Energy: 1.1572826673089227
Energy: 1.508273125591864
Energy: 1.305319198901367
Energy: 1.3179458826491575
Energy: 1.509976962389993
Energy: 1.3071110735367777
Energy: 1.3185336906777212
Energy: 1.302810417386537
Energy: 1.2017078846682203
Energy: 1.1588858329320764
Energy: 1.303433943665585
Energy: 1.2179849828069031
Energy: 1.159736318001306
Energy: 1.337495741006639
Energy: 1.2179340410415074
Energy: 1.1108638685009018
Energy: 1.3365716636949525
Energy: 1.2185760960579424
Energy: 1.317662755733233
Energy: 1.1045410263173836
Energy: 1.1614436155051315
Energy: 1.1609302927241019
Energy: 1.1047609238337925
Energy: 1.173315005615674
Energy: 1.1577829445819978

minimum gb energy = 1.1045410263173836 eV
minimum distance =  2.30640152715996 Angstroms
sigma value = 9


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

Energy: 2.012497114614714
Energy: 1.9874202828252883
Energy: 1.5509498157721286
Energy: 1.8143645033142866
Energy: 2.223453725655726
Energy: 1.486646947331129
Energy: 1.4556398713451693
Energy: 1.2977156470109517
Energy: 1.2622325999577484
Energy: 1.4567132303542996
Energy: 1.2995001389315892
Energy: 1.2732638934471205
Energy: 1.3094215752128986
Energy: 1.319651570951135
Energy: 1.359403192332528
Energy: 1.3098740358716434
Energy: 1.3020545794612188
Energy: 1.361204806867236
Energy: 1.2782167577226875
Energy: 1.2615925999048874
Energy: 1.2519758808573833
Energy: 1.2791479972025552
Energy: 1.2765180823686963
Energy: 1.2641007337243748
Energy: 1.3230668025276027
Energy: 1.2832122267020818
Energy: 1.2592616921247146
Energy: 1.3249510275243341
Energy: 1.3005226887863108
Energy: 1.329359098266866
Energy: 1.2665395338199974
Energy: 1.237708837825979
Energy: 1.2333100979077845
Energy: 1.267287226717766
Energy: 1.3252478212132772
Energy: 1.233470217401886
Energy: 1.3409916169670184
Energy: 1.3873066020825124
Energy: 1.2502206858610698
Energy: 1.3407164401463882
Energy: 1.4630423733547107
Energy: 1.3702957916552945
Energy: 1.3243358574290829
Energy: 1.2316062661620386
Energy: 1.2344974975603524
Energy: 1.32486481790247
Energy: 1.260331890251003
Energy: 1.2425603005927284
Energy: 1.500488213189175
Energy: 1.2895686228571623
Energy: 1.2750493247871832
Energy: 1.320251762969524
Energy: 1.3088085778742828
Energy: 1.366013949630992
Energy: 1.3926536851669693
Energy: 1.3326962972244487
Energy: 1.3008692173359104
Energy: 1.409786675350191
Energy: 1.3128461604166102
Energy: 1.2583840723818305
Energy: 1.3256176526000196
Energy: 1.2342441175758123
Energy: 1.2390641735012844
Energy: 1.3270599908122371
Energy: 1.318478018103274
Energy: 1.2396179470731306
Energy: 1.297404861927812
Energy: 1.3060650619699665
Energy: 1.2616164338777673
Energy: 1.2986862397397927
Energy: 1.3055154954229724
Energy: 1.265819486899802
Energy: 1.5390154319124565
Energy: 1.3418086865160292
Energy: 1.384795473000734
Energy: 1.271609984347153
Energy: 1.3602682920583749
Energy: 1.4654020242946697
Energy: 1.2857099687373308
Energy: 1.3314923505443832
Energy: 1.3738191469575354
Energy: 1.399243799804151
Energy: 1.4112074613027838
Energy: 1.373816550965792
Energy: 1.407383249218872
Energy: 1.4409112325392528
Energy: 1.2714868927898746
Energy: 1.409655804227669
Energy: 1.3071099895941087
Energy: 1.4310036294387156
Energy: 1.3987910806831867
Energy: 1.664814546226696
Energy: 1.4695202580323292
Energy: 1.4012936496348554
Energy: 1.52816032976478
Energy: 1.4623513427934958
Energy: 1.2815748906450668
Energy: 1.3053221259873562
Energy: 1.2538455540436466
Energy: 1.281672457835821
Energy: 1.4262360564702008
Energy: 1.2976900611191167
Energy: 1.4378132188202033
Energy: 1.3673404379560818
Energy: 1.3508972657700258
Energy: 1.4397238364156624
Energy: 1.360009399626195
Energy: 1.4003762245186242
Energy: 1.3604690176598557
Energy: 1.3059026442015382
Energy: 1.2633774730607952
Energy: 1.3604879544858186
Energy: 1.3673603570275816
Energy: 1.3435657347304861
Energy: 1.2803816914816593
Energy: 1.3073941563738416
Energy: 1.2927488141916692
Energy: 1.2803004222443621
Energy: 1.3063258827415507
Energy: 1.353446565860021
Energy: 1.2871020765280161
Energy: 1.2971633469033799
Energy: 1.3007337597949529
Energy: 1.2866577840608406
Energy: 1.2874315389209479
Energy: 1.2642702497625833

minimum gb energy = 1.2316062661620386 eV
minimum distance =  2.27866305365257 Angstroms
sigma value = 27


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

Energy: 1.38517161926141
Energy: 1.4984834511768503
Energy: 1.3630951527627326
Energy: 1.3772871463743726
Energy: 1.8681731122740144
Energy: 1.3688359663549186
Energy: 1.414485042672933
Energy: 1.4018566053978019
Energy: 1.40375497722098
Energy: 1.414397516473698
Energy: 1.5056267620585895
Energy: 1.4333802167848024
Energy: 1.2800263216120094
Energy: 1.2943123633978715
Energy: 1.2912209234965315
Energy: 1.2802876104927063
Energy: 1.258715109129381
Energy: 1.2793302677631493
Energy: 1.3078716469054765
Energy: 1.3044150993080725
Energy: 1.300338132748344
Energy: 1.3094369619276434
Energy: 1.3857635087085192
Energy: 1.294116335137439
Energy: 1.3091583179247084
Energy: 1.4081634883268745
Energy: 1.3862457796674548
Energy: 1.3108915899576616
Energy: 1.3553365902641346
Energy: 1.405533589311489
Energy: 1.3150093730863677
Energy: 1.2931016012715786
Energy: 1.3022113167969984
Energy: 1.3158109308916923
Energy: 1.2776531727096516
Energy: 1.3029065609725843
Energy: 1.283473372652719
Energy: 1.2308543349740557
Energy: 1.2243481333908048
Energy: 1.2850059587610352
Energy: 1.1930137605748392
Energy: 1.2215200935748807
Energy: 1.2956725509612859
Energy: 1.266485597980042
Energy: 1.3309999342212517
Energy: 1.2957964189199558
Energy: 1.249057282661746
Energy: 1.300628060676401
Energy: 1.3843644247902198
Energy: 1.270439807509423
Energy: 1.2714220617185394
Energy: 1.3251406118565103
Energy: 1.2654509543263663
Energy: 1.290956334601822
Energy: 1.3561555087886836
Energy: 1.3054575001253161
Energy: 1.3291511682473738
Energy: 1.3073872349998608
Energy: 1.3302816806028654
Energy: 1.324808955999167
Energy: 1.2524751710520685
Energy: 1.294992751902563
Energy: 1.3234479621253277
Energy: 1.2526400104968598
Energy: 1.3186670234679785
Energy: 1.2779300282989532
Energy: 1.2937075661631676
Energy: 1.3175241293727422
Energy: 1.3204917320592755
Energy: 1.3054958105008743
Energy: 1.3270559543028246
Energy: 1.3185002465534272
Energy: 1.1887167634006162
Energy: 1.3208011549408158
Energy: 1.2225547420639806
Energy: 1.1895750252011137
Energy: 1.3233286816396819
Energy: 1.2203343741801898
Energy: 1.1901057158167438
Energy: 1.3280926271333264
Energy: 1.32824190593205
Energy: 1.2220889882161816
Energy: 1.3201323570689822
Energy: 1.220775768369889
Energy: 1.2538792361749875
Energy: 1.3512141213508893
Energy: 1.3480121079592782
Energy: 1.2550279183953197
Energy: 1.3564574150550515
Energy: 1.3119580380921574
Energy: 1.3878620731627918
Energy: 1.3372332225592372
Energy: 1.336735783085232
Energy: 1.388769551544282
Energy: 1.3402791424523641
Energy: 1.336483890479001
Energy: 1.306097233190604
Energy: 1.3962275470192411
Energy: 1.340409025271169
Energy: 1.3066409721284424
Energy: 1.3995925083573457
Energy: 1.3436299714452586
Energy: 1.3252035486967637
Energy: 1.30108107538761
Energy: 1.2978377313836034
Energy: 1.321880219983385
Energy: 1.331689299106049
Energy: 1.300618272049333
Energy: 1.29496072848113
Energy: 1.2226101221347079
Energy: 1.2209795815756512
Energy: 1.2949862478379122
Energy: 1.1900122353646487
Energy: 1.219855217949025
Energy: 1.2873447636573143
Energy: 1.2221582344309243
Energy: 1.2210435679920715
Energy: 1.2862113697148851
Energy: 1.1904750729978464
Energy: 1.2198009437184538
Energy: 1.425545205804649
Energy: 1.2999204210181776
Energy: 1.2923881181359276
Energy: 1.4263071201158593
Energy: 1.3018719159137984
Energy: 1.3010149483432008
Energy: 1.2559073419498952
Energy: 1.410733884726355
Energy: 1.4030609703562311
Energy: 1.2742487642738378
Energy: 1.4145644769584071
Energy: 1.4017767624907622
Energy: 1.427068037580818
Energy: 1.2993480585453347
Energy: 1.2989157005560452
Energy: 1.4283672774337817
Energy: 1.2901501014745969
Energy: 1.2990569703168002
Energy: 1.3426265670576103
Energy: 1.3021138972014898
Energy: 1.3012314066466566
Energy: 1.3437470277091008
Energy: 1.289341941266922
Energy: 1.3007617664891526
Energy: 1.386152183746005
Energy: 1.4035981859555227
Energy: 1.4020163297574149
Energy: 1.3772147106853927
Energy: 1.3869801950345362
Energy: 1.359050661141461

minimum gb energy = 1.1887167634006162 eV
minimum distance =  2.30712903075685 Angstroms
sigma value = 19


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

Energy: 1.9088796811373872
Energy: 1.64350935156464
Energy: 1.359724234255793
Energy: 1.3385374667136514
Energy: 2.0553841210174224
Energy: 1.4391106630016686
Energy: 1.493839028965582
Energy: 1.3182656050643464
Energy: 1.3331799602924799
Energy: 1.4941347085636445
Energy: 1.3542723663252558
Energy: 1.3332389412210472
Energy: 1.309115364978772
Energy: 1.4272124059564337
Energy: 1.4252056431149096
Energy: 1.3100699268176113
Energy: 1.4299820544515238
Energy: 1.4254472455254663
Energy: 1.3221618113985187
Energy: 1.3339099585264977
Energy: 1.3245622882291863
Energy: 1.3224022624115621
Energy: 1.3286853838139538
Energy: 1.325308160519704
Energy: 1.2688918851751334
Energy: 1.3070394798433245
Energy: 1.3911800703136643
Energy: 1.2714560777272341
Energy: 1.309343054599209
Energy: 1.415108863488683
Energy: 1.3525987432714333
Energy: 1.307930674885307
Energy: 1.3925717600598702
Energy: 1.3529920947982956
Energy: 1.5346993934155402
Energy: 1.3882121928131028
Energy: 1.770713507405095
Energy: 1.4012853899391111
Energy: 1.5238115025683616
Energy: 1.6512604518698983
Energy: 1.4601707647442326
Energy: 1.5404347679536714
Energy: 1.418732961517741
Energy: 1.3277746195150393
Energy: 1.4549208750936067
Energy: 1.4212951589005902
Energy: 1.3267308910341546
Energy: 1.4414477852526009
Energy: 1.252071322330978
Energy: 1.3013276818086357
Energy: 1.327362659761457
Energy: 1.2514746600363251
Energy: 1.3093061944447013
Energy: 1.3287688283980446
Energy: 1.2869410355966908
Energy: 1.3312003640292087
Energy: 1.3330812174449949
Energy: 1.3461155467502897
Energy: 1.3375306415495398
Energy: 1.3320589449247786
Energy: 1.3724448451027518
Energy: 1.5192738268344126
Energy: 1.426703909677231
Energy: 1.3729812094941376
Energy: 1.5159809112337392
Energy: 1.4327583925169118
Energy: 1.3981343050032171
Energy: 1.3214966922808233
Energy: 1.3211370435377638
Energy: 1.398589792031436
Energy: 1.3511789909593497
Energy: 1.3210506929763914
Energy: 1.5561168175100526
Energy: 1.482745778035825
Energy: 1.3729592249315157
Energy: 1.4231362458146672
Energy: 1.482693399322417
Energy: 1.4571804938873885
Energy: 1.4256201381772222
Energy: 1.322478123038766
Energy: 1.3253251827261208
Energy: 1.3446836994106937
Energy: 1.305046939443482
Energy: 1.3278258131833733
Energy: 1.2737034353324794
Energy: 1.227986377254107
Energy: 1.3069110290096468
Energy: 1.2730972710373287
Energy: 1.227744444817407
Energy: 1.3122774955937615
Energy: 1.3655745156539048
Energy: 1.319154177958578
Energy: 1.3154803603851186
Energy: 1.3656775005602428
Energy: 1.2517558817697934
Energy: 1.3154553268322533
Energy: 1.5516293381919164
Energy: 1.4573965177883839
Energy: 1.3237860290933663
Energy: 1.5088624611515868
Energy: 1.6269973480516942
Energy: 1.3363132748169217
Energy: 1.2995373702971718
Energy: 1.2917915385562893
Energy: 1.3152529269114714
Energy: 1.2999487202819684
Energy: 1.312600422154193
Energy: 1.3157336478362545
Energy: 1.3129115061731607
Energy: 1.300164760756539
Energy: 1.3313156853014283
Energy: 1.306325739597825
Energy: 1.4255791745472999
Energy: 1.312197442545701
Energy: 1.325552251359844
Energy: 1.3214385506635788
Energy: 1.3631245645806125
Energy: 1.326623128746294
Energy: 1.2968655560362417
Energy: 1.313838235870073
Energy: 1.2276344135918966
Energy: 1.3154638049440959
Energy: 1.3165686705334843
Energy: 1.2271782638516457
Energy: 1.273504825990543
Energy: 1.3176523782377287
Energy: 1.2573924638226175
Energy: 1.3205446103237681
Energy: 1.321529466020434
Energy: 1.257238821134381
Energy: 1.2738689905645477
Energy: 1.322010398136983
Energy: 1.512435932116853
Energy: 1.3340599026253057
Energy: 1.3336445671903145
Energy: 1.5119481639140502
Energy: 1.3387170174497185
Energy: 1.54823651027836
Energy: 1.3111029017769662
Energy: 1.2851622472431616
Energy: 1.3164212999702105
Energy: 1.3115315297074674
Energy: 1.2538540217317828
Energy: 1.31314065967183
Energy: 1.2885461962694558
Energy: 1.2744214517878876
Energy: 1.3209343374279514
Energy: 1.2884395178291121
Energy: 1.2734755652465861
Energy: 1.317182113645513
Energy: 1.410502499898597
Energy: 1.4029431980122535
Energy: 1.3344897880297613
Energy: 1.4126360333512222
Energy: 1.4018476733556933
Energy: 1.3351677349833249
Energy: 1.3177553705225922
Energy: 1.3363343389074105
Energy: 1.3278990698415103
Energy: 1.3179989196119777
Energy: 1.2532109717302389
Energy: 1.3282326853499364
Energy: 1.3083011040413983
Energy: 1.3212016975899128
Energy: 1.3217572978646013
Energy: 1.3086090806020798
Energy: 1.2902695905737303
Energy: 1.3275581099755047
Energy: 1.4601858600598008
Energy: 1.4952835665381847
Energy: 1.5125511315496394
Energy: 1.2358568947671207
Energy: 1.4950872930241936
Energy: 1.345298036763984

minimum gb energy = 1.2271782638516457 eV
minimum distance =  2.27666842253673 Angstroms
sigma value = 101


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

Energy: 1.7214423191955188
Energy: 1.521805255472143
Energy: 1.3132166378640133
Energy: 1.6381198747980485
Energy: 1.5215332060675617
Energy: 1.5013559930984492
Energy: 1.4539424780088515
Energy: 1.310079119568026
Energy: 1.325618268977561
Energy: 1.4553514842103445
Energy: 1.295176430189122
Energy: 1.3271394243994827
Energy: 1.41525952108092
Energy: 1.4409431665958627
Energy: 1.4259914972076821
Energy: 1.4163250809720012
Energy: 1.4381663444951713
Energy: 1.4272516002254512
Energy: 1.2961567181620945
Energy: 1.333352331827685
Energy: 1.3394304041884375
Energy: 1.2960324232992448
Energy: 1.3189283938775016
Energy: 1.3199917102108687
Energy: 1.2218755760620361
Energy: 1.4121525725236102
Energy: 1.424985252858274
Energy: 1.2247898422206782
Energy: 1.4179798361834177
Energy: 1.3213794170465176
Energy: 1.3137048701098575
Energy: 1.3743349312598452
Energy: 1.3355722319246828
Energy: 1.3143682699532948
Energy: 1.3991348068842664
Energy: 1.3317635284551954
Energy: 1.2953200901953306
Energy: 1.4810074299603329
Energy: 1.407571392792923
Energy: 1.2962065365930953
Energy: 1.4860023127770603
Energy: 1.4140302532149007
Energy: 1.3528603933754164
Energy: 1.3203720841843438
Energy: 1.3213244674464535
Energy: 1.352313543398949
Energy: 1.3210322064886786
Energy: 1.3205639623763956
Energy: 1.2033612452783713
Energy: 1.2985811930051812
Energy: 1.3251698054278325
Energy: 1.2004639818346206
Energy: 1.3047250041129188
Energy: 1.2553704305073197
Energy: 1.2000380414521266
Energy: 1.3225408768843694
Energy: 1.3220687814703662
Energy: 1.2006778166506544
Energy: 1.310108915318097
Energy: 1.3224001058373716
Energy: 1.4113618239094212
Energy: 1.6404077431020214
Energy: 1.5051131756861618
Energy: 1.4136167781767681
Energy: 1.6436405450100144
Energy: 1.5137304900239932
Energy: 1.3173045910759718
Energy: 1.3239079750099887
Energy: 1.3269298126982565
Energy: 1.3166801163528226
Energy: 1.2644624827929287
Energy: 1.3280654648191101
Energy: 1.4723730531932868
Energy: 1.3872948976849357
Energy: 1.2717558353443195
Energy: 1.4319780667521873
Energy: 1.3871303945425852
Energy: 1.3204104385013684
Energy: 1.231240183394796
Energy: 1.3244315767762105
Energy: 1.3235088904888108
Energy: 1.2327465837738014
Energy: 1.3228766642184155
Energy: 1.3253460189398092
Energy: 1.3041739264450711
Energy: 1.2020932196896217
Energy: 1.2559843715884862
Energy: 1.3060466583809647
Energy: 1.2048902880067598
Energy: 1.267746952210216
Energy: 1.304621055434936
Energy: 1.257970778405132
Energy: 1.3399115752334496
Energy: 1.3048957567664905
Energy: 1.2534803348877603
Energy: 1.3191159536865045
Energy: 1.7222098721236212
Energy: 1.3051931205529976
Energy: 1.3127614289235932
Energy: 1.6342015805661454
Energy: 1.3621657717912663
Energy: 1.501589485810936
Energy: 1.3262824371102406
Energy: 1.294396965554784
Energy: 1.3120759222481981
Energy: 1.3276065622894702
Energy: 1.2948787414692466
Energy: 1.3214192652041326
Energy: 1.4148299578810477
Energy: 1.5095952947927214
Energy: 1.3201364793797015
Energy: 1.415378557362143
Energy: 1.4524876987677067
Energy: 1.318203720549412
Energy: 1.321546302712677
Energy: 1.3204026318709385
Energy: 1.3214409666645395
Energy: 1.3221262763088524
Energy: 1.2595795770077594
Energy: 1.31989363631043
Energy: 1.2262104644012823
Energy: 1.430265194287567
Energy: 1.44785478772062
Energy: 1.2238305483425664
Energy: 1.447645480643704
Energy: 1.3213769402559543
Energy: 1.2890185543973096
Energy: 1.3507585668629836
Energy: 1.3175526101738704
Energy: 1.2908026727500757
Energy: 1.4031771670629487
Energy: 1.3178528109037668
Energy: 1.5167768644044326
Energy: 1.5383236444358102
Energy: 1.503552541142574
Energy: 1.5218846754145117
Energy: 1.4971961229647692
Energy: 1.4941275521256558
Energy: 1.4944244299207787
Energy: 1.3203212486481999
Energy: 1.3195792998192057
Energy: 1.5033789829286057
Energy: 1.2617683326400246
Energy: 1.5142034155850177
Energy: 1.2004245099582478
Energy: 1.3217989369874905
Energy: 1.3207650895072318
Energy: 1.2006765910110662
Energy: 1.3037275914425492
Energy: 1.2591469199853598
Energy: 1.2027368864749584
Energy: 1.3257922844137684
Energy: 1.3251944844738568
Energy: 1.2040614300665915
Energy: 1.3038551193262506
Energy: 1.3266168491319614
Energy: 1.5109613701964761
Energy: 1.6247522724610808
Energy: 1.6077302596323884
Energy: 1.5179553334235978
Energy: 1.6678863111636997
Energy: 1.5930336533062543
Energy: 1.3200604583329807
Energy: 1.1738240453704198
Energy: 1.311949215035625
Energy: 1.3214752977475455
Energy: 1.1733138697455996
Energy: 1.32207464280949
Energy: 1.2317739004007735
Energy: 1.2781968601069424
Energy: 1.3210576945950734
Energy: 1.4468324724207902
Energy: 1.280253126979838
Energy: 1.3223891996984487
Energy: 1.472303615726196
Energy: 1.3372537220440122
Energy: 1.2777653411880423
Energy: 1.4538251126477164
Energy: 1.3232164654062712
Energy: 1.309002975948931
Energy: 1.3035160801973822
Energy: 1.202753265478974
Energy: 1.2654935830430958
Energy: 1.3036800562927253
Energy: 1.2016616331190704
Energy: 1.3224133763665151
Energy: 1.3029578276042277
Energy: 1.258257644929648
Energy: 1.2602309370239984
Energy: 1.30315193238053
Energy: 1.2536141388945126
Energy: 1.3209152328844942
Energy: 1.4830930509124571
Energy: 1.285477194605531
Energy: 1.171692736870131
Energy: 1.6667856873406026
Energy: 1.2854807403151052
Energy: 1.1730284603430803

minimum gb energy = 1.171692736870131 eV
minimum distance =  2.27947068955579 Angstroms
sigma value = 33


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

Energy: 0.02046603085564116
Energy: 0.8612402051558499
Energy: 0.02123230258390649
Energy: 0.023075625353569974
Energy: 0.8635686186752213
Energy: 0.02103571093849516
Energy: 0.7100695466029772
Energy: 0.17664726369257194
Energy: 0.1740250561052328
Energy: 0.17420502657928363
Energy: 0.17400150266779216
Energy: 0.17364086153947933
Energy: 1.3974332231624684
Energy: 0.8642812241240018
Energy: 0.8618296557012056
Energy: 0.8597131959366884
Energy: 0.8631441013473521
Energy: 0.8617979135701475
Energy: 0.021235367189851327
Energy: 0.17664726369257194
Energy: 0.1740250561047654
Energy: 0.17420502657928363
Energy: 0.17400150266779216
Energy: 0.17364086153901193

minimum gb energy = 0.02046603085564116 eV
minimum distance =  2.45809767866562 Angstroms
sigma value = 1