Model name: model_name=EAM_Dynamo_BelandLuOsetskiy_2016_CoNi__MO_871937946490_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.520013511180878
cohesive_energy=4.422209022875811
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -0.0272614017519761 eV

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

Energy: 0.018046687865143
Energy: 0.018551869125379695
Energy: 1.1744797356693797
Energy: 0.018551869125379695
Energy: 0.018551869125379695
Energy: 1.294581779452829
Energy: 0.01855186912600447
Energy: 1.294581779452829
Energy: 1.1744797356700414
Energy: 0.018551869125379695
Energy: 0.018046687865143
Energy: 0.018551869125379695
Energy: 0.018551869125379695
Energy: 1.2945817794534904
Energy: 0.018551869125379695
Energy: 1.2945817794541152

minimum gb energy = 0.018046687865143 eV
minimum distance =  2.46558056531417 Angstroms
sigma value = 1


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

Energy: 1.3995092432916578
Energy: 1.442234385765417
Energy: 1.271136712952977
Energy: 1.4422343857646147
Energy: 1.3117086824985604
Energy: 1.3962202504114765
Energy: 1.3166695333451301
Energy: 1.3962202504106742
Energy: 1.248182651639672
Energy: 1.425732906919576
Energy: 1.2908338883595831
Energy: 1.4257329069211808
Energy: 1.2784800231888618
Energy: 1.3491907032982946
Energy: 1.2794556790351606
Energy: 1.3491907032974924
Energy: 1.281945484242393
Energy: 1.4478842719873004
Energy: 1.3129762554252198
Energy: 1.4478842719856957
Energy: 1.2515411625386874
Energy: 1.4102447236880966
Energy: 1.2399393155352565
Energy: 1.410244723686492
Energy: 1.312923450920545
Energy: 1.4214176062240136
Energy: 1.2534945775913835
Energy: 1.4214176062232113
Energy: 1.1753110974594316
Energy: 1.4492430653907142
Energy: 1.212936558711651
Energy: 1.4492430653883073
Energy: 1.2792843144929837
Energy: 1.5988578637394117
Energy: 1.3171435467595414
Energy: 1.5988578637378073
Energy: 1.2234989912070506
Energy: 1.4244023044298229
Energy: 1.1587729348643614
Energy: 1.4244023044298229
Energy: 1.3097233257496428
Energy: 1.3954252121282933
Energy: 1.2795778469361219
Energy: 1.3954252121258863
Energy: 1.2651844336883835
Energy: 1.4483920552465348
Energy: 1.246597415731479
Energy: 1.4483920552441278
Energy: 1.3147960111465777
Energy: 1.419502667011603
Energy: 1.312986159251453
Energy: 1.419502667011603
Energy: 1.2941991628361256
Energy: 1.4279417672571852
Energy: 1.2589087020729746
Energy: 1.427941767255581
Energy: 1.293492077012974
Energy: 1.442919177079404
Energy: 1.2910211389872261
Energy: 1.442919177079404
Energy: 1.2918637356837166
Energy: 1.4426578443917815
Energy: 1.310529985115934
Energy: 1.4426578443909794
Energy: 1.2912863011155746
Energy: 1.425921387011939
Energy: 1.204602628080175
Energy: 1.4259213870103342
Energy: 1.3166166599079572
Energy: 1.3783863452580896
Energy: 1.3119224921060302
Energy: 1.3783863452588918
Energy: 1.230938572901693
Energy: 1.4481514120369108
Energy: 1.2450858348631995
Energy: 1.448151412037713
Energy: 1.3350632745223487
Energy: 1.2961037020025055
Energy: 1.2823628601321166
Energy: 1.2961037020025055
Energy: 1.2279888945277382
Energy: 1.4256915370093461
Energy: 1.1745607112970866
Energy: 1.4256915370093461
Energy: 1.2795214437776392
Energy: 1.3032431991278877
Energy: 1.2931512174603375
Energy: 1.3032431991286901
Energy: 1.2923805903928711
Energy: 1.4477813861996378
Energy: 1.227814543516639
Energy: 1.4477813862004403
Energy: 1.2696210767371356
Energy: 1.4212446428638599
Energy: 1.251761515387188
Energy: 1.4212446428630576
Energy: 1.2536215698505604
Energy: 1.3999312790604646
Energy: 1.3156351400327289
Energy: 1.3999312790604646
Energy: 1.2808211429563319
Energy: 1.449027961527351
Energy: 1.2444813139847788
Energy: 1.4490279615265487
Energy: 1.3024791807138143
Energy: 1.3734868133928257
Energy: 1.279231828529557
Energy: 1.3734868133952323
Energy: 1.2341414422812635
Energy: 1.4215707778811326
Energy: 1.3677864145119174
Energy: 1.4215707778811326
Energy: 1.3106005306140276
Energy: 1.3661428425892927
Energy: 1.291386370760284
Energy: 1.3661428425892927
Energy: 1.317827072845119
Energy: 1.4438963949073342
Energy: 1.2706071974377793
Energy: 1.4438963949081365
Energy: 1.3058200002945093
Energy: 1.427332433548878
Energy: 1.314867767441379
Energy: 1.427332433546471
Energy: 1.2705243837931417
Energy: 1.4210894133082836
Energy: 1.2948332423056037
Energy: 1.4210894133098884
Energy: 1.2818135975140905
Energy: 1.4542655037590118
Energy: 1.2816585360178094
Energy: 1.4542655037590118

minimum gb energy = 1.1587729348643614 eV
minimum distance =  2.18808531370407 Angstroms
sigma value = 1


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

Energy: 1.4834892901169163
Energy: 1.5368365831697242
Energy: 1.3565437088101449
Energy: 1.5368365831715536
Energy: 1.3549789818815474
Energy: 1.4705716114448593
Energy: 1.371093976127225
Energy: 1.4705716114412002
Energy: 1.2962122075269615
Energy: 1.538894401651271
Energy: 1.3485117621809155
Energy: 1.5388944016549297
Energy: 1.3104796007023425
Energy: 1.3336134238443844
Energy: 1.3024033637297778
Energy: 1.3336134238434696
Energy: 1.310565062319839
Energy: 1.5050500976999344
Energy: 1.3570135322034296
Energy: 1.5050500977017638
Energy: 1.370780929508124
Energy: 1.5052602670555457
Energy: 1.316642799612029
Energy: 1.5052602670610344
Energy: 1.347554061698276
Energy: 1.3344132389372694
Energy: 1.3207410014484913
Energy: 1.3344132389372694
Energy: 1.2103505909048813
Energy: 1.5393794410123849
Energy: 1.2845994638603884
Energy: 1.5393794410132997
Energy: 1.3246966370497424
Energy: 1.3743737647588024
Energy: 1.3939924328654159
Energy: 1.3743737647615466
Energy: 1.2942217339667061
Energy: 1.5389891042474209
Energy: 1.2945376263821486
Energy: 1.5389891042455912
Energy: 1.3473530044331947
Energy: 1.4464804438293732
Energy: 1.3711529583978443
Energy: 1.446480443830288
Energy: 1.2682570644370295
Energy: 1.5205530457349987
Energy: 1.3473256135249503
Energy: 1.5205530457322547
Energy: 1.3681922332931942
Energy: 1.500690374857044
Energy: 1.344901520027386
Energy: 1.5006903748542997
Energy: 1.3681661866320138
Energy: 1.5007494200296296
Energy: 1.3265013060826647
Energy: 1.5007494200323739
Energy: 1.2681351888291172
Energy: 1.5205784798259772
Energy: 1.3543263549986855
Energy: 1.520578479823233
Energy: 1.3473503114252934
Energy: 1.4465814058699693
Energy: 1.3709645571789573
Energy: 1.4465814058736282
Energy: 1.2942025061567597
Energy: 1.5389576060497614
Energy: 1.2225914371626967
Energy: 1.5389576060543348
Energy: 1.3247028696400327
Energy: 1.3745435551660627
Energy: 1.3940390901119175
Energy: 1.3745435551678922
Energy: 1.2103305947669447
Energy: 1.5393436351137406
Energy: 1.269503501536872
Energy: 1.5393436351119114
Energy: 1.3475481182113298
Energy: 1.334320663482381
Energy: 1.3024895988815406
Energy: 1.3343206634851252
Energy: 1.3708549850478222
Energy: 1.5053262406804018
Energy: 1.2534661109901062
Energy: 1.5053262406739985
Energy: 1.310426829538664
Energy: 1.5052391931111821
Energy: 1.351655886976007
Energy: 1.5052391931166706
Energy: 1.3104277002187865
Energy: 1.3335570520177347
Energy: 1.2933711527102392
Energy: 1.3335570520223083
Energy: 1.2963474340254353
Energy: 1.5389103043893368
Energy: 1.348576184024758
Energy: 1.5389103043875076
Energy: 1.3550686724589034
Energy: 1.4705474688122855
Energy: 1.371061144688558
Energy: 1.4705474688122855
Energy: 1.4834892901169163
Energy: 1.5368365831697242
Energy: 1.328799182362863
Energy: 1.5368365831715536
Energy: 1.3549789818824622
Energy: 1.4705716114448593
Energy: 1.3710939761263101
Energy: 1.4705716114412002
Energy: 1.2962122075251319
Energy: 1.538894401651271
Energy: 1.3472878428672153
Energy: 1.5388944016549297
Energy: 1.3104796007023425
Energy: 1.3336134238434696
Energy: 1.301484190594592
Energy: 1.3336134238425548

minimum gb energy = 1.2103305947669447 eV
minimum distance =  2.15795842383895 Angstroms
sigma value = 25


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

Energy: 1.4308912190326866
Energy: 1.6045590520024746
Energy: 1.440363514109769
Energy: 1.604559052003538
Energy: 1.449917902008099
Energy: 1.499372440560305
Energy: 1.3976017681417063
Energy: 1.499372440560305
Energy: 1.3686977610784985
Energy: 1.6624553947331213
Energy: 1.3977367658683584
Energy: 1.6624553947320577
Energy: 1.3610316255868695
Energy: 1.4163325392902064
Energy: 1.3574284519651052
Energy: 1.4163325392902064
Energy: 1.3578355260271358
Energy: 1.6048593114514753
Energy: 1.4198797415729054
Energy: 1.6048593114504117
Energy: 1.4590190180498273
Energy: 1.6607696110517878
Energy: 1.4457881826250323
Energy: 1.6607696110517878
Energy: 1.4454220615207025
Energy: 1.3963316741840706
Energy: 1.4086768484075423
Energy: 1.3963316741840706
Energy: 1.4804986289746658
Energy: 1.6115685240926467
Energy: 1.3030866156835126
Energy: 1.6115685240937103
Energy: 1.4086024797060697
Energy: 1.517930950216557
Energy: 1.4453524248443752
Energy: 1.5179309502154936
Energy: 1.3841003593975263
Energy: 1.6611323313507467
Energy: 1.3394773654778107
Energy: 1.6611323313507467
Energy: 1.4191547010616972
Energy: 1.601824269679759
Energy: 1.4067695642110443
Energy: 1.6018242696808227
Energy: 1.3986713845870324
Energy: 1.604050680570878
Energy: 1.4068683344672
Energy: 1.6040506805698145
Energy: 1.3840963206639076
Energy: 1.5364122341987243
Energy: 1.3392352144019093
Energy: 1.5364122341997877
Energy: 1.407436090864727
Energy: 1.4780669350400688
Energy: 1.4457805918207056
Energy: 1.4780669350390052
Energy: 1.363872869251473
Energy: 1.6130875074932982
Energy: 1.3013679159004818
Energy: 1.6130875074922348
Energy: 1.4447748962789837
Energy: 1.3981415945945734
Energy: 1.3576282224724199
Energy: 1.3981415945935098
Energy: 1.2666534532078024
Energy: 1.662622050548866
Energy: 1.2667326275337303
Energy: 1.6626220505499296
Energy: 1.3571551802494566
Energy: 1.5374320764846685
Energy: 1.4203670831838948
Energy: 1.5374320764857319
Energy: 1.3607866770270287
Energy: 1.5417566741178403
Energy: 1.358090070333539
Energy: 1.5417566741178403
Energy: 1.446062884949934
Energy: 1.660475655119095
Energy: 1.3990507597207942
Energy: 1.660475655119095
Energy: 1.4158054849528738
Energy: 1.5024456245429412
Energy: 1.3995083696409427
Energy: 1.5024456245418778
Energy: 1.4331217218915928
Energy: 1.6051656935975258
Energy: 1.4330918920831608
Energy: 1.6051656935964622
Energy: 1.4495378833456063
Energy: 1.5374229957326415
Energy: 1.4069789200389107
Energy: 1.5374229957326415
Energy: 1.3669236592436433
Energy: 1.6611281920084455
Energy: 1.384073235906551
Energy: 1.6611281920095091
Energy: 1.4076177151570328
Energy: 1.4151550874782988
Energy: 1.3578183752375446
Energy: 1.4151550874793624

minimum gb energy = 1.2666534532078024 eV
minimum distance =  2.15584798554699 Angstroms
sigma value = 9


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

Energy: 1.498863240264889
Energy: 1.4985362732978165
Energy: 1.4389738456739933
Energy: 1.498536273299085
Energy: 1.465891361354457
Energy: 1.600952156365129
Energy: 1.4858760445555153
Energy: 1.600952156365129
Energy: 1.4512135474032317
Energy: 1.5062030661405676
Energy: 1.446383788506097
Energy: 1.5062030661392993
Energy: 1.5093153316997574
Energy: 1.4909730207997303
Energy: 1.3918697398190478
Energy: 1.4909730207997303
Energy: 1.5640217121366629
Energy: 1.6011324855771087
Energy: 1.4270418240129232
Energy: 1.6011324855771087
Energy: 1.3226475988428943
Energy: 1.5053550211053401
Energy: 1.5009358152295522
Energy: 1.5053550211040718
Energy: 1.4984608701627216
Energy: 1.3922229126094765
Energy: 1.3929674487325752
Energy: 1.392222912608208
Energy: 1.4374722256196533
Energy: 1.5054816299165437
Energy: 1.3770406216699098
Energy: 1.5054816299165437
Energy: 1.498861516938217
Energy: 1.6013704718494577
Energy: 1.4859122781910226
Energy: 1.601370471851966
Energy: 1.5072813433795362
Energy: 1.4983090561575272
Energy: 1.3920653020193272
Energy: 1.4983090561575272
Energy: 1.4127306819966492
Energy: 1.5895118843250582
Energy: 1.4474524358584464
Energy: 1.5895118843237896
Energy: 1.5080321014099334
Energy: 1.5799509853475646
Energy: 1.3923845203142966
Energy: 1.5799509853475646
Energy: 1.3224494950117947
Energy: 1.5059931538042228
Energy: 1.3914583096945055
Energy: 1.5059931538029545
Energy: 1.4919785882508965
Energy: 1.5048956841575531
Energy: 1.502363409824157
Energy: 1.50489568416009
Energy: 1.3224502423392621
Energy: 1.505999282910743
Energy: 1.3815386357274004
Energy: 1.5059992829120112
Energy: 1.5077142107084318
Energy: 1.5799022614900229
Energy: 1.3923529444722336
Energy: 1.5799022614912912
Energy: 1.4128740062849865
Energy: 1.5894912684609506
Energy: 1.4092700115109449
Energy: 1.5894912684596822
Energy: 1.5072737189549321
Energy: 1.4982908853487071
Energy: 1.391955822811576
Energy: 1.498290885351244
Energy: 1.4990260616355564
Energy: 1.6011761581471782
Energy: 1.4266999920909387
Energy: 1.6011761581471782
Energy: 1.4373869684021032
Energy: 1.5054644142718188
Energy: 1.3770559484442277
Energy: 1.5054644142743268
Energy: 1.4984555943180573
Energy: 1.3921991172222807
Energy: 1.3929804206061556
Energy: 1.3921991172235493

minimum gb energy = 1.3224494950117947 eV
minimum distance =  2.28717320919585 Angstroms
sigma value = 25


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

Energy: 1.4421502031721096
Energy: 1.7801401023762118
Energy: 1.5950323356097467
Energy: 1.7801401023777805
Energy: 1.4077353510987827
Energy: 1.6100574674592227
Energy: 1.3783383437530965
Energy: 1.6100574674607915
Energy: 1.3783473610969237
Energy: 1.7416410193209122
Energy: 1.3782286805162887
Energy: 1.741641019322481
Energy: 1.440852492748984
Energy: 1.5996866137204189
Energy: 1.548920278564068
Energy: 1.5996866137188501
Energy: 1.547921826542076
Energy: 1.4065362365001592
Energy: 1.4492556665722476
Energy: 1.4065362365001592
Energy: 1.3785228659358693
Energy: 1.6464482838828292
Energy: 1.3785255797694018
Energy: 1.6464482838828292
Energy: 1.3807409506154327
Energy: 1.6016366166136722
Energy: 1.3777992537137065
Energy: 1.6016366166121034
Energy: 1.529982505758799
Energy: 1.6103772860569956
Energy: 1.442122795318146
Energy: 1.6103772860569956
Energy: 1.3783203207225212
Energy: 1.5146318032932968
Energy: 1.4086156111428585
Energy: 1.5146318032948658
Energy: 1.6136966108833783
Energy: 1.6474768430546802
Energy: 1.3780435879789352
Energy: 1.6474768430546802
Energy: 1.4387597056964645
Energy: 1.7050889714792352
Energy: 1.69442587222518
Energy: 1.7050889714776662
Energy: 1.3778102745022982
Energy: 1.5437469719983121
Energy: 1.6163155980120412
Energy: 1.5437469719983121
Energy: 1.522179504781205
Energy: 1.5176869513293028
Energy: 1.3781161157859558
Energy: 1.5176869513277338
Energy: 1.3777792531995119
Energy: 1.4886246079262635
Energy: 1.4407645752742142
Energy: 1.4886246079262635
Energy: 1.5165800178243811
Energy: 1.6090458907105893
Energy: 1.5302994955072349
Energy: 1.609045890712158
Energy: 1.4069598036938809
Energy: 1.546350313081301
Energy: 1.3782903738257382
Energy: 1.5463503130828695
Energy: 1.3778235705513024
Energy: 1.5260832498090124
Energy: 1.6147727820918159
Energy: 1.5260832498090124

minimum gb energy = 1.3777792531995119 eV
minimum distance =  2.26927453802738 Angstroms
sigma value = 17


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

Energy: 1.5729064355258762
Energy: 1.5711143215731636
Energy: 1.696485880676867
Energy: 1.5711143215740522
Energy: 1.6099948453159518
Energy: 1.5325416725307797
Energy: 1.4259666739944024
Energy: 1.5325416725307797
Energy: 1.5834104008330354
Energy: 1.5547891302120995
Energy: 1.4254541687285907
Energy: 1.5547891302112107
Energy: 1.4278270001164093
Energy: 1.6915373040644672
Energy: 1.530879251210213
Energy: 1.6915373040644672
Energy: 1.6370827750239123
Energy: 1.5372331543441102
Energy: 1.4965299468860733
Energy: 1.5372331543432214
Energy: 1.4540581296231287
Energy: 1.5828277944524531
Energy: 1.5675382350213387
Energy: 1.5828277944524531
Energy: 1.4278154515759307
Energy: 1.5970405155866243
Energy: 1.5131854030917116
Energy: 1.5970405155884013
Energy: 1.566740521604035
Energy: 1.582626340596562
Energy: 1.4518296976106981
Energy: 1.582626340596562
Energy: 1.4527796845412286
Energy: 1.5953718708984224
Energy: 1.6210181330672875
Energy: 1.5953718709001994
Energy: 1.7196964712250635
Energy: 1.5512849142632372
Energy: 1.4267833197496762
Energy: 1.5512849142650142
Energy: 1.4320252386912398
Energy: 1.5980362298097333
Energy: 1.5860415626249469
Energy: 1.5980362298106219
Energy: 1.4525594204013552
Energy: 1.594296998592615
Energy: 1.451679668984526
Energy: 1.5942969985917264
Energy: 1.7121792644450604
Energy: 1.5716095066113107
Energy: 1.574777834221639
Energy: 1.5716095066113107
Energy: 1.4258764093572693
Energy: 1.613961645132256
Energy: 1.612370810691299
Energy: 1.613961645132256
Energy: 1.5564609196085508
Energy: 1.5938884904643689
Energy: 1.4549805143355656
Energy: 1.5938884904625918
Energy: 1.5835711657176625
Energy: 1.5823285385268957
Energy: 1.5668773670212028
Energy: 1.5823285385251187
Energy: 1.5134632258755258
Energy: 1.644767742691889
Energy: 1.7263314753778316
Energy: 1.6447677426910003
Energy: 1.558897789331792
Energy: 1.5545519329068016
Energy: 1.4538800623355197
Energy: 1.55455193290769
Energy: 1.555376476822632
Energy: 1.6487726633818154
Energy: 1.5054675988307924
Energy: 1.6487726633818154
Energy: 1.5151228223556863
Energy: 1.6910749480761897
Energy: 1.42840313476637
Energy: 1.6910749480753013
Energy: 1.4973723178499236
Energy: 1.5805633814138553
Energy: 1.5831841663660768
Energy: 1.580563381414744
Energy: 1.5130012502231307
Energy: 1.6829408508480321
Energy: 1.7192355861849724
Energy: 1.6829408508471435
Energy: 1.5884204305504175
Energy: 1.5990015624700018
Energy: 1.4256934792987546
Energy: 1.5990015624700018
Energy: 1.537629384710805
Energy: 1.5962554622222982
Energy: 1.5972092562924163
Energy: 1.5962554622231868
Energy: 1.537442328969098
Energy: 1.5542644520844806
Energy: 1.5958871872041656
Energy: 1.5542644520853692
Energy: 1.6695163344079131
Energy: 1.5946141690882427
Energy: 1.4273337506132382
Energy: 1.5946141690882427
Energy: 1.4703242974509332
Energy: 1.6188015495184618
Energy: 1.765998098134799
Energy: 1.6188015495175736
Energy: 1.5665104172465005
Energy: 1.5822733147082382
Energy: 1.5846850011091744
Energy: 1.5822733147082382
Energy: 1.7259370359463029
Energy: 1.6909938933328197
Energy: 1.4281793121821058
Energy: 1.6909938933319308
Energy: 1.4514082060926423
Energy: 1.64689333634214
Energy: 1.697786997413854
Energy: 1.6468933363412512

minimum gb energy = 1.4254541687285907 eV
minimum distance =  2.13985331765081 Angstroms
sigma value = 53


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

Energy: 1.3766038558780187
Energy: 1.376014435529945
Energy: 1.7050743436700089
Energy: 1.3760144355360815
Energy: 1.64079839530184
Energy: 1.5464653149158054
Energy: 1.4964298083624386
Energy: 1.5464653149158054
Energy: 1.4053582825447395
Energy: 1.3760239023050933
Energy: 1.4969794485285823
Energy: 1.3760239023071388
Energy: 1.4053003354259948
Energy: 1.376005978942857
Energy: 1.5297994780158084
Energy: 1.3760059789449024
Energy: 1.6408427270853798
Energy: 1.5482840255584385
Energy: 1.4971996070013074
Energy: 1.5482840255604837
Energy: 1.3766038558759732
Energy: 1.376014435529945
Energy: 1.678475345658053
Energy: 1.3760144355360815
Energy: 1.6407983953038852
Energy: 1.5464653149158054
Energy: 1.5709627978419856
Energy: 1.5464653149198964
Energy: 1.405358258889572
Energy: 1.3760239023071388
Energy: 1.5761440624481609
Energy: 1.3760239023071388
Energy: 1.4053003227437917
Energy: 1.376005978942857
Energy: 1.4838222739293598
Energy: 1.3760059789469479
Energy: 1.6408427270874255
Energy: 1.5482840255584385
Energy: 1.6058446522566605
Energy: 1.5482840255604837
Energy: 1.3766038558759732
Energy: 1.376014435529945
Energy: 1.7934004692370118
Energy: 1.3760144355360815
Energy: 1.64079839530184
Energy: 1.5464653149158054
Energy: 1.5709652382700954
Energy: 1.5464653149158054
Energy: 1.4053582734179655
Energy: 1.3760239023050933
Energy: 1.5761440624481609
Energy: 1.3760239023071388

minimum gb energy = 1.376005978942857 eV
minimum distance =  2.24880586887552 Angstroms
sigma value = 9


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

Energy: 1.4949664772865292
Energy: 1.6564340397054278
Energy: 1.7892576639166795
Energy: 1.656434039707699
Energy: 1.7348533977834573
Energy: 1.5721693641160959
Energy: 1.5057437801836602
Energy: 1.5721693641123107
Energy: 1.4879760588392745
Energy: 1.474642582164213
Energy: 1.4819384002253493
Energy: 1.474642582164213
Energy: 1.6274771215032402
Energy: 1.7323959157495818
Energy: 1.504781194697257
Energy: 1.7323959157503388
Energy: 1.651376029362388
Energy: 1.5643888037018066
Energy: 1.50512600363963
Energy: 1.5643888037018066
Energy: 1.4749358652375726
Energy: 1.47364813678401
Energy: 1.6196195040557526
Energy: 1.4736481367855243
Energy: 1.8568661217313056
Energy: 1.5576343703988802
Energy: 1.5063861947215673
Energy: 1.5576343703988802
Energy: 1.5055750695011967
Energy: 1.7368093092762913
Energy: 1.651362884539482
Energy: 1.7368093092770485
Energy: 1.4916994959956138
Energy: 1.747126645682432
Energy: 1.473520268925184
Energy: 1.747126645682432
Energy: 1.4965655807800353
Energy: 1.5698607631197787
Energy: 1.5075945432300657
Energy: 1.5698607631190213
Energy: 1.5081576790438902
Energy: 1.7322814067363437
Energy: 1.8048460010965905
Energy: 1.732281406737858
Energy: 1.6760737945108244
Energy: 1.680280269154846
Energy: 1.4970863449199867
Energy: 1.680280269154089
Energy: 1.4914646799544478
Energy: 1.573276754229195
Energy: 1.7501519516983755
Energy: 1.5732767542284378
Energy: 1.6321991597412893
Energy: 1.6563676117501183
Energy: 1.4924092076791928
Energy: 1.6563676117501183
Energy: 1.5100982135071777
Energy: 1.6658074777643854
Energy: 1.661050859650248
Energy: 1.6658074777643854
Energy: 1.4957143165154168
Energy: 1.7452744929499389
Energy: 1.6252947409071083
Energy: 1.7452744929522102
Energy: 1.5923534840725841
Energy: 1.6656484985955209
Energy: 1.5099974807772567
Energy: 1.6656484985932496
Energy: 1.5121570735316623
Energy: 1.557544794528001
Energy: 1.6955648218507642
Energy: 1.557544794528758
Energy: 1.6861787318261372
Energy: 1.5715444268382044
Energy: 1.4780359948520023
Energy: 1.5715444268382044
Energy: 1.4954823103449766
Energy: 1.5915644751625728
Energy: 1.6171360622627802
Energy: 1.5915644751603015
Energy: 1.626491098111455
Energy: 1.730596323835062
Energy: 1.630294147593363
Energy: 1.730596323835062
Energy: 1.6160878052111454
Energy: 1.6580698584619584
Energy: 1.502217153313668
Energy: 1.658069858461201
Energy: 1.4735745279927068
Energy: 1.6492746166208874
Energy: 1.491651470516036
Energy: 1.6492746166224013
Energy: 1.8374786275686095
Energy: 1.5801938344824558
Energy: 1.5050246982907372
Energy: 1.5801938344832127
Energy: 1.5061582496817096
Energy: 1.695616670165801
Energy: 1.778991920421349
Energy: 1.695616670165801
Energy: 1.5555256006289997
Energy: 1.4744066797857294
Energy: 1.488455199971495
Energy: 1.4744066797849724
Energy: 1.6005737302050966
Energy: 1.6715002032809774
Energy: 1.6264873497848422
Energy: 1.6715002032809774
Energy: 1.49301583853162
Energy: 1.7339791219925562
Energy: 1.627150537506989
Energy: 1.7339791219910423
Energy: 1.5465465299684906
Energy: 1.4740814489423009
Energy: 1.4874015963955889
Energy: 1.4740814489415437
Energy: 1.5058414091369658
Energy: 1.6958777235351774
Energy: 1.778448956576499
Energy: 1.6958777235329061
Energy: 1.7419428705289783
Energy: 1.5795807000394022
Energy: 1.5035801155321256
Energy: 1.5795807000394022
Energy: 1.474004268527434
Energy: 1.559369388391219
Energy: 1.4885802094844984
Energy: 1.5593693883904618
Energy: 1.506803869034765
Energy: 1.6533795412661532
Energy: 1.4884476787856784
Energy: 1.6533795412661532
Energy: 1.6263539465042858
Energy: 1.731658395620953
Energy: 1.6271384764137105
Energy: 1.7316583956194391
Energy: 1.493829355198002
Energy: 1.725069687109504
Energy: 1.8587943869650336
Energy: 1.725069687109504

minimum gb energy = 1.473520268925184 eV
minimum distance =  2.18233957907073 Angstroms
sigma value = 73


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

Energy: 1.565793375994829
Energy: 1.5650513074942534
Energy: 1.7653062779115247
Energy: 1.565051307493052
Energy: 1.616085380634177
Energy: 1.6225230702440485
Energy: 1.527604073307421
Energy: 1.6225230702440485
Energy: 1.5259531891508182
Energy: 1.563982909339085
Energy: 1.4810632034831401
Energy: 1.563982909339085
Energy: 1.4980531418703475
Energy: 1.6904512693024223
Energy: 1.5705439700297614
Energy: 1.6904512693036233
Energy: 1.57330382719736
Energy: 1.628533902346402
Energy: 1.5339783908635172
Energy: 1.628533902346402
Energy: 1.5391291607346937
Energy: 1.5159554304634097
Energy: 1.697279381873887
Energy: 1.515955430464611
Energy: 1.8561298184913058
Energy: 1.696610231473161
Energy: 1.5290235375781878
Energy: 1.696610231474362
Energy: 1.494226029165684
Energy: 1.4728170459833996
Energy: 1.7284969964448382
Energy: 1.4728170459833996
Energy: 1.7699317807066746
Energy: 1.473551328318036
Energy: 1.472772138020416
Energy: 1.473551328319237
Energy: 1.5262497732177507
Energy: 1.638524577533296
Energy: 1.5264333591923471
Energy: 1.6385245775344972
Energy: 1.4913401932143384
Energy: 1.5632007546419628
Energy: 1.7135462248247297
Energy: 1.5632007546395603
Energy: 1.65651457324969
Energy: 1.6905501039349866
Energy: 1.4957933495212408
Energy: 1.6905501039349866
Energy: 1.5372837266950097
Energy: 1.5884435195051732
Energy: 1.7209810511643386
Energy: 1.5884435195063742
Energy: 1.7417349731309273
Energy: 1.6753726817682977
Energy: 1.5368561040934845
Energy: 1.6753726817694714
Energy: 1.4862766881017198
Energy: 1.7425517342461005
Energy: 1.7087328316490338
Energy: 1.7425517342473016
Energy: 1.719508074520385
Energy: 1.473121468237693
Energy: 1.494672503189189
Energy: 1.473121468237693
Energy: 1.564010849379525
Energy: 1.5649758628400514
Energy: 1.5259565602995842
Energy: 1.5649758628400514
Energy: 1.5650408996640415
Energy: 1.564569925174393
Energy: 1.536585827809111
Energy: 1.5645699251731917
Energy: 1.5003428223187558
Energy: 1.4728006082276064
Energy: 1.4915929699144057
Energy: 1.4728006082264054
Energy: 1.527281939631764
Energy: 1.635676480096154
Energy: 1.778268974318235
Energy: 1.6356764800973551
Energy: 1.7154929262683487
Energy: 1.5845743645480426
Energy: 1.5382116585961314
Energy: 1.5845743645480426
Energy: 1.5713975332187675
Energy: 1.629144371269636
Energy: 1.6660193071035152
Energy: 1.629144371269636

minimum gb energy = 1.472772138020416 eV
minimum distance =  2.20831271516559 Angstroms
sigma value = 7


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

Energy: 1.4994188988828885
Energy: 1.498767986412506
Energy: 1.8495769383603637
Energy: 1.4987679864159034
Energy: 1.826547100637062
Energy: 1.5549469681433588
Energy: 1.5274694547449206
Energy: 1.554946968146756
Energy: 1.4927214873799002
Energy: 1.6976924160308868
Energy: 1.523473456285568
Energy: 1.697692416033435
Energy: 1.5494543236552016
Energy: 1.6038704408418065
Energy: 1.5438945251384601
Energy: 1.6038704408341626
Energy: 1.5084201611339674
Energy: 1.5939493162410003
Energy: 1.4953908720283242
Energy: 1.5939493162384524
Energy: 1.4973116206491859
Energy: 1.6183014935460067
Energy: 1.739059987597812
Energy: 1.618301493543459
Energy: 1.670175043336322
Energy: 1.6963750293901112
Energy: 1.5489928190717401
Energy: 1.6963750293867137
Energy: 1.4972231122340836
Energy: 1.4999039012364095
Energy: 1.8014936743695786
Energy: 1.4999039012423547
Energy: 1.6714642389327852
Energy: 1.5873321140672332
Energy: 1.517934993407139
Energy: 1.5873321140646852
Energy: 1.5090875529517214
Energy: 1.604334116405813
Energy: 1.6181941627791427
Energy: 1.6043341163998677
Energy: 1.5338767279674559
Energy: 1.7018431414526527
Energy: 1.5643183375870884
Energy: 1.701843141450105
Energy: 1.5000699789923846
Energy: 1.591547122671157
Energy: 1.5622591645586372
Energy: 1.5915471226728555
Energy: 1.4988761173261993
Energy: 1.5005674322538778
Energy: 1.5643094899787628
Energy: 1.5005674322521791
Energy: 1.5228036730609296
Energy: 1.4892375167246181
Energy: 1.5600528329088403
Energy: 1.4892375167229193
Energy: 1.5061891426716176
Energy: 1.7263833510278013
Energy: 1.7181618662947908
Energy: 1.7263833510311988
Energy: 1.8398795359746511
Energy: 1.4885480414627468
Energy: 1.5137552846489775
Energy: 1.4885480414559522
Energy: 1.5298263928056621
Energy: 1.619693290149747
Energy: 1.7172090298409866
Energy: 1.6196932901488974
Energy: 1.4967117794492484
Energy: 1.6975229646102832
Energy: 1.561586614779088
Energy: 1.6975229646077352
Energy: 1.4924889985509475
Energy: 1.619098422326814
Energy: 1.5634020818619034
Energy: 1.619098422326814
Energy: 1.5086994457278067
Energy: 1.592133167147719
Energy: 1.5381946087213096
Energy: 1.592133167152815
Energy: 1.5454203505595656
Energy: 1.7068196549049972
Energy: 1.5176172749465893
Energy: 1.7068196549075452
Energy: 1.5104641435227701
Energy: 1.6977864402831824
Energy: 1.6437541026093756
Energy: 1.6977864402831824
Energy: 1.7779349992545062
Energy: 1.5896247522373699
Energy: 1.56872416598725
Energy: 1.589624752245863
Energy: 1.5047902173375904
Energy: 1.4998134009746544
Energy: 1.74370844063068
Energy: 1.4998134009729558
Energy: 1.5852548395821884
Energy: 1.5916804153217643
Energy: 1.512612403554128
Energy: 1.5916804153234632
Energy: 1.5492675263231626
Energy: 1.700278339792513
Energy: 1.5365595639730714
Energy: 1.700278339789116
Energy: 1.5093453387601508
Energy: 1.6041785308988885
Energy: 1.5108421765443265
Energy: 1.6041785308980392
Energy: 1.549373081336752
Energy: 1.6182158189713252
Energy: 1.5433555913685775
Energy: 1.6182158189670786
Energy: 1.4918984711676628
Energy: 1.499699435183232
Energy: 1.6368819542891113
Energy: 1.499699435188328
Energy: 1.6844639404726296
Energy: 1.5539224383615022
Energy: 1.527335191869354
Energy: 1.553922438358105
Energy: 1.4918990834136454
Energy: 1.4995342762487254
Energy: 1.7554119565631452
Energy: 1.4995342762529718

minimum gb energy = 1.4885480414559522 eV
minimum distance =  2.19644299790606 Angstroms
sigma value = 29


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

Energy: 1.4311304591839331
Energy: 1.426913557034294
Energy: 1.5285514208162634
Energy: 1.426913557034294
Energy: 1.4357031175204507
Energy: 1.432269788578518
Energy: 1.5004415201387507
Energy: 1.43226978857911
Energy: 1.4346397057940725
Energy: 1.5017150784679234
Energy: 1.3837044302924495
Energy: 1.5017150784687778
Energy: 1.4291160660561522
Energy: 1.3855151696977879
Energy: 1.3795588045171414
Energy: 1.3855151696972294
Energy: 1.431199170140389
Energy: 1.4831401407023013
Energy: 1.6390367661543679
Energy: 1.4831401407023013
Energy: 1.4882982247777594
Energy: 1.5028634476982339
Energy: 1.4881338498376289
Energy: 1.5028634476973461
Energy: 1.4349642179933435
Energy: 1.4831127330143035
Energy: 1.4312055409951077
Energy: 1.4831127330140077
Energy: 1.3797450179155006
Energy: 1.3855320964416558
Energy: 1.4291123143900033
Energy: 1.3855320964416558
Energy: 1.3844877852416408
Energy: 1.5017054693821446
Energy: 1.4884421225490767
Energy: 1.50170546938244

minimum gb energy = 1.3795588045171414 eV
minimum distance =  2.26246353998783 Angstroms
sigma value = 5


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

Energy: 1.4206762955277559
Energy: 1.4038278405587354
Energy: 1.6553285773276452
Energy: 1.4038278405587354
Energy: 1.610618533849546
Energy: 1.487868120457351
Energy: 1.3839258662118412
Energy: 1.4878681204581532
Energy: 1.3732339849160102
Energy: 1.395294340592616
Energy: 1.6391302115482123
Energy: 1.395294340592616
Energy: 1.390133955289443
Energy: 1.4777563514682643
Energy: 1.3952769724340084
Energy: 1.4777563514682643
Energy: 1.3823805113128516
Energy: 1.4855599604730076
Energy: 1.6906150766478831
Energy: 1.4855599604714032
Energy: 1.4352713132744552
Energy: 1.4060568616831424
Energy: 1.3749651381689305
Energy: 1.4060568616839446
Energy: 1.3743319172623576
Energy: 1.494518803803651
Energy: 1.3746319603576982
Energy: 1.494518803808465
Energy: 1.3814241821209077
Energy: 1.4070516182008157
Energy: 1.3841473319479034
Energy: 1.407051618198409
Energy: 1.388057466702292
Energy: 1.4045183361034892
Energy: 1.3964273510980525
Energy: 1.4045183360994777
Energy: 1.394600891439743
Energy: 1.487693789123538
Energy: 1.3757492516792653
Energy: 1.4876937891243402
Energy: 1.3705374100513121
Energy: 1.4069747472921394
Energy: 1.3758928398807555
Energy: 1.4069747472897327
Energy: 1.3728239954614998
Energy: 1.429332142208474
Energy: 1.512019370516475
Energy: 1.4293321422132879
Energy: 1.4587558366913653
Energy: 1.4055512786343554
Energy: 1.4086732624662268
Energy: 1.4055512786327506
Energy: 1.3820156044808718
Energy: 1.4725829540549484
Energy: 1.4975625125002494
Energy: 1.4725829540517392
Energy: 1.7579549528729315
Energy: 1.4757662477279812
Energy: 1.3757110975605595
Energy: 1.475766247721563
Energy: 1.3925941366673522
Energy: 1.3914322461823398
Energy: 1.588701330638848
Energy: 1.3914322461823398
Energy: 1.6045046922004265
Energy: 1.3796483114498057
Energy: 1.3908857146688183
Energy: 1.3796483114506082
Energy: 1.3881478570585406
Energy: 1.404805153666796
Energy: 1.5474069181613148
Energy: 1.4048051536643893
Energy: 1.3778794773631213
Energy: 1.4966333509035037
Energy: 1.3777584319853133
Energy: 1.496633350906713
Energy: 1.371823162099971
Energy: 1.4844071471964273
Energy: 1.3951828076622081
Energy: 1.4844071471996365
Energy: 1.3868443301251607
Energy: 1.4052028154017981
Energy: 1.3889170741197467
Energy: 1.4052028154042047
Energy: 1.4044654528432083
Energy: 1.4865077703327443
Energy: 1.386582500761824
Energy: 1.486507770329535
Energy: 1.3807402799120976
Energy: 1.4064570185531866
Energy: 1.3673212391305436
Energy: 1.4064570185555936
Energy: 1.5116814281557909
Energy: 1.4174592115085933
Energy: 1.3729890410132726
Energy: 1.4174592115110003
Energy: 1.5164510638401618
Energy: 1.4007884885312794
Energy: 1.3858866677036168
Energy: 1.400788488532884
Energy: 1.3975850774795322
Energy: 1.4051147840241713
Energy: 1.3827500031639868
Energy: 1.4051147840321943
Energy: 1.374606296485747
Energy: 1.4667226485709142
Energy: 1.5200876677826773
Energy: 1.4667226485628913
Energy: 1.4104472908986279
Energy: 1.4873387152051074
Energy: 1.3906040906916097
Energy: 1.4873387152059097
Energy: 1.3734580975646857
Energy: 1.379684952866014
Energy: 1.7338837038991537
Energy: 1.37968495287163
Energy: 1.6090456831948547
Energy: 1.4044544179371572
Energy: 1.3870681344586624
Energy: 1.4044544179331457
Energy: 1.375631596309816
Energy: 1.395835804801859
Energy: 1.594641378209459
Energy: 1.3958358048066728
Energy: 1.6074139000457275
Energy: 1.4626104145809007
Energy: 1.3727862234094292
Energy: 1.462610414581703
Energy: 1.3968086234463828
Energy: 1.4793825517350467
Energy: 1.366820947968225
Energy: 1.4793825517342445

minimum gb energy = 1.366820947968225 eV
minimum distance =  2.20880679474303 Angstroms
sigma value = 1


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

Energy: 1.346513501549615
Energy: 1.3460099720023928
Energy: 1.4179532198036684
Energy: 1.3460099719979557
Energy: 1.4177212250106905
Energy: 1.3722469526269956
Energy: 1.334461946398604
Energy: 1.3722469526247771
Energy: 1.3029464068470114
Energy: 1.3461370857979853
Energy: 1.802910749625007
Energy: 1.3461370857968762
Energy: 1.4012833109058114
Energy: 1.4463838690535014
Energy: 1.317685538939745
Energy: 1.446383869049064
Energy: 1.3032353794248448
Energy: 1.4786540943069368
Energy: 1.5814994124679203
Energy: 1.4786540943102648
Energy: 1.3042532388183543
Energy: 1.349722805654553
Energy: 1.3174288739412445
Energy: 1.3497228056567716
Energy: 1.303271127947412
Energy: 1.4791458219030047
Energy: 1.3192946028879193
Energy: 1.4791458219030047
Energy: 1.2981000017577755
Energy: 1.350139776421202
Energy: 1.35439401852676
Energy: 1.350139776422311
Energy: 1.345480668032583
Energy: 1.352150518506006
Energy: 1.364361229484932
Energy: 1.352150518504897
Energy: 1.3454613136070628
Energy: 1.352176718941713
Energy: 1.3537321684777153
Energy: 1.3521767189394946
Energy: 1.2979397093605842
Energy: 1.350337043529569
Energy: 1.3643055033170455
Energy: 1.3503370435284594
Energy: 1.2986931747226136
Energy: 1.4791088194108606
Energy: 1.3188344656793916
Energy: 1.4791088194075328
Energy: 1.3040518491120001
Energy: 1.34965386199598
Energy: 1.3174270446120382
Energy: 1.3496538619970893
Energy: 1.3034461525789947
Energy: 1.4786645992548761
Energy: 1.4904472531335045
Energy: 1.4786645992548761
Energy: 1.4014640249594588
Energy: 1.4463892783727732
Energy: 1.3174110607066252
Energy: 1.4463892783749919
Energy: 1.3029488088225682
Energy: 1.3460897932433258
Energy: 1.4239131797688163
Energy: 1.3460897932444351
Energy: 1.4178851027179629
Energy: 1.3722317283359957
Energy: 1.3344966078947607
Energy: 1.3722317283338277
Energy: 1.346513501549615
Energy: 1.3460099720023928
Energy: 1.6215960262969416
Energy: 1.3460099719979557
Energy: 1.4177212250073628
Energy: 1.3722469526269956
Energy: 1.3344619463974945
Energy: 1.3722469526236678
Energy: 1.3029464068470114
Energy: 1.3461370857979853
Energy: 1.802910749625007
Energy: 1.346137085795767
Energy: 1.4012833109058114
Energy: 1.4463838690535014
Energy: 1.3176855389386357
Energy: 1.4463838690501734
Energy: 1.3032353794248448
Energy: 1.4786540943069368
Energy: 1.5814994124668111
Energy: 1.4786540943091557
Energy: 1.3042532388105894
Energy: 1.349722805655662
Energy: 1.3174288739434128
Energy: 1.349722805655662
Energy: 1.303271127947412
Energy: 1.4791458219030047
Energy: 1.31929460288681
Energy: 1.4791458219030047

minimum gb energy = 1.2979397093605842 eV
minimum distance =  2.22442503848285 Angstroms
sigma value = 17


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

Energy: 1.3349606378945647
Energy: 1.3347590867599337
Energy: 1.6339734622406492
Energy: 1.3347590867619907
Energy: 1.5476211499319055
Energy: 1.3243809596620288
Energy: 1.3089045531314372
Energy: 1.3243809596599718
Energy: 1.3051358026403093
Energy: 1.3186430592715512
Energy: 1.5963146838586748
Energy: 1.3186430592729226
Energy: 1.3973120129611962
Energy: 1.2950937632179504
Energy: 1.303193954249611
Energy: 1.2950937632179504
Energy: 1.294705927290403
Energy: 1.4212268474261522
Energy: 1.6338615190443013
Energy: 1.4212268474261522
Energy: 1.2945491489352123
Energy: 1.3133220141558177
Energy: 1.320728722661578
Energy: 1.3133220141558177
Energy: 1.3289665430499478
Energy: 1.4007593706396155
Energy: 1.3189150938583545
Energy: 1.4007593706389299
Energy: 1.290594638622691
Energy: 1.5966486028565812
Energy: 1.2979016311560285
Energy: 1.59664860285521
Energy: 1.3323318366892791
Energy: 1.6015029990944252
Energy: 1.3614361545701752
Energy: 1.6015029990964822
Energy: 1.3190851284571106
Energy: 1.3998380405969528
Energy: 1.3057890836257113
Energy: 1.3998380405921533
Energy: 1.3093456348825019
Energy: 1.3742744892710264
Energy: 1.3003104902432394
Energy: 1.374274489270341
Energy: 1.2965942299326252
Energy: 1.3991533450901033
Energy: 1.2877241045520287
Energy: 1.399153345088732
Energy: 1.292115748250519
Energy: 1.3871676067269978
Energy: 1.3073552960393797
Energy: 1.387167606728369
Energy: 1.3152786287877887
Energy: 1.4206034199869464
Energy: 1.3337403432570536
Energy: 1.4206034199890036
Energy: 1.2971219090827832
Energy: 1.3053191428607853
Energy: 1.3459619037351722
Energy: 1.3053191428600999
Energy: 1.3107063104865808
Energy: 1.3196242772941644
Energy: 1.623584303276179
Energy: 1.3196242772907365
Energy: 1.3042128678788198
Energy: 1.3034781690016122
Energy: 1.3065746293501743
Energy: 1.3034781690056636
Energy: 1.2976727230303562
Energy: 1.4560111005135687
Energy: 1.3540467893190895
Energy: 1.456011100511512
Energy: 1.4874749473074944
Energy: 1.4020559038458296
Energy: 1.308403006681391
Energy: 1.4020559038465157
Energy: 1.315319894441457
Energy: 1.3192905062133755
Energy: 1.5142596806830688
Energy: 1.3192905062126898
Energy: 1.5419259497460824
Energy: 1.314634562909609
Energy: 1.3267419638093365
Energy: 1.3146345629109804
Energy: 1.3273550950847095
Energy: 1.456238305947533
Energy: 1.3565440503556416
Energy: 1.45623830594959
Energy: 1.4885529680286507
Energy: 1.3113616929568401
Energy: 1.3172102913778871
Energy: 1.3113616929547833
Energy: 1.3080342900942932
Energy: 1.4025582863897101
Energy: 1.493623500697496
Energy: 1.4025582863903956
Energy: 1.3784490486432437
Energy: 1.3352509058357922
Energy: 1.3000498730322976
Energy: 1.3352509058385347
Energy: 1.3104479847280541
Energy: 1.4239784491935705
Energy: 1.30316736508181
Energy: 1.4239784491949419
Energy: 1.479987992520143
Energy: 1.3901757417603904
Energy: 1.3026403646964617
Energy: 1.3901757417597047
Energy: 1.3440892602833299
Energy: 1.4792005257521597
Energy: 1.3034969652453272
Energy: 1.4792005257507883
Energy: 1.333523318719059
Energy: 1.4201225192138327
Energy: 1.320285128950786
Energy: 1.4201225192172608
Energy: 1.3229354723403492
Energy: 1.391196624348137
Energy: 1.3355439627089583
Energy: 1.3911966243508795
Energy: 1.3028461924549144
Energy: 1.4200120898499888
Energy: 1.3088231237626657
Energy: 1.4200120898520456
Energy: 1.304285423284784
Energy: 1.3705296950131034
Energy: 1.3064438708426487
Energy: 1.370529695011732
Energy: 1.3026990904570994
Energy: 1.4003720558004877
Energy: 1.5040614472723908
Energy: 1.4003720558004877
Energy: 1.3662135866796847
Energy: 1.500906847078966
Energy: 1.3218411795701048
Energy: 1.5009068470762232
Energy: 1.2970531435266865
Energy: 1.3360883658000537
Energy: 1.3400144443090285
Energy: 1.336088365801425
Energy: 1.320079253531997
Energy: 1.403242028094576
Energy: 1.3265814749164007
Energy: 1.4032420280918962
Energy: 1.3172261834280956
Energy: 1.3135669098769467
Energy: 1.2985416125314484
Energy: 1.3135669098762612
Energy: 1.3536262430733899
Energy: 1.423540969896493
Energy: 1.3114761171977467
Energy: 1.423540969896493

minimum gb energy = 1.2877241045520287 eV
minimum distance =  2.21423227499723 Angstroms
sigma value = 89


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

Energy: 1.1843772324404438
Energy: 1.1844096773260162
Energy: 1.5210541149641297
Energy: 1.1844096773260162
Energy: 1.1843296956776537
Energy: 1.2243112402388694
Energy: 1.20327612103086
Energy: 1.2243112402388694
Energy: 1.2003926482999785
Energy: 1.4082728493650924
Energy: 1.9628767233862994
Energy: 1.4082728493650924
Energy: 1.2122347731139311
Energy: 1.2244652876305724
Energy: 1.203092948370184
Energy: 1.2244652876305724
Energy: 1.1996224539310745
Energy: 1.3105778817797125
Energy: 1.9027142030767001
Energy: 1.3105778817815068
Energy: 1.1996723388796138
Energy: 1.1854425288678296
Energy: 1.1882677579429028
Energy: 1.1854425288678296
Energy: 1.2008194774603973
Energy: 1.407961472695216
Energy: 1.1841142325716025
Energy: 1.40796147269701
Energy: 1.2012868374195096
Energy: 1.4076119405650656
Energy: 1.203257993001038
Energy: 1.4076119405650656
Energy: 1.1996917975763668
Energy: 1.310973663280303
Energy: 1.2118049393356642
Energy: 1.3109736632820967
Energy: 1.2238594284399265
Energy: 1.3095813103331597
Energy: 1.1996187166408587
Energy: 1.3095813103331597
Energy: 1.1837918496052564
Energy: 1.2253538997568083
Energy: 1.1998947934166921
Energy: 1.2253538997586022
Energy: 1.1838240381233611
Energy: 1.4092189682896128
Energy: 1.2032573395419455
Energy: 1.4092189682914067
Energy: 1.1997167569790557
Energy: 1.1880698772559122
Energy: 1.2117171423995883
Energy: 1.1880698772559122
Energy: 1.1996410700110036
Energy: 1.310173905096279
Energy: 1.1996865790487254
Energy: 1.310173905098073
Energy: 1.1988184654456
Energy: 1.1882082660790458
Energy: 1.1997326023454784
Energy: 1.1882082660808397

minimum gb energy = 1.1837918496052564 eV
minimum distance =  2.23955157099368 Angstroms
sigma value = 13


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

Energy: 1.1813323473969444
Energy: 1.1420262597537676
Energy: 1.508169400614636
Energy: 1.1420262597500082
Energy: 1.3446378202743914
Energy: 1.1710136695606652
Energy: 1.1303716911080788
Energy: 1.1710136695644249
Energy: 1.1437416331992378
Energy: 1.1424439145103404
Energy: 1.3668500488892221
Energy: 1.1424439145080847
Energy: 1.1680960573643246
Energy: 1.1708035711507643
Energy: 1.1284532027843024
Energy: 1.170803571161291
Energy: 1.1500636995278162
Energy: 1.233897567411795
Energy: 1.2099359315899578
Energy: 1.233897567418562
Energy: 1.156873313096653
Energy: 1.1709199511901915
Energy: 1.1530546609397625
Energy: 1.1709199511909436
Energy: 1.1494327357803127
Energy: 1.2375366034648916
Energy: 1.6725591470103738
Energy: 1.2375366034641402
Energy: 1.1184649296816118
Energy: 1.171778004927671
Energy: 1.1531932015529036
Energy: 1.1717780049404531
Energy: 1.1495396292231368
Energy: 1.2372585601923398
Energy: 1.3259894054585528
Energy: 1.237258560199859
Energy: 1.356450291920078
Energy: 1.2589971027703672
Energy: 1.128884953334367
Energy: 1.2589971027756304
Energy: 1.1496375932948957
Energy: 1.25990754644533
Energy: 1.1564669476372165
Energy: 1.2599075464483376
Energy: 1.49719556877077
Energy: 1.258898763102617
Energy: 1.136290283954116
Energy: 1.2588987630973534
Energy: 1.1934359045560736
Energy: 1.159805257045762
Energy: 1.166409138825444
Energy: 1.159805257054785
Energy: 1.5263445258215111
Energy: 1.2594380204102587
Energy: 1.1362896820227641
Energy: 1.2594380204095066
Energy: 1.1499063879451892
Energy: 1.1411760830286597
Energy: 1.1664981108367345
Energy: 1.141176083037683
Energy: 1.131978200668271
Energy: 1.2593457257697254
Energy: 1.125819236977757
Energy: 1.2593457257757408
Energy: 1.1452406072262111
Energy: 1.22636694290863
Energy: 1.1259141002303943
Energy: 1.2263669429101338
Energy: 1.1635907265577516
Energy: 1.2331770348676292
Energy: 1.1492825253226044
Energy: 1.2331770348676292
Energy: 1.1453546557492988
Energy: 1.2343677011847907
Energy: 1.149041810297552
Energy: 1.2343677011930618
Energy: 1.1454042711830417
Energy: 1.2343413292825638
Energy: 1.1490737958206814
Energy: 1.2343413292878271
Energy: 1.1635902319622151
Energy: 1.2331695504625415
Energy: 1.14923173033316
Energy: 1.2331695504617894
Energy: 1.1451705595764097
Energy: 1.2260572964783083
Energy: 1.12592101480878
Energy: 1.226057296473045
Energy: 1.1316858120783078
Energy: 1.2593495976976645
Energy: 1.1257777397099702
Energy: 1.259349597701424
Energy: 1.1497644018798334
Energy: 1.1412147779872415
Energy: 1.152606866161188
Energy: 1.1412147780045354
Energy: 1.5263323474869468
Energy: 1.2594637378642741
Energy: 1.136629442886957
Energy: 1.259463737854499
Energy: 1.1886363288102355
Energy: 1.1599565395610794
Energy: 1.1630243346246436
Energy: 1.1599565395618312
Energy: 1.497214590308178
Energy: 1.2588939975976559
Energy: 1.1363460377999677
Energy: 1.2588939975916407
Energy: 1.1494162821087657
Energy: 1.2598740852780956
Energy: 1.125720404301151
Energy: 1.2598740852878705
Energy: 1.3569319476608095
Energy: 1.2589517559086136
Energy: 1.12886817865433
Energy: 1.2589517559236518
Energy: 1.1497242259899432
Energy: 1.2370420377020546
Energy: 1.328112518943622
Energy: 1.2370420377005509
Energy: 1.1184687631255046
Energy: 1.1718847997973785
Energy: 1.1529706728478983
Energy: 1.1718847997958746
Energy: 1.1498819860052147
Energy: 1.2376040324148985
Energy: 1.5187059362658502
Energy: 1.2376040324058757
Energy: 1.1564304649082657
Energy: 1.1709054350425334
Energy: 1.1530395434898335
Energy: 1.170905435045541
Energy: 1.1498096163668137
Energy: 1.2337418281838233
Energy: 1.4993933083230304
Energy: 1.2337418281725445
Energy: 1.1678674073328736
Energy: 1.170940682012344
Energy: 1.1284949414003518
Energy: 1.1709406820145996

minimum gb energy = 1.1184649296816118 eV
minimum distance =  2.2547610830802 Angstroms
sigma value = 37


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

Energy: 1.254672341150981
Energy: 1.2533783014727131
Energy: 1.3726192221800348
Energy: 1.2533783014727131
Energy: 1.315045859523759
Energy: 1.3791541600930932
Energy: 1.0464242417316043
Energy: 1.3791541600917996
Energy: 1.0773290536118327
Energy: 1.4126869847723986
Energy: 1.4268507826506482
Energy: 1.4126869847711343
Energy: 1.1906199189043314
Energy: 1.084838140689223
Energy: 1.051266113735451
Energy: 1.0848381406879293
Energy: 1.0509563550191092
Energy: 1.3785230556288128
Energy: 1.1410368062649394
Energy: 1.3785230556301065
Energy: 1.07095920118267
Energy: 1.378448874951374
Energy: 1.1934027726001413
Energy: 1.3784488749500803
Energy: 1.068268770193892
Energy: 1.7862897731171692
Energy: 1.5208548278407799
Energy: 1.7862897731171692
Energy: 1.0327029287298555
Energy: 1.0862425104101288
Energy: 1.0861164140902528
Energy: 1.0862425104088351
Energy: 1.0477312852577092
Energy: 1.3786115767119027
Energy: 1.5219836956075339
Energy: 1.3786115767119027
Energy: 1.4278569330206794
Energy: 1.3779732223172516
Energy: 1.1935416117664503
Energy: 1.3779732223159578
Energy: 1.050246992347383
Energy: 1.5459398589327502
Energy: 1.1909323555362004
Energy: 1.5459398589340438
Energy: 1.416272023391847
Energy: 1.0849804316758223
Energy: 1.0513135821495938
Energy: 1.0849804316758223
Energy: 1.1905610280498102
Energy: 1.3783467829541514
Energy: 1.044334240388459
Energy: 1.3783467829528577
Energy: 1.5212041347124392
Energy: 1.8229091878870132
Energy: 1.0326728771228046
Energy: 1.8229091878870132
Energy: 1.2532879933423775
Energy: 1.2825816286780918
Energy: 1.0324729589477417
Energy: 1.2825816286793854
Energy: 1.2534462724792326
Energy: 1.3781746899582965
Energy: 1.0463807033364074
Energy: 1.3781746899595901
Energy: 1.19066935571386
Energy: 1.378387373290455
Energy: 1.046095151930649
Energy: 1.3783873732917487
Energy: 1.1911187057556705
Energy: 1.5470422506465593
Energy: 1.050086110904826
Energy: 1.5470422506452657
Energy: 1.0504602702792434
Energy: 1.0867939101812436
Energy: 1.0501702410573974
Energy: 1.0867939101799498
Energy: 1.0501102734930035
Energy: 1.3781967839819784
Energy: 1.1907536688244555
Energy: 1.3781967839807143

minimum gb energy = 1.0324729589477417 eV
minimum distance =  2.16710777365409 Angstroms
sigma value = 25


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

Energy: 1.136658926327542
Energy: 1.3194268534467193
Energy: 0.9283132429941297
Energy: 1.319426853443689
Energy: 1.5441293385413186
Energy: 1.0871133403754993
Energy: 0.9495784811589176
Energy: 1.0871133403734792
Energy: 1.0709181061048159
Energy: 0.9644314028074245
Energy: 1.2350346628741906
Energy: 0.9644314028033837
Energy: 1.309147305247759
Energy: 1.108748521131448
Energy: 0.9567072785092481
Energy: 1.1087485211354888
Energy: 0.9686443196317055
Energy: 0.9728966007578465
Energy: 1.0135252818759508
Energy: 0.9728966007578465
Energy: 1.0388211963128027
Energy: 1.0715729202969604
Energy: 0.968214484989904
Energy: 1.0715729202989805
Energy: 0.9516849110121184
Energy: 0.9438424309871848
Energy: 1.3095827756154248
Energy: 0.9438424309922355
Energy: 0.9365698026451432
Energy: 1.1180037052302827
Energy: 1.0728200719904508
Energy: 1.118003705231293
Energy: 0.9484936965076172
Energy: 0.9834691021783482
Energy: 1.50052523197719
Energy: 0.9834691021773381
Energy: 0.9177912845558729
Energy: 0.9443856002464948
Energy: 1.0105657318036223
Energy: 0.9443856002464948
Energy: 0.9517885939839759
Energy: 0.9439451856916187
Energy: 1.41468704945894
Energy: 0.9439451856926289
Energy: 1.2350395319150538
Energy: 1.4849554384376877
Energy: 1.0729243087732427
Energy: 1.4849554384356676
Energy: 0.9583486657526521
Energy: 0.9949029061071883
Energy: 1.2899471630404589
Energy: 0.9949029061142594
Energy: 1.2366660864329502
Energy: 1.051464328931946
Energy: 0.9683324315999325
Energy: 1.0514643289279055
Energy: 0.9669978366482589
Energy: 0.9437126871210778
Energy: 1.039225637295057
Energy: 0.9437126871240624
Energy: 1.3391695066511686
Energy: 1.5749168756116652
Energy: 0.9495580268206939
Energy: 1.5749168756116652
Energy: 1.0777665547343045
Energy: 1.007184817412938
Energy: 0.9288231140307041
Energy: 1.0071848174169786
Energy: 1.324655835503623
Energy: 0.9733839742361621
Energy: 0.9496198303637714
Energy: 0.9733839742341418
Energy: 1.1388325019020913
Energy: 1.307041313682228
Energy: 0.9180956128150691
Energy: 1.307041313682228
Energy: 1.5286828818968843
Energy: 1.2234279311234926
Energy: 0.9497599904442747
Energy: 1.2234279311255132
Energy: 1.077584466397085
Energy: 1.3531849162932463
Energy: 0.9182587776636979
Energy: 1.3531849162962766
Energy: 1.0710248338523207
Energy: 0.994975470482857
Energy: 0.9600584171225539
Energy: 0.994975470483867
Energy: 0.9668041100746332
Energy: 1.0505982403549083
Energy: 1.2369603365985906
Energy: 1.0505982403528882
Energy: 1.0386055341021696
Energy: 1.6123176508048116
Energy: 0.9666620786881942
Energy: 1.6123176508098624
Energy: 0.9495416235486164
Energy: 1.1139115916284765
Energy: 1.3532236061242036
Energy: 1.1139115916264561
Energy: 0.9272308297179386
Energy: 1.0088522875625179
Energy: 1.0708023868823495
Energy: 1.008852287564538

minimum gb energy = 0.9177912845558729 eV
minimum distance =  2.26246922392542 Angstroms
sigma value = 41


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

Energy: 1.2527834654569585
Energy: 0.8851492156124418
Energy: 1.2692760771322558
Energy: 0.8851492156132699
Energy: 1.5984416069942695
Energy: 0.8627249902548842
Energy: 0.8514620226771537
Energy: 0.8627249902557124
Energy: 0.8829698985255348
Energy: 0.8486518208896857
Energy: 1.1377456783091195
Energy: 0.8486518208896857
Energy: 1.232625126102561
Energy: 0.8633515578909153
Energy: 0.8512862476678755
Energy: 0.8633515578892589
Energy: 0.8458743486555954
Energy: 1.088248312039676
Energy: 0.9001984330942436
Energy: 1.0882483120421604
Energy: 1.0514729555869637
Energy: 0.8638551427508957
Energy: 0.8512823982358363
Energy: 0.8638551427508957
Energy: 0.850297950838547
Energy: 1.0521676922579761
Energy: 0.9023074053995571
Energy: 1.0521676922579761
Energy: 0.8283694200994214
Energy: 0.8830194807154795
Energy: 0.8470427812709346
Energy: 0.8830194807154795
Energy: 0.8541856295951111
Energy: 1.2214396033587902
Energy: 1.3784062882609136
Energy: 1.2214396033554775
Energy: 0.8274243331551625
Energy: 0.8486782833536124
Energy: 0.8842257673766112
Energy: 0.8486782833536124
Energy: 0.8502975619120686
Energy: 0.8631489818754907
Energy: 1.4147817035963797
Energy: 0.8631489818730061
Energy: 0.8321109573991109
Energy: 0.8852575349683801
Energy: 1.2535488319371857
Energy: 0.8852575349692082
Energy: 0.8545001470825908
Energy: 1.2209916361353093
Energy: 1.414559469940801
Energy: 1.2209916361353093
Energy: 1.0954718535500017
Energy: 1.2197645044652519
Energy: 0.884280280590442
Energy: 1.21976450446608
Energy: 0.8503505132402415
Energy: 0.8630576305023473
Energy: 1.2322215164344172
Energy: 0.8630576305015192
Energy: 1.0929614427220586
Energy: 1.0680294853592427
Energy: 0.8470168535777534
Energy: 1.0680294853584145
Energy: 0.8544953707108082
Energy: 1.2184353091852334
Energy: 1.0314839286280402
Energy: 1.2184353091860616
Energy: 1.0901137903225175
Energy: 1.219456115960417
Energy: 0.851476018484555
Energy: 1.2194561159595887
Energy: 0.8504111655301019
Energy: 0.8829213999904134
Energy: 0.8284409413642173
Energy: 0.8829213999920698
Energy: 1.0995357172001956
Energy: 1.404549659526958
Energy: 0.8541064628008204
Energy: 1.4045496595261302
Energy: 0.887492351718823
Energy: 1.2183549980027215
Energy: 0.8283981629038792
Energy: 1.2183549980035497
Energy: 1.4151825099793938
Energy: 1.5379309830913839
Energy: 0.8515694188275013
Energy: 1.5379309830905559
Energy: 1.2558867561440628
Energy: 0.8825929035744323
Energy: 0.8319877956028965
Energy: 0.8825929035744323
Energy: 1.2533974310764038
Energy: 1.4030001337550677
Energy: 0.8541028957543833
Energy: 1.403000133755896
Energy: 0.8873956156121561
Energy: 1.2189152941943315
Energy: 0.8331125189184423
Energy: 1.2189152941951598
Energy: 1.2326061645125896
Energy: 1.5372036883663012
Energy: 0.8514104333024524
Energy: 1.5372036883646447
Energy: 0.8504097084312516
Energy: 0.8835690328909002
Energy: 1.0932351874205097
Energy: 0.8835690328900718
Energy: 0.8464395861574406
Energy: 1.2180218522804227
Energy: 0.8539310749498732
Energy: 1.218021852281251
Energy: 0.854597396323631
Energy: 1.219131233577894
Energy: 1.0901120059239588
Energy: 1.2191312335762379
Energy: 0.8282975425276624
Energy: 1.2696476786733768
Energy: 0.8550767853268639
Energy: 1.2696476786717203
Energy: 0.8579544291857997
Energy: 0.8836532172319793
Energy: 1.0992919877655156
Energy: 0.8836532172328075
Energy: 0.8322992760258924
Energy: 1.2183529689572332
Energy: 0.8922950071860688
Energy: 1.2183529689564052

minimum gb energy = 0.8274243331551625 eV
minimum distance =  2.23838081686706 Angstroms
sigma value = 15


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

Energy: 1.1387753424782763
Energy: 0.8023578642039957
Energy: 1.5006199193758583
Energy: 0.8023578642025926
Energy: 1.4143717836939804
Energy: 0.8009677441390732
Energy: 0.7995736643095666
Energy: 0.8009677441404763
Energy: 0.8307604986855454
Energy: 0.7975949585415708
Energy: 1.0364548335954586
Energy: 0.7975949585387645
Energy: 1.2602702153703647
Energy: 0.8023682900005058
Energy: 0.7995164801046195
Energy: 0.8023682899998043
Energy: 0.7961001978995969
Energy: 1.3828900747861526
Energy: 0.7635925621575262
Energy: 1.382890074784749
Energy: 1.1018422271901456
Energy: 0.7997221949173434
Energy: 0.7993700757674626
Energy: 0.7997221949194482
Energy: 0.7985312959240718
Energy: 0.9683213451644757
Energy: 0.822180223682752
Energy: 0.9683213451637741
Energy: 0.9523877619460221
Energy: 0.8142784644786384
Energy: 0.7992630109775433
Energy: 0.8142784644793398
Energy: 0.8015172801880145
Energy: 1.389940857275616
Energy: 1.1627066084392215
Energy: 1.389940857274213
Energy: 0.7622314527702411
Energy: 0.7991345599916188
Energy: 0.7965812660125645
Energy: 0.7991345599916188
Energy: 0.7988232354639399
Energy: 0.7997407386222122
Energy: 1.3162016857656773
Energy: 0.7997407386236153
Energy: 0.7625942571272523
Energy: 0.7976899899905681
Energy: 0.8315642510725076
Energy: 0.7976899899905681
Energy: 0.8016066350861769
Energy: 1.3892823738064273
Energy: 1.4941006650943793
Energy: 1.389282373807129
Energy: 0.7657640747719445
Energy: 0.802707996164744
Energy: 1.1394225719781483
Energy: 0.802707996161236
Energy: 0.7987490052444114
Energy: 0.8011174018710289
Energy: 1.4144043466680407
Energy: 0.8011174018724322
Energy: 0.9883355087214759
Energy: 0.7976283163971518
Energy: 0.8313754974301616
Energy: 0.7976283163971518
Energy: 0.8014585200293795
Energy: 1.3887063222889158
Energy: 1.2601933279904929
Energy: 1.3887063222882141
Energy: 0.9878783753285441
Energy: 1.3805450367219854
Energy: 0.7968663305396153
Energy: 1.3805450367226866
Energy: 0.7987256089264699
Energy: 0.7996908637105196
Energy: 1.1013254302677578
Energy: 0.7996908637070117
Energy: 0.9859550049804442
Energy: 0.799532583295644
Energy: 0.7995275668645871
Energy: 0.7995325832984502
Energy: 0.8014574524448204
Energy: 1.1275864667023239
Energy: 0.932514916783462
Energy: 1.1275864667016222
Energy: 0.9916946631345565
Energy: 1.3854534021033729
Energy: 0.8047500424180826
Energy: 1.3854534021005664
Energy: 0.7987062034869551
Energy: 0.7994856884579404
Energy: 0.7622363292207703
Energy: 0.7994856884572389
Energy: 1.3168385107700358
Energy: 0.7985859427338033
Energy: 0.7995212115703918
Energy: 0.7985859427345048
Energy: 0.8335117339996294
Energy: 1.1273397590185739
Energy: 0.762883574139544
Energy: 1.1273397590178722
Energy: 1.2795360961229574
Energy: 1.387132530261384
Energy: 0.8048198275930257
Energy: 1.387132530261384
Energy: 1.141138572004575
Energy: 1.3774254493803413
Energy: 0.7658874349890601
Energy: 1.3774254493796396
Energy: 1.4266716219549216
Energy: 0.957690869918587
Energy: 0.7993753896603775
Energy: 0.9576908699178854
Energy: 0.833702543773342
Energy: 1.408922633215528
Energy: 0.7667874963570904
Energy: 1.408922633214125
Energy: 1.114270984141651
Energy: 1.3866354226036035
Energy: 0.8049616137021828
Energy: 1.3866354226022006
Energy: 0.7988531654130927
Energy: 1.1160279700916305
Energy: 0.9885112756919345
Energy: 1.1160279700923321
Energy: 1.1012446495928552
Energy: 0.7998266627885638
Energy: 0.7994093419916213
Energy: 0.7998266627906686
Energy: 0.8014769612875768
Energy: 1.4091335137954446
Energy: 0.9856390087931487
Energy: 1.4091335137961463
Energy: 0.7735671760373475
Energy: 1.1273628107256088
Energy: 0.8049386458708547
Energy: 1.1273628107221012
Energy: 0.7909346494373315
Energy: 1.1168271450362637
Energy: 0.991742528960799
Energy: 1.116827145032756
Energy: 0.7618143773843733
Energy: 0.7997429498569418
Energy: 0.8021362868125278
Energy: 0.7997429498576434
Energy: 0.8016980168707402
Energy: 1.4088955874007663
Energy: 1.3319268923774592
Energy: 1.4088955873979598

minimum gb energy = 0.7618143773843733 eV
minimum distance =  2.19461623463362 Angstroms
sigma value = 85


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

Energy: 1.0774318429204832
Energy: 1.292389741509708
Energy: 0.8578143657353269
Energy: 1.292389741509708
Energy: 1.541178818312534
Energy: 0.779854539448509
Energy: 0.7351639752373492
Energy: 0.779854539448509
Energy: 1.0299326518708454
Energy: 0.7791103542654185
Energy: 1.0727487740978745
Energy: 0.7791103542642015
Energy: 1.264618085776788
Energy: 0.7798179464590791
Energy: 0.7353082906698176
Energy: 0.7798179464596877
Energy: 0.7776759910409465
Energy: 0.7330587402754368
Energy: 0.6850273044592607
Energy: 0.7330587402748282
Energy: 1.1226041416877044
Energy: 0.7800039384099292
Energy: 0.7350237701239717
Energy: 0.7800039384093208
Energy: 0.7316089137967923
Energy: 0.927261139743281
Energy: 0.786206191310477
Energy: 0.9272611397469319
Energy: 0.9798855156135029
Energy: 0.777503280232182
Energy: 0.7349069922535648
Energy: 0.7775032802327905
Energy: 0.7343306925517371
Energy: 0.8810960199732532
Energy: 1.0394942141878731
Energy: 0.8810960199732532
Energy: 0.8518094507609723
Energy: 0.9274790312506198
Energy: 0.7323865473475402
Energy: 0.9274790312512282
Energy: 0.7346477002711164
Energy: 0.7794100483568666
Energy: 1.1829372550673805
Energy: 0.7794100483574752
Energy: 0.6851663513951831
Energy: 0.777333992235511
Energy: 0.7784498068343366
Energy: 0.777333992235511
Energy: 0.7345632314521036
Energy: 0.7532067475352147
Energy: 1.2948792525901671
Energy: 0.7532067475358231
Energy: 0.685179115450769
Energy: 0.7791323661846713
Energy: 1.030529493024877
Energy: 0.7791323661840629
Energy: 0.7347783166897057
Energy: 0.7799776548378788
Energy: 1.3939253609527014
Energy: 0.7799776548384871
Energy: 0.6875906646550409
Energy: 1.2928923341020806
Energy: 1.0781209503739118
Energy: 1.2928923341020806
Energy: 0.7344563874811947
Energy: 0.7531160553910621
Energy: 1.3937381580561006
Energy: 0.7531160553898453
Energy: 0.8830142896515417
Energy: 0.779222569962496
Energy: 1.030599821312851
Energy: 0.7792225699631046
Energy: 0.7347687182093978
Energy: 0.7798968896322686
Energy: 1.264708582492801
Energy: 0.7798968896310515
Energy: 0.8809948272931689
Energy: 1.3179233429701165
Energy: 0.7784150358602626
Energy: 1.3179233429707249
Energy: 0.7343547382242931
Energy: 0.7533367727421916
Energy: 1.1226335029017949
Energy: 0.7533367727428002
Energy: 0.8797502782198874
Energy: 0.7793191730892567
Energy: 0.732423846693598
Energy: 0.7793191730880397
Energy: 0.7368864369673835
Energy: 0.7778702076787763
Energy: 0.9792010015747015
Energy: 0.7778702076787763
Energy: 0.8914548221637628
Energy: 1.3143570636399966
Energy: 0.73496829263749
Energy: 1.3143570636406052
Energy: 0.7346176682313966
Energy: 0.7787529999191558
Energy: 0.8520456335400414
Energy: 0.7787529999197643
Energy: 1.1826590280219227
Energy: 1.0299490606279371
Energy: 0.7359123314133087
Energy: 1.0299490606267203
Energy: 0.7803926980856672
Energy: 0.7775965639449927
Energy: 0.6850934814816739
Energy: 0.7775965639462097
Energy: 1.1852267349075587
Energy: 1.3150620152116674
Energy: 0.7351257050102217
Energy: 1.3150620152122758
Energy: 1.0324904293342347
Energy: 0.902978702481021
Energy: 0.6847967789439386
Energy: 0.9029787024816295
Energy: 1.3939918596177647
Energy: 0.9031174514658756
Energy: 0.7360228830179026
Energy: 0.9031174514670925
Energy: 1.079937980408166
Energy: 1.2826957047330425
Energy: 0.6874565389600734
Energy: 1.282695704732434
Energy: 1.2969314230807043
Energy: 1.3079542531777961
Energy: 0.7351910899372517
Energy: 1.3079542531771873
Energy: 1.0324978699627454
Energy: 0.9030825112635374
Energy: 0.6901570568487596
Energy: 0.9030825112635374
Energy: 1.2645485606371802
Energy: 0.9036269275969606
Energy: 0.7358687884941932
Energy: 0.9036269275981776
Energy: 0.7806437426292125
Energy: 1.3078674290633396
Energy: 0.8807060545967785
Energy: 1.3078674290633396
Energy: 0.9967108952799089
Energy: 1.308243498291452
Energy: 0.7351300009324088
Energy: 1.3082434982920605
Energy: 0.734591541112186
Energy: 1.0308704581910888
Energy: 0.879748599530965
Energy: 1.0308704581904802
Energy: 0.9787552977461368
Energy: 0.778264553120648
Energy: 0.7362555143655437
Energy: 0.778264553120648
Energy: 0.7347931555854855
Energy: 1.307542220587585
Energy: 0.8914384792113182
Energy: 1.3075422205869764
Energy: 0.7002156314419874
Energy: 1.2183018424256942
Energy: 0.7344639977041362
Energy: 1.2183018424250858
Energy: 0.7339257738632324
Energy: 0.9046278507386045
Energy: 1.170219997606823
Energy: 0.9046278507386045
Energy: 0.6851354048724382
Energy: 0.7778320425618339
Energy: 0.7773304771288161
Energy: 0.7778320425618339
Energy: 0.7349840310901985
Energy: 1.307392590276521
Energy: 1.1850229310753693
Energy: 1.3073925902771295

minimum gb energy = 0.6847967789439386 eV
minimum distance =  2.19108281947716 Angstroms
sigma value = 113


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

Energy: 0.02040930527515811
Energy: 0.021567615195672133
Energy: 2.1310398654239986
Energy: 0.021567615197543202
Energy: 1.1763331278718523
Energy: 0.42764019035062667
Energy: 0.42830013507286024
Energy: 0.42764019035109446
Energy: 0.02040930527515811
Energy: 0.02156761519525634
Energy: 2.131039865424414
Energy: 0.021567615197075438
Energy: 1.1763331278718523
Energy: 0.42764019035062667
Energy: 0.4283001350746793
Energy: 0.42764019035156225
Energy: 0.02040930527515811
Energy: 0.021567615195672133
Energy: 1.176511373489209
Energy: 0.021567615197075438
Energy: 1.1763331278727358
Energy: 0.4276401903502109
Energy: 0.42830013507421155
Energy: 0.42764019035109446

minimum gb energy = 0.02040930527515811 eV
minimum distance =  2.47854843619353 Angstroms
sigma value = 1