Model name: model_name=EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_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=3.5192936509847637
cohesive_energy=4.450092204567907
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.27094118279794e-19, 3.1441434700942797e-19, 3.73960843788672e-19, 4.19856795646236e-19, 4.576040771432759e-19, 4.895450705187e-19, 5.15384975271852e-19, 5.37671252250792e-19, 5.58300878590176e-19, 5.78252784213378e-19, 5.97890663216316e-19, 6.1663773201075e-19, 6.339604657775579e-19, 6.496409684945159e-19, 6.635302377346619e-19, 6.75482475424302e-19, 6.85480057620462e-19, 6.9362231927445e-19, 7.00082295462738e-19, 7.05044236498236e-19, 7.086699622209779e-19, 7.11108475057926e-19, 7.124895513164339e-19, 7.12926945537516e-19, 7.12483142609898e-19, 7.111228946476319e-19, 7.088173624713059e-19, 7.054223501838599e-19, 7.005917876323499e-19, 6.93788945644386e-19, 6.842784251449619e-19, 6.71230298637666e-19, 6.537793907401379e-19, 6.308442322244279e-19, 6.00966842353596e-19, 5.622037808705999e-19, 5.12433765912024e-19, 4.49452202429484e-19, 3.71363715464958e-19, 2.7737042105471397e-19, 1.6851854054075398e-19, 3.95018251289334e-20, -1.24927319771199e-19, -3.40964016011442e-19, -6.297467412301379e-19, -1.020652205099994e-18, -1.5528311958494338e-18, -2.28050617730292e-18, -3.3066522460809e-18, -4.8161269400376596e-18, -7.149120423870419e-18, -1.090188273192228e-17, -1.71205390755972e-17, -2.5854804995848195e-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: 0.018110112842301913
Energy: 0.15187067899689452
Energy: 0.8260624781290549
Energy: 0.01849965732316589
Energy: 0.15187067899755632
Energy: 0.7977258059362006
Energy: 0.01849965732316589
Energy: 0.7977258059368256
Energy: 0.8260624781296799
Energy: 0.01849965732316589
Energy: 0.018110112842301913
Energy: 0.15187067899755632
Energy: 0.01849965732316589
Energy: 0.7977258059387743
Energy: 0.15187067899689452
Energy: 0.7977258059303916

minimum gb energy = 0.018110112842301913 eV
minimum distance =  2.4668236348653 Angstroms
sigma value = 1


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

Energy: 1.3721693163567874
Energy: 1.2132343007120534
Energy: 1.213832723765149
Energy: 1.1737206423088375
Energy: 1.1787826440505276
Energy: 1.280262230074104
Energy: 1.1781116854130032
Energy: 1.2802622300773143
Energy: 1.2153502260412403
Energy: 1.2143811398554136
Energy: 1.3775775363405391
Energy: 1.2143811398570188
Energy: 1.1885267096155177
Energy: 1.2813307152676108
Energy: 1.1790182183675149
Energy: 1.2813307152676108
Energy: 1.3623171784785006
Energy: 1.1810918297112647
Energy: 1.179385475297498
Energy: 1.1810918297120674
Energy: 1.279187940308305
Energy: 1.1793034404504144
Energy: 1.1797177993643873
Energy: 1.1793034404520197
Energy: 1.234938226986017
Energy: 1.27025374259972
Energy: 1.3604650115527646
Energy: 1.2702537426029306
Energy: 1.2439196785024997
Energy: 1.468531502462874
Energy: 1.3339972292562923
Energy: 1.468531502462874
Energy: 1.3135549752483253
Energy: 1.3420078423987156
Energy: 1.3108228816863414
Energy: 1.3420078424003206
Energy: 1.3226769890437506
Energy: 1.440169823966485
Energy: 1.2840752926351915
Energy: 1.4401698239640772
Energy: 1.280447917290639
Energy: 1.3396286132452233
Energy: 1.3150356439536872
Energy: 1.3396286132452233
Energy: 1.2418804790874263
Energy: 1.473285040482427
Energy: 1.3336084606861776
Energy: 1.4732850404808218
Energy: 1.2325919122798932
Energy: 1.2707893759290148
Energy: 1.189878956674284
Energy: 1.2707893759266071
Energy: 1.2807357546698195
Energy: 1.3748747667143597
Energy: 1.2593039866529603
Energy: 1.37487476671757
Energy: 1.1900813974265412
Energy: 1.1793100996849253
Energy: 1.1826127101848756
Energy: 1.1793100996841228
Energy: 1.2491131110582028
Energy: 1.282462990201762
Energy: 1.1785460051389225
Energy: 1.282462990200157
Energy: 1.2156228493753103
Energy: 1.2130015804538428
Energy: 1.166924328056913
Energy: 1.2130015804546455
Energy: 1.1786837203649558
Energy: 1.1886488620090547
Energy: 1.1897892128408045
Energy: 1.1886488620106601
Energy: 1.180223645503136
Energy: 1.214560680559659
Energy: 1.2200615479065036
Energy: 1.214560680559659
Energy: 1.2986732539238164
Energy: 1.2823074074380312
Energy: 1.1901189076304683
Energy: 1.2823074074380312
Energy: 1.180037431330175
Energy: 1.1804731009091929
Energy: 1.3622273828304072
Energy: 1.1804731009091929
Energy: 1.1798467041056013
Energy: 1.178876060104766
Energy: 1.2787449252383152
Energy: 1.1788760601031611
Energy: 1.2392549378093898
Energy: 1.2712662197243176
Energy: 1.2766683133877124
Energy: 1.2712662197219098
Energy: 1.3282413835091595
Energy: 1.2329360410286716
Energy: 1.2417513728833562
Energy: 1.2329360410262638
Energy: 1.3280211325339835
Energy: 1.3378313557667598
Energy: 1.308459145044142
Energy: 1.3378313557635493
Energy: 1.2817952231848284
Energy: 1.3252722979909768
Energy: 1.3245091104328528
Energy: 1.3252722979925822
Energy: 1.2814538058976905
Energy: 1.3408046380792413
Energy: 1.3015204549226256
Energy: 1.3408046380800438
Energy: 1.3308971463876476
Energy: 1.3926297881717535
Energy: 1.2420210308028807
Energy: 1.3926297881693457
Energy: 1.2594599698400721
Energy: 1.2711534287784891
Energy: 1.2349970999811632
Energy: 1.2711534287792918
Energy: 1.2591035788283382
Energy: 1.2519245874703175
Energy: 1.2801752415928942
Energy: 1.251924587471923
Energy: 1.1787796859091924
Energy: 1.1797964380417563
Energy: 1.2601055617684287
Energy: 1.1797964380409536
Energy: 1.1787196772491673
Energy: 1.1878431167950894
Energy: 1.2491185347348464
Energy: 1.187843116794287
Energy: 1.1641321721998898
Energy: 1.2131681543560837
Energy: 1.2166202396409511
Energy: 1.2131681543576889

minimum gb energy = 1.1641321721998898 eV
minimum distance =  2.28660810626646 Angstroms
sigma value = 1


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

Energy: 1.8877768266373793
Energy: 1.27387058006307
Energy: 1.275418949942691
Energy: 1.2220471076293271
Energy: 1.2302416866562667
Energy: 1.3342757186819887
Energy: 1.2334299870075407
Energy: 1.3342757186865641
Energy: 1.2752947319107943
Energy: 1.2761987955453522
Energy: 1.4336441221561322
Energy: 1.2761987955407768
Energy: 1.2461918495672384
Energy: 1.3349589194372098
Energy: 1.2319122649970422
Energy: 1.3349589194372098
Energy: 1.2300792715477187
Energy: 1.2313651600491717
Energy: 1.23204830277038
Energy: 1.231365160044596
Energy: 1.3511931817034077
Energy: 1.2305720142653285
Energy: 1.2322995461982857
Energy: 1.2305720142726495
Energy: 1.3054572806405333
Energy: 1.339267261697919
Energy: 1.3664284813169152
Energy: 1.3392672616952153
Energy: 1.3024777496761768
Energy: 1.3009823121114041
Energy: 1.4058531632059257
Energy: 1.3009823121168949
Energy: 1.300126986251113
Energy: 1.4065346181262661
Energy: 1.3403972396449368
Energy: 1.4065346181216902
Energy: 1.4023347877743477
Energy: 1.4828652029339247
Energy: 1.3021657405683766
Energy: 1.4828652029302642
Energy: 1.2480928779182505
Energy: 1.3393168824044317
Energy: 1.2996854561396949
Energy: 1.339316882405347
Energy: 1.3253770965637823
Energy: 1.4121719205631147
Energy: 1.3506947840496866
Energy: 1.4121719205603693
Energy: 1.2305012289233335
Energy: 1.2313565822854002
Energy: 1.2468204795538944
Energy: 1.2313565822872303
Energy: 1.2300148384651954
Energy: 1.3358666138393887
Energy: 1.309205654336243
Energy: 1.3358666138375586
Energy: 1.2090615891221055
Energy: 1.2745265283160465
Energy: 1.2770675024512161
Energy: 1.274526528313301
Energy: 1.2475462592633968
Energy: 1.2447979277656223
Energy: 1.2325208168626
Energy: 1.244797927764707
Energy: 1.2759462916709026
Energy: 1.2768642664140426
Energy: 1.4352134454299987
Energy: 1.2768642664094672
Energy: 1.2733316646871753
Energy: 1.3375131182512758
Energy: 1.3735066451758033
Energy: 1.3375131182494455
Energy: 1.2319902635928277
Energy: 1.2307911418463535
Energy: 1.2313136537239533
Energy: 1.2307911418445234
Energy: 1.350908771678383
Energy: 1.2310557574141734
Energy: 1.231971262136092
Energy: 1.2310557574114283
Energy: 1.3500920764945963
Energy: 1.3384222695585914
Energy: 1.3659763514912378
Energy: 1.3384222695512704
Energy: 1.299459843534138
Energy: 1.3400802802951797
Energy: 1.4042859210060117
Energy: 1.340080280297925
Energy: 1.3002704961570177
Energy: 1.4056608948276066
Energy: 1.37925617582818
Energy: 1.405660894832182
Energy: 1.401807238473741
Energy: 1.410282665758066
Energy: 1.301063851856754
Energy: 1.4102826657534906
Energy: 1.3254161646747438
Energy: 1.340181626153912
Energy: 1.3005135903847664
Energy: 1.3401816261575725
Energy: 1.3256258247954735
Energy: 1.3202373041207731
Energy: 1.3510302536051655
Energy: 1.3202373041235185
Energy: 1.231650871638049
Energy: 1.231330945682944
Energy: 1.3241774788005567
Energy: 1.2313309456719626
Energy: 1.2300627139989997
Energy: 1.2456648026613972
Energy: 1.3094745725354842
Energy: 1.2456648026604822
Energy: 1.3118703374940968
Energy: 1.2741906223596973
Energy: 1.2751851149982805
Energy: 1.2741906223725088

minimum gb energy = 1.2090615891221055 eV
minimum distance =  2.27237039538373 Angstroms
sigma value = 25


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

Energy: 1.8175099015779954
Energy: 1.3423417277570342
Energy: 1.3555366928557633
Energy: 1.2734487342868057
Energy: 1.3450616808110039
Energy: 1.387659634869045
Energy: 1.2887467509780792
Energy: 1.3876596348679813
Energy: 1.343206225616217
Energy: 1.349359032133529
Energy: 1.4411745776744618
Energy: 1.3493590321324649
Energy: 1.3378780265082213
Energy: 1.3877667101409308
Energy: 1.2882565348624686
Energy: 1.3877667101409308
Energy: 1.2826202591304818
Energy: 1.2859395617346903
Energy: 1.2877467998392849
Energy: 1.2859395617357543
Energy: 1.481544049567276
Energy: 1.2852463577456923
Energy: 1.2849694245278676
Energy: 1.2852463577456923
Energy: 1.374376170810847
Energy: 1.4514320239989538
Energy: 1.3901149459113387
Energy: 1.4514320240010814
Energy: 1.3403407432230474
Energy: 1.341798236404219
Energy: 1.4860872537275929
Energy: 1.341798236404219
Energy: 1.3418123844234218
Energy: 1.4528050196631572
Energy: 1.3125772565927234
Energy: 1.4528050196631572
Energy: 1.483973714131081
Energy: 1.4239604981456677
Energy: 1.2862718057840186
Energy: 1.4239604981456677
Energy: 1.2545511596997267
Energy: 1.3337408942943827
Energy: 1.284982289542905
Energy: 1.3337408942954465
Energy: 1.3714396883283833
Energy: 1.3882332179443393
Energy: 1.2885719577745556
Energy: 1.3882332179443393
Energy: 1.354823164223746
Energy: 1.3411041003354454
Energy: 1.2539448229296488
Energy: 1.3411041003343815
Energy: 1.2874298712322907
Energy: 1.3876929288858562
Energy: 1.3106835160635935
Energy: 1.38769292888692
Energy: 1.4695313886565449
Energy: 1.3448581712078174
Energy: 1.344608948838916
Energy: 1.3448581712078174
Energy: 1.448785536514328
Energy: 1.3881513825909186
Energy: 1.3387486135362894
Energy: 1.3881513825887912
Energy: 1.2855287669399291
Energy: 1.2852514699313236
Energy: 1.2826784839855838
Energy: 1.2852514699323876
Energy: 1.2869880757989662
Energy: 1.2846879142671563
Energy: 1.4817024426008474
Energy: 1.2846879142660927
Energy: 1.3934965276000566
Energy: 1.4523502323198012
Energy: 1.4348139995164555
Energy: 1.4523502323187376
Energy: 1.4880106953413512
Energy: 1.4225936724722106
Energy: 1.3440579779482225
Energy: 1.4225936724722106
Energy: 1.40381401441095
Energy: 1.4509536162554728
Energy: 1.3423409993906745
Energy: 1.4509536162586645
Energy: 1.4040698271423966
Energy: 1.458050909195511
Energy: 1.4860692727775893
Energy: 1.4580509091944467
Energy: 1.2839801310357588
Energy: 1.28493348395199
Energy: 1.3719663539833746
Energy: 1.28493348395199
Energy: 1.287611288576172
Energy: 1.3407050324647585
Energy: 1.3714043538950424
Energy: 1.3407050324636947
Energy: 1.2542003855725712
Energy: 1.3404578741035347
Energy: 1.3550458385837871
Energy: 1.3404578741035347

minimum gb energy = 1.2539448229296488 eV
minimum distance =  2.2566930226031 Angstroms
sigma value = 9


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

Energy: 1.579336021084995
Energy: 1.4170757983664264
Energy: 1.4161831315442321
Energy: 1.365218752977976
Energy: 1.4434903097462957
Energy: 1.4593459929234813
Energy: 1.433236202343369
Energy: 1.4593459929247503
Energy: 1.442902246366645
Energy: 1.4427209696338668
Energy: 2.0279553466704647
Energy: 1.4427209696325975
Energy: 1.4429183029831014
Energy: 1.4596811435246801
Energy: 1.3718832608705427
Energy: 1.4596811435259494
Energy: 1.5041897263112245
Energy: 1.411755809964821
Energy: 1.3871607698929307
Energy: 1.4117558099660903
Energy: 1.6172045118623373
Energy: 1.3706772054418666
Energy: 1.3726276269584459
Energy: 1.3706772054431358
Energy: 1.3940246183551908
Energy: 1.520501151471106
Energy: 1.4143491546093103
Energy: 1.5205011514698368
Energy: 1.4693344838691123
Energy: 1.512608080991422
Energy: 1.5771262555151153
Energy: 1.5126080809926905
Energy: 1.4372788243540955
Energy: 1.4984094371185805
Energy: 1.3447430610708557
Energy: 1.4984094371223877
Energy: 1.5527646884434643
Energy: 1.2899918216918882
Energy: 1.3692597292538788
Energy: 1.289991821690619
Energy: 1.287261004252295
Energy: 1.348203648360872
Energy: 1.3448811028954846
Energy: 1.348203648360872
Energy: 1.5321205500868254
Energy: 1.2893192616577238
Energy: 1.34964575755171
Energy: 1.289319261660262
Energy: 1.532543749166424
Energy: 1.518005963219681
Energy: 1.442282804712159
Energy: 1.518005963219681
Energy: 1.5049950855619394
Energy: 1.3597389059138134
Energy: 1.546095377961851
Energy: 1.3597389059150822
Energy: 1.3243119244798993
Energy: 1.4011524604734982
Energy: 1.422097659832996
Energy: 1.4011524604722294
Energy: 1.6142926589880457
Energy: 1.4167096698967525
Energy: 1.3700740885838332
Energy: 1.4167096698954833
Energy: 1.5016009949466045
Energy: 1.539439874325292
Energy: 1.6086497553501444
Energy: 1.539439874325292
Energy: 1.4298594305759489
Energy: 1.537604820794612
Energy: 1.6038605876819507
Energy: 1.53760482079715
Energy: 1.367704237188441
Energy: 1.4248782386176642
Energy: 1.4931732542975105
Energy: 1.4248782386202024
Energy: 1.4702168082931233
Energy: 1.4315675049822219
Energy: 1.4207727878071639
Energy: 1.4315675049796839
Energy: 1.3411857873323971
Energy: 1.4162395896825357
Energy: 1.4169506385254826
Energy: 1.4162395896812667

minimum gb energy = 1.287261004252295 eV
minimum distance =  2.19942488232812 Angstroms
sigma value = 25


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

Energy: 1.5040320959445597
Energy: 1.4747061026541985
Energy: 1.4777885398781763
Energy: 1.3512905525171262
Energy: 1.4751493964258713
Energy: 1.4150147812894025
Energy: 1.520972319889294
Energy: 1.4150147812894025
Energy: 1.4628536233981924
Energy: 1.480041858987149
Energy: 1.4627137316342018
Energy: 1.4800418589855797
Energy: 1.4862406498738905
Energy: 1.4153983629869988
Energy: 1.520679398391788
Energy: 1.415398362988568
Energy: 1.3516240457768542
Energy: 1.4613404773014493
Energy: 1.3578634073178792
Energy: 1.4613404773014493
Energy: 1.6980106182678962
Energy: 1.335267776392245
Energy: 1.3315613028303155
Energy: 1.3352677763938143
Energy: 1.3084480530066478
Energy: 1.463860419026801
Energy: 1.3357205040688744
Energy: 1.463860419026801
Energy: 1.500803046681462
Energy: 1.417649999722204
Energy: 1.5203168606078625
Energy: 1.417649999722204
Energy: 1.4750526081785438
Energy: 1.474268846872621
Energy: 1.603782940665141
Energy: 1.4742688468710519
Energy: 1.4731129696166063
Energy: 1.4174362216373413
Energy: 1.6449399039534864
Energy: 1.4174362216389107
Energy: 1.4619103380019864
Energy: 1.4789736247935654
Energy: 1.4702607828670062
Energy: 1.4789736247919958
Energy: 1.6576767289830516
Energy: 1.4181665751152253
Energy: 1.4875372402024567
Energy: 1.4181665751152253
Energy: 1.5230806134649293
Energy: 1.4611607440630687
Energy: 1.4107326103017468
Energy: 1.4611607440630687
Energy: 1.3344384905558309
Energy: 1.4549815835041084
Energy: 1.7028238080346534
Energy: 1.4549815835025393
Energy: 1.3575658288181378
Energy: 1.4869138221948897
Energy: 1.5007109943116919
Energy: 1.4869138221948897
Energy: 1.519941561354852
Energy: 1.4643526025032032
Energy: 1.3090624751684525
Energy: 1.4643526025032032
Energy: 1.601580799398005
Energy: 1.4744931440208116
Energy: 1.4829013643714521
Energy: 1.4744931440208116

minimum gb energy = 1.3084480530066478 eV
minimum distance =  2.23352692089166 Angstroms
sigma value = 17


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

Energy: 1.9969020705236558
Energy: 1.6060584688919717
Energy: 1.605661395552539
Energy: 1.5287230515022363
Energy: 1.450298516010204
Energy: 1.5022049459966709
Energy: 1.6427656495787697
Energy: 1.5022049459984486
Energy: 1.449041288458208
Energy: 1.4383363216703904
Energy: 1.8453488484519354
Energy: 1.4383363216695013
Energy: 1.4352868387050364
Energy: 1.5010909029345891
Energy: 1.6807628090277176
Energy: 1.5010909029363668
Energy: 1.4363392702466478
Energy: 1.593341401219193
Energy: 1.3606452961914022
Energy: 1.593341401220082
Energy: 1.6812351821779077
Energy: 1.5043419734456576
Energy: 1.43618586808742
Energy: 1.5043419734412538
Energy: 1.5002040893597288
Energy: 1.43634143815745
Energy: 1.441321937922359
Energy: 1.4363414381565611
Energy: 1.7444285319848645
Energy: 1.435187423270595
Energy: 1.450640615932384
Energy: 1.4351874232697064
Energy: 1.6085853528364082
Energy: 1.6022703009208727
Energy: 1.5877743213994557
Energy: 1.6022703009226504
Energy: 1.603410872817234
Energy: 1.5235180790521439
Energy: 1.6559921255870633
Energy: 1.5235180790476999
Energy: 1.4339247657944374
Energy: 1.4121915473829683
Energy: 1.4725179067468912
Energy: 1.4121915473820794
Energy: 1.8388972415932123
Energy: 1.3769871344632976
Energy: 1.3766671182541823
Energy: 1.3769871345592524
Energy: 1.6361083576596671
Energy: 1.471748137711171
Energy: 1.3802824187304439
Energy: 1.4717481377093933
Energy: 1.5032782445016195
Energy: 1.5167697119634773
Energy: 1.4734851180620474
Energy: 1.5167697119634773
Energy: 1.5992560717382347
Energy: 1.6006081580293359
Energy: 1.6735438066542672
Energy: 1.600608158028447
Energy: 1.606294982500146
Energy: 1.6008363969487065
Energy: 1.6764370072998283
Energy: 1.6008363969460402
Energy: 1.5915523862722183
Energy: 1.4366188613702588
Energy: 1.4490122809221846
Energy: 1.4366188613711477
Energy: 1.5911351892193193
Energy: 1.436284451841451
Energy: 1.4357356018565801
Energy: 1.436284451841451
Energy: 1.6795177489470152
Energy: 1.6306581633007173
Energy: 1.4369558688714257
Energy: 1.630658163301606
Energy: 1.509418220517833
Energy: 1.5963671976958003
Energy: 1.6528127554666014
Energy: 1.5963671976958003
Energy: 1.4359324132877385
Energy: 1.50090427984148
Energy: 1.7792999704158843
Energy: 1.5009042798379244
Energy: 1.449616775272794
Energy: 1.4381905510510657
Energy: 1.675874231705802
Energy: 1.4381905510510657
Energy: 1.601550458435583
Energy: 1.5237681301897246
Energy: 1.606620402351215
Energy: 1.5237681301915023
Energy: 1.5886623061036336
Energy: 1.602151138759545
Energy: 1.5891920929130539
Energy: 1.6021511387604341
Energy: 1.4736358040523065
Energy: 1.5023419551514101
Energy: 1.6042665110316483
Energy: 1.5023419551451882
Energy: 1.4228357862303689
Energy: 1.4141314421333406
Energy: 1.5868987118700686
Energy: 1.414131442131563
Energy: 1.3697371911346412
Energy: 1.3738751849006867
Energy: 1.8355738740992007
Energy: 1.3738751849024646
Energy: 1.4028128617022821
Energy: 1.3768908181698762
Energy: 1.5028727885419446
Energy: 1.3768908181680986
Energy: 1.4726888023413263
Energy: 1.5278854816929985
Energy: 1.636180000006905
Energy: 1.5278854816929985
Energy: 1.9998379900418204
Energy: 1.602726174582455
Energy: 1.6011128314957361
Energy: 1.602726174582455

minimum gb energy = 1.3606452961914022 eV
minimum distance =  2.19745448251606 Angstroms
sigma value = 53


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

Energy: 1.8167195466073147
Energy: 1.5135882042583375
Energy: 1.5403860614060467
Energy: 1.3803362467948346
Energy: 1.5076515997166282
Energy: 1.4056107977990315
Energy: 1.51605573815354
Energy: 1.4056107977990315
Energy: 1.506224134619828
Energy: 1.5135782657394716
Energy: 1.5606525429866474
Energy: 1.513578265741518
Energy: 1.5089134441013967
Energy: 1.4072945782945
Energy: 1.6063787868513082
Energy: 1.4072945782985462
Energy: 1.6408192817256775
Energy: 1.4419636707736434
Energy: 1.3017507984043806
Energy: 1.441963670777736
Energy: 1.6763851505424872
Energy: 1.4154311496052097
Energy: 1.3022888034948723
Energy: 1.415431149607256
Energy: 1.8330558227552927
Energy: 1.5116055731745197
Energy: 1.503053177470241
Energy: 1.5116055731745197
Energy: 1.6878228144326077
Energy: 1.4058211515532595
Energy: 1.5043610219624626
Energy: 1.4058211515532595
Energy: 1.5048270338135723
Energy: 1.5131869664209048
Energy: 1.5592547812153608
Energy: 1.5131869664209048
Energy: 1.5770141360925207
Energy: 1.4061033053440042
Energy: 1.6546977255871267
Energy: 1.4061033053440042
Energy: 1.639202513690745
Energy: 1.4607101048528497
Energy: 1.3049227533942735
Energy: 1.460710104854896
Energy: 1.6063083192723593
Energy: 1.4184238618380898
Energy: 1.3020289937804463
Energy: 1.418423861840136
Energy: 1.6875514285286568
Energy: 1.407222611978185
Energy: 1.5091210989240702
Energy: 1.4072226119740925

minimum gb energy = 1.3017507984043806 eV
minimum distance =  2.30182613040029 Angstroms
sigma value = 9


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

Energy: 1.7984110259959083
Energy: 1.7101033917347328
Energy: 1.6992125728641863
Energy: 1.640462625038427
Energy: 1.4518293339720258
Energy: 1.417677370791738
Energy: 1.707808926969613
Energy: 1.4176773707932528
Energy: 1.432496506308029
Energy: 1.417920733636052
Energy: 1.6933586906966074
Energy: 1.4179207336368091
Energy: 1.4108934562367332
Energy: 1.4160621692767374
Energy: 1.91484626336166
Energy: 1.4160621692759805
Energy: 1.4463099489799833
Energy: 1.4177309139940146
Energy: 1.8156229281928908
Energy: 1.4177309139969754
Energy: 1.4499973783415487
Energy: 1.590228827191114
Energy: 1.84016086884682
Energy: 1.5902288271949008
Energy: 1.7816415639067529
Energy: 1.700050798077382
Energy: 1.7092530477676893
Energy: 1.7000507980796542
Energy: 1.7052105879277635
Energy: 1.6872781232836254
Energy: 1.710122495547785
Energy: 1.6872781232828682
Energy: 1.5132627411164583
Energy: 1.5949814784636234
Energy: 1.4939244802190728
Energy: 1.5949814784621084
Energy: 1.4101668027307142
Energy: 1.4975206843857647
Energy: 1.7005137715167442
Energy: 1.497520684386522
Energy: 1.5140330539337805
Energy: 1.554895540692809
Energy: 1.7105073733183964
Energy: 1.5548955406935667
Energy: 1.528319438608588
Energy: 1.6457735852356887
Energy: 1.8048520504912706
Energy: 1.6457735852356887
Energy: 1.7020170578476466
Energy: 1.555588889113035
Energy: 1.5314866183908245
Energy: 1.555588889113792
Energy: 1.7868481747304545
Energy: 1.5177833261134783
Energy: 1.5257394138054707
Energy: 1.5177833261120326
Energy: 1.7029104844192315
Energy: 1.5158699118423153
Energy: 1.4922534178551197
Energy: 1.515869911841558
Energy: 1.5791038801800494
Energy: 1.5517763717451756
Energy: 1.4922767140406257
Energy: 1.5517763717451756
Energy: 1.7017514552211124
Energy: 1.4171603499745657
Energy: 1.5147348317784062
Energy: 1.4171603499745657
Energy: 1.6978763351930048
Energy: 1.702777265468977
Energy: 1.7999073062603297
Energy: 1.7027772654667048
Energy: 1.7084408747278235
Energy: 1.4176406921302962
Energy: 1.5341084635316256
Energy: 1.4176406921340832
Energy: 1.6933221164709629
Energy: 1.4447476803146913
Energy: 1.4354100890705017
Energy: 1.444747680310147
Energy: 1.907266734752833
Energy: 1.4167206045863632
Energy: 1.4131286093165942
Energy: 1.4167206045871206
Energy: 1.8392620105501616
Energy: 1.4170953538372892
Energy: 1.460811274708581
Energy: 1.4170953538350173
Energy: 1.8145054828601554
Energy: 1.5848375178050356
Energy: 1.4495283866819695
Energy: 1.5848375178050356
Energy: 1.709031460351855
Energy: 1.6966727244713486
Energy: 1.7865528300588052
Energy: 1.6966727244698339
Energy: 1.6919389324981609
Energy: 1.7198976779882118
Energy: 1.7826131645566607
Energy: 1.7198976779874544
Energy: 1.494423695110498
Energy: 1.5948892084903037
Energy: 1.5115254500702326
Energy: 1.5948892084903037
Energy: 1.702184799351466
Energy: 1.4977058029141797
Energy: 1.4057224550597855
Energy: 1.4977058029156942
Energy: 1.699724369024057
Energy: 1.5536011707258444
Energy: 1.5168169920496368
Energy: 1.553601170726602
Energy: 1.8009448380394224
Energy: 1.5158573636598498
Energy: 1.5281524416518304
Energy: 1.5158573636628794
Energy: 1.5316368204377726
Energy: 1.5533823947611536
Energy: 1.8019750839763622
Energy: 1.5533823947611536
Energy: 1.5275877539237492
Energy: 1.5185841347438906
Energy: 1.7025377787764406
Energy: 1.5185841347416185
Energy: 1.4997599547406442
Energy: 1.5280411687008408
Energy: 1.74953574236647
Energy: 1.5280411687008408
Energy: 1.491508648749287
Energy: 1.5472478611767915
Energy: 1.5781619676393237
Energy: 1.5472478611775486
Energy: 1.5132504047860016
Energy: 1.5827948744532454
Energy: 1.6517045153426266
Energy: 1.5827948744547602
Energy: 1.8078085083656337
Energy: 1.7021522260829078
Energy: 1.6988558644234013
Energy: 1.7021522260844228

minimum gb energy = 1.4057224550597855 eV
minimum distance =  2.21661176647389 Angstroms
sigma value = 73


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

Energy: 1.878016184957811
Energy: 1.609940855903322
Energy: 1.6812448788589995
Energy: 1.6205980887107692
Energy: 1.482884737204795
Energy: 1.6124290490633089
Energy: 1.6965064224542905
Energy: 1.6124290490633089
Energy: 1.4830308468919362
Energy: 1.4284740729266043
Energy: 1.6458816033747243
Energy: 1.4284740729242011
Energy: 1.426988457677335
Energy: 1.429867695807339
Energy: 1.8727235831350468
Energy: 1.4298676958061372
Energy: 1.4730066365756054
Energy: 1.4285559153359921
Energy: 1.8217853569445976
Energy: 1.4285559153371938
Energy: 1.4813352856510573
Energy: 1.6673488771885383
Energy: 1.8210242461168726
Energy: 1.6673488771861351
Energy: 1.5579855807087533
Energy: 1.8003223497571732
Energy: 1.6790762293606956
Energy: 1.800322349758375
Energy: 1.5580602751040067
Energy: 1.6684085824424573
Energy: 1.6803237358198562
Energy: 1.668408582440054
Energy: 1.5255062383377824
Energy: 1.4100598458148208
Energy: 1.645984861061241
Energy: 1.4100598458136193
Energy: 1.4837746574730681
Energy: 1.6232944513724705
Energy: 1.6669678893162398
Energy: 1.6232944513748737
Energy: 1.5778701403596693
Energy: 1.5305581742122742
Energy: 1.4890485873751784
Energy: 1.5305581742122742
Energy: 1.561632640053844
Energy: 1.5246051897363566
Energy: 1.7213920250355228
Energy: 1.5246051897363566
Energy: 1.6456167580988814
Energy: 1.5327638856881292
Energy: 1.5462787684738555
Energy: 1.5327638856881292
Energy: 1.6482040438927092
Energy: 1.5780635708180153
Energy: 1.5472098928491527
Energy: 1.5780635708180153
Energy: 1.7365180688979487
Energy: 1.5633013320970635
Energy: 1.479310248405548
Energy: 1.563301332095862
Energy: 1.822312469978748
Energy: 1.4815867032913284
Energy: 1.4880645116471896
Energy: 1.4815867032937318
Energy: 1.8607673122616226
Energy: 1.6137801495824926
Energy: 1.494869584928333
Energy: 1.6137801495848958
Energy: 1.688977428874426
Energy: 1.5899804398467516
Energy: 2.2040287309299913
Energy: 1.589980439849155
Energy: 1.6299048350052563
Energy: 1.6127387148953982
Energy: 1.610401473656762
Energy: 1.6127387148966
Energy: 1.6046029522619099
Energy: 1.5678489463351033
Energy: 1.6143101090219474
Energy: 1.5678489463351033
Energy: 1.5993895318093436
Energy: 1.5657700872614027
Energy: 1.4824423919037
Energy: 1.5657700872614027
Energy: 1.8402154671183906
Energy: 1.6890316200857634
Energy: 1.6585542205037824
Energy: 1.6890316200857634

minimum gb energy = 1.4100598458136193 eV
minimum distance =  2.11791238335752 Angstroms
sigma value = 7


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

Energy: 2.1292610738672337
Energy: 1.7234052511277091
Energy: 1.7236867455696165
Energy: 1.5698545802783148
Energy: 1.5471119947355554
Energy: 1.656064177233332
Energy: 1.7196555932240614
Energy: 1.656064177225685
Energy: 1.450941484397551
Energy: 1.4213503217033814
Energy: 1.547926753084048
Energy: 1.4213503216948846
Energy: 1.4180664349365006
Energy: 1.4946484039307528
Energy: 1.7642609593874938
Energy: 1.4946484039417987
Energy: 1.5226153785840157
Energy: 1.4229536675515677
Energy: 1.660059384638185
Energy: 1.4229536675583652
Energy: 1.5239806732191334
Energy: 1.4208966915464396
Energy: 1.661870575848895
Energy: 1.4208966915472891
Energy: 1.8350667434261023
Energy: 1.6479026717186493
Energy: 1.5244036985950276
Energy: 1.6479026717169498
Energy: 1.696719413032519
Energy: 1.4225662765089568
Energy: 1.491762657914144
Energy: 1.4225662765089568
Energy: 1.7682745488185285
Energy: 1.4220200419437214
Energy: 1.4192009312932141
Energy: 1.4220200419386237
Energy: 1.660602596214072
Energy: 1.4206512972406107
Energy: 1.4517001407199293
Energy: 1.4206512972516563
Energy: 1.7196400587245708
Energy: 1.6519712393334842
Energy: 1.4868514877206005
Energy: 1.6519712393326347
Energy: 1.5506286886792324
Energy: 1.5511463811270132
Energy: 1.83623013174164
Energy: 1.5511463811287125
Energy: 1.5510545222734806
Energy: 1.6566894412968352
Energy: 1.552549201622627
Energy: 1.656689441299384
Energy: 1.5491437749996182
Energy: 1.5330810571401727
Energy: 1.4305041525351343
Energy: 1.533081057138473
Energy: 1.5510585570949813
Energy: 1.5553635025512784
Energy: 1.4371324623932338
Energy: 1.5553635025487291
Energy: 1.5673262614657721
Energy: 1.5501401148168388
Energy: 1.5490898569843357
Energy: 1.550140114815989
Energy: 1.5666582654186045
Energy: 1.6545620882503098
Energy: 1.7194834164806547
Energy: 1.6545620882562575
Energy: 1.4519777890942698
Energy: 1.4207417588328248
Energy: 1.5471392743120052
Energy: 1.420741758837073
Energy: 1.418691762077642
Energy: 1.4218230398960265
Energy: 1.7671368817229607
Energy: 1.4218230398968763
Energy: 1.495149760913969
Energy: 1.4223161961498023
Energy: 1.7225566468414732
Energy: 1.4223161961574493
Energy: 1.5247027323827522
Energy: 1.6475530877035045
Energy: 1.6661282612447352
Energy: 1.6475530877043543
Energy: 1.8277726230775218
Energy: 1.421233266353738
Energy: 1.5235643869231494
Energy: 1.4212332663528884
Energy: 1.83184271162908
Energy: 1.4226657195714285
Energy: 1.522952838126141
Energy: 1.4226657195680297
Energy: 1.7909061016899777
Energy: 1.4942715452700124
Energy: 1.4154442510398355
Energy: 1.494271545260666
Energy: 1.663003148474325
Energy: 1.4202083023027643
Energy: 1.4516109469630767
Energy: 1.4202083022993657
Energy: 1.6628424504959576
Energy: 1.6577974167125722
Energy: 1.4517095554337132
Energy: 1.657797416708324
Energy: 1.7268775682454112
Energy: 1.727159367357568
Energy: 1.8929452018763249
Energy: 1.7271593673592673
Energy: 1.5525566764573837
Energy: 1.6558126589691546
Energy: 1.5516915638806765
Energy: 1.6558126589742526
Energy: 1.5476052744065916
Energy: 1.5348376129815067
Energy: 1.5515683806575697
Energy: 1.5348376129739367
Energy: 1.551337206449981
Energy: 1.5833281929499796
Energy: 1.4299113308448341
Energy: 1.5833281929525287
Energy: 1.566966724417411
Energy: 1.5510640617649976
Energy: 1.6328648198978293
Energy: 1.5510640617700957

minimum gb energy = 1.4154442510398355 eV
minimum distance =  2.10722000969123 Angstroms
sigma value = 29


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

Energy: 1.3045798715220478
Energy: 1.3300398651954113
Energy: 1.3361452543322432
Energy: 1.4785851476320127
Energy: 1.4364789409454444
Energy: 1.33973285764452
Energy: 1.433104046903335
Energy: 1.339732857644224
Energy: 1.3320598333093312
Energy: 1.4770201152642155
Energy: 1.3156861128342041
Energy: 1.4770201152653664
Energy: 1.362483870660554
Energy: 1.3293295594200136
Energy: 1.4283857464623329
Energy: 1.3293295594200136
Energy: 1.32521824612154
Energy: 1.3387449754183456
Energy: 1.306784178168434
Energy: 1.3387449754180496
Energy: 1.330531017947977
Energy: 1.475934324828924
Energy: 1.3069800074612072
Energy: 1.475934324828628
Energy: 1.3182631188554663
Energy: 1.4768061923327682
Energy: 1.431585595579234
Energy: 1.4768061923324722
Energy: 1.4331197751039142
Energy: 1.3300907006414362
Energy: 1.3594146880443283
Energy: 1.3300907006405813
Energy: 1.3073987020702023
Energy: 1.332751645367908
Energy: 1.330726097465943
Energy: 1.3327516453670532

minimum gb energy = 1.3045798715220478 eV
minimum distance =  2.21549928919851 Angstroms
sigma value = 5


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

Energy: 1.8981983607738597
Energy: 1.36969014846056
Energy: 1.367207500572871
Energy: 1.4570752359784058
Energy: 1.659074011054316
Energy: 1.3673869334087758
Energy: 1.6746610399629935
Energy: 1.3673869334111837
Energy: 1.6466759515695346
Energy: 1.4716975958922105
Energy: 1.5955898340875216
Energy: 1.4716975958874676
Energy: 1.4829678853305597
Energy: 1.4729070527996404
Energy: 1.6227041956818282
Energy: 1.4729070528044563
Energy: 1.4817346119493064
Energy: 1.374375773171907
Energy: 1.5104252391859412
Energy: 1.374375773167894
Energy: 1.366043070548613
Energy: 1.3737555645053827
Energy: 1.483889577193405
Energy: 1.3737555645005675
Energy: 1.3653230663379388
Energy: 1.365664100963606
Energy: 1.6227895945376827
Energy: 1.3656641009676187
Energy: 1.3665954265198679
Energy: 1.3699368860011416
Energy: 1.9061586084505757
Energy: 1.369936886002747
Energy: 1.3673788173265802
Energy: 1.5237405719979449
Energy: 1.7297687274796192
Energy: 1.5237405720011552
Energy: 1.6884942484990382
Energy: 1.3565541138709223
Energy: 1.356683946457971
Energy: 1.3565541138749353
Energy: 1.6883528415561786
Energy: 1.3561007985141373
Energy: 1.3615365353560342
Energy: 1.356100798510927
Energy: 1.7471445594507824
Energy: 1.3583554530919535
Energy: 1.3811400318607945
Energy: 1.358355453101585
Energy: 1.701264540344067
Energy: 1.360663076512509
Energy: 1.4497190319568183
Energy: 1.3606630765141143
Energy: 1.4589952801091124
Energy: 1.44648092660964
Energy: 1.69738034407217
Energy: 1.4464809266048242
Energy: 1.4577288905754648
Energy: 1.3469627295500128
Energy: 1.7337869178399767
Energy: 1.3469627295516182
Energy: 1.4919505364894134
Energy: 1.3424469587429648
Energy: 1.3732168710093664
Energy: 1.3424469587461751
Energy: 1.5647099118108674
Energy: 1.558730044173259
Energy: 2.2169342510024217
Energy: 1.5587300441740617
Energy: 1.7421232137214513
Energy: 1.3442465094118248
Energy: 1.3729795512847713
Energy: 1.34424650941343
Energy: 1.688324427738008
Energy: 1.5485136720297394
Energy: 1.373000874275699
Energy: 1.5485136720289367
Energy: 1.7243793458051409
Energy: 1.5456696553587552
Energy: 1.4788312708852251
Energy: 1.5456696553627682
Energy: 1.4828697604263348
Energy: 1.3743375766743797
Energy: 1.4856578765642485
Energy: 1.374337576671972
Energy: 1.4908078364279882
Energy: 1.3723760036035817
Energy: 1.3715717326984507
Energy: 1.3723760036116077
Energy: 1.7154370570351074
Energy: 1.371690583631911
Energy: 1.3734777940704774
Energy: 1.371690583630306
Energy: 1.7021194445152286
Energy: 1.3751907327156876
Energy: 1.3725716810245419
Energy: 1.375190732714885
Energy: 1.7454163534100102
Energy: 1.3507362193221657
Energy: 1.4620766259874978
Energy: 1.3507362193189554
Energy: 1.3530307245619675
Energy: 1.3518149365464613
Energy: 1.6881414359418612
Energy: 1.3518149365416459
Energy: 1.3561247533026428
Energy: 1.3521673014247801
Energy: 1.4693703450689453
Energy: 1.3521673014200373
Energy: 1.381157551701858
Energy: 1.3520863246563328
Energy: 1.3721464883927375
Energy: 1.352086324653925
Energy: 1.3528454128647374
Energy: 1.5404861867839772
Energy: 1.9032283386615845
Energy: 1.5404861867824449
Energy: 1.7361185233554097
Energy: 1.442029701250284
Energy: 1.4651440653912418
Energy: 1.4420297012510865
Energy: 1.717800619978604
Energy: 1.3669881513852946
Energy: 1.3648917077440383
Energy: 1.3669881513877027
Energy: 1.6379023144765028
Energy: 1.3662472982751033
Energy: 1.3699983766491888
Energy: 1.3662472982743006
Energy: 1.4720416027854293
Energy: 1.365226662913661
Energy: 1.3685575789038353
Energy: 1.3652266629160685

minimum gb energy = 1.3424469587429648 eV
minimum distance =  2.15874099151175 Angstroms
sigma value = 1


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

Energy: 1.905244298000911
Energy: 1.313361039880522
Energy: 1.314124476242069
Energy: 1.3897211375489547
Energy: 1.7110705773901598
Energy: 1.3106280943552147
Energy: 1.7336929966162855
Energy: 1.3106280943529949
Energy: 1.6852789965110824
Energy: 1.4480131692143448
Energy: 1.6235647225958998
Energy: 1.4480131692143448
Energy: 1.3246089625822246
Energy: 1.4490358393804186
Energy: 1.6549305704609345
Energy: 1.44903583937487
Energy: 1.4413952899836868
Energy: 1.310840962611232
Energy: 1.6484750307059457
Energy: 1.3108409626123416
Energy: 1.3226636671690577
Energy: 1.3106128236416184
Energy: 1.648323579023179
Energy: 1.3106128236405088
Energy: 1.3065788654922836
Energy: 1.3085086541644069
Energy: 1.6541548183663346
Energy: 1.3085086541655166
Energy: 1.309757121775643
Energy: 1.3118157817219698
Energy: 1.9114192717692358
Energy: 1.311815781725299
Energy: 1.653021125551614
Energy: 1.4123072782180321
Energy: 1.960550768689666
Energy: 1.4123072782169221
Energy: 1.6140037143999562
Energy: 1.3123637798554706
Energy: 1.4056658803677273
Energy: 1.3123637798544117
Energy: 1.4403732811568364
Energy: 1.3085535840293088
Energy: 1.3071893025039178
Energy: 1.3085535840293088
Energy: 1.94441518380747
Energy: 1.3108853778256966
Energy: 1.3722513213830012
Energy: 1.3108853778245868
Energy: 1.9122861324631628
Energy: 1.3096209630592055
Energy: 1.4391340369924814
Energy: 1.309620963061425
Energy: 1.4428692684887652
Energy: 1.308099382020418
Energy: 1.6498875500591792
Energy: 1.3080993820270768
Energy: 1.3221027306512054
Energy: 1.4471556224955073
Energy: 1.6562988071730709
Energy: 1.4471556225021656
Energy: 1.32205505966542
Energy: 1.3096921523839726
Energy: 1.7366277420047498
Energy: 1.3096921523839726
Energy: 1.4416484113850414
Energy: 1.4417033092910292
Energy: 2.1915117839149505
Energy: 1.4417033092943585
Energy: 1.3097019284831906
Energy: 1.3134133780097204
Energy: 1.6460073541886855
Energy: 1.313413378015269
Energy: 1.3102157426769971
Energy: 1.3102399250783683
Energy: 1.9624503063027887
Energy: 1.3102399250761485
Energy: 1.3109286213090012
Energy: 1.31011037085006
Energy: 1.9121777814209424
Energy: 1.3101103708522799
Energy: 1.6476021779204761
Energy: 1.4133296110878206
Energy: 1.4397069861647667
Energy: 1.4133296110867108
Energy: 1.6158031121149499
Energy: 1.3115235832214853
Energy: 1.3092538374221407
Energy: 1.3115235832214853
Energy: 1.3108017103476806
Energy: 1.3083489670092874
Energy: 1.3096526040650829
Energy: 1.3083489670081776
Energy: 1.911743923442001
Energy: 1.309362911802183
Energy: 1.3102315364535633
Energy: 1.3093629118044026

minimum gb energy = 1.3065788654922836 eV
minimum distance =  2.17563840128651 Angstroms
sigma value = 17


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

Energy: 2.0282127497135174
Energy: 1.5590683342197758
Energy: 1.5660113577913444
Energy: 1.3627579213657965
Energy: 1.6043874082352345
Energy: 1.2980919179429173
Energy: 1.5759543596327612
Energy: 1.2980919179422314
Energy: 1.6705966277549833
Energy: 1.5026512396401777
Energy: 1.489727828182509
Energy: 1.5026512396394915
Energy: 1.6657712556550934
Energy: 1.6476460505314106
Energy: 1.4877625771279113
Energy: 1.6476460505314106
Energy: 1.5597344103033124
Energy: 1.2885533009605143
Energy: 1.8927171428250031
Energy: 1.2885533009584569
Energy: 1.2860022523687535
Energy: 1.2888462186065686
Energy: 1.921063898181249
Energy: 1.2888462186093121
Energy: 1.2861723616842589
Energy: 1.2846640314683282
Energy: 1.375474186178832
Energy: 1.2846640314683282
Energy: 1.2861332950762814
Energy: 1.292327594239659
Energy: 2.032304154375154
Energy: 1.2923275942410306
Energy: 1.5494592886173557
Energy: 1.2869450813749548
Energy: 1.7211202510014825
Energy: 1.286945081373583
Energy: 1.4825755015661493
Energy: 1.5013155598059384
Energy: 1.490343627683288
Energy: 1.5013155598079961
Energy: 1.9087905324215746
Energy: 1.5037298303676034
Energy: 1.3037267821469174
Energy: 1.5037298303655457
Energy: 1.558146242817379
Energy: 1.3014560682302396
Energy: 1.533010821351985
Energy: 1.3014560682274958
Energy: 1.8519363875110169
Energy: 1.2974120059080445
Energy: 1.3214919212979224
Energy: 1.2974120059114742
Energy: 1.6058991644743366
Energy: 1.2957878741410875
Energy: 1.300112821535728
Energy: 1.2957878741404016
Energy: 1.66856700065252
Energy: 1.2982402333045346
Energy: 1.3137609958290195
Energy: 1.298240233306592
Energy: 2.09679598700091
Energy: 1.3604329596430416
Energy: 1.2964315588245756
Energy: 1.360432959645037
Energy: 1.3618616986158611
Energy: 1.30259630080846
Energy: 1.8459285028942805
Energy: 1.30259630080846
Energy: 1.299658890219553
Energy: 1.2963771279750664
Energy: 1.5559458147606253
Energy: 1.296377127973009
Energy: 1.35838167589603
Energy: 1.2982853620510733
Energy: 1.7203214499547033
Energy: 1.2982853620545027
Energy: 1.3875156047049961
Energy: 1.3859045206901366
Energy: 2.029229555880252
Energy: 1.3859045206908223
Energy: 1.4955365287790874
Energy: 1.297906926118128
Energy: 1.6073167498314256
Energy: 1.2979069261201857
Energy: 1.4919929615603056
Energy: 1.5031580298726697
Energy: 1.714307065340621
Energy: 1.5031580298719838
Energy: 1.3726456825533726
Energy: 1.3743781318084096
Energy: 1.668439126685961
Energy: 1.3743781318090955
Energy: 1.8512312430931255
Energy: 1.2912173797889355
Energy: 1.5548462128754366
Energy: 1.2912173797868773
Energy: 1.875598643611086
Energy: 1.2867886391293077
Energy: 1.300495485371715
Energy: 1.2867886391279357
Energy: 1.4861198575608965
Energy: 1.2848712133865892
Energy: 1.2897012016906304
Energy: 1.2848712133859035
Energy: 2.029463002722377
Energy: 1.294132679763319
Energy: 1.2862883164464889
Energy: 1.294132679764005
Energy: 1.7271185063395262
Energy: 1.2849192302076717
Energy: 1.8995589855635686
Energy: 1.2849192302090435
Energy: 1.5618869446200228
Energy: 1.5007946232773495
Energy: 1.4857109492273062
Energy: 1.5007946232752916
Energy: 1.3058402477378046
Energy: 1.504451681287954
Energy: 1.9054136776478672
Energy: 1.504451681289326
Energy: 1.5247165943552197
Energy: 1.3031819461559297
Energy: 1.5601354643622685
Energy: 1.303181946159359
Energy: 1.3210668371020504
Energy: 1.3040366954773865
Energy: 1.857352414748274
Energy: 1.3040366954760148
Energy: 1.2961400557271128
Energy: 1.2953840541784225
Energy: 1.606760221927387
Energy: 1.295384054181166
Energy: 1.2969951587580968
Energy: 1.2992995130034588
Energy: 1.665768755830091
Energy: 1.2992995130041447
Energy: 1.560714683217923
Energy: 1.35926987605835
Energy: 1.6917093531808816
Energy: 1.359269876059722
Energy: 1.8448426272851564
Energy: 1.3016484638538464
Energy: 1.297086222437322
Energy: 1.3016484638524746
Energy: 1.8837538173160364
Energy: 1.2958055622683626
Energy: 1.2964240898230632
Energy: 1.2958055622704205
Energy: 1.66093340450932
Energy: 1.3000581962178688
Energy: 1.3641690591598035
Energy: 1.3000581962192406

minimum gb energy = 1.2846640314683282 eV
minimum distance =  2.16836484332789 Angstroms
sigma value = 89


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

Energy: 2.2809413689446556
Energy: 1.261815706821198
Energy: 1.263734894823734
Energy: 1.2855928277732318
Energy: 1.7107620238230135
Energy: 1.2625273086127382
Energy: 1.3576828466346849
Energy: 1.2625273086109434
Energy: 1.4134756228469605
Energy: 1.392388845945344
Energy: 1.3684347632685328
Energy: 1.392388845945344
Energy: 1.4144066019386932
Energy: 1.5163198956894945
Energy: 1.175983317543864
Energy: 1.5163198956859052
Energy: 1.5810122571525833
Energy: 1.2389076754755186
Energy: 1.8862058658916636
Energy: 1.238907675473724
Energy: 1.4203180755670646
Energy: 1.230891883749464
Energy: 1.5215774754127573
Energy: 1.2308918837476694
Energy: 1.4203733656869715
Energy: 1.1746309607291667
Energy: 1.175574790720403
Energy: 1.1746309607309615
Energy: 1.4364641502049724
Energy: 1.4166435344066606
Energy: 2.132437742667618
Energy: 1.4166435344084551
Energy: 1.4458575189359415
Energy: 1.1766915305852732
Energy: 1.1759215048622376
Energy: 1.1766915305834784
Energy: 1.9066995628120087
Energy: 1.5707347936250329
Energy: 1.175014559978281
Energy: 1.5707347936250329
Energy: 1.5684928637737083
Energy: 1.3607354232743185
Energy: 1.41136676226246
Energy: 1.3607354232761133
Energy: 1.5217764667306004
Energy: 1.431854029931658
Energy: 1.175105353678764
Energy: 1.431854029931658
Energy: 1.8865074661416505
Energy: 1.260603311773456
Energy: 1.260323150895614
Energy: 1.260603311773456
Energy: 1.69788896798493
Energy: 1.2604626073742844
Energy: 1.2602280198441789
Energy: 1.2604626073778737
Energy: 1.5820539723584193
Energy: 1.2613184840983356
Energy: 1.2608208253264486
Energy: 1.2613184841001301

minimum gb energy = 1.1746309607291667 eV
minimum distance =  2.17297308190979 Angstroms
sigma value = 13


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

Energy: 1.923205031765799
Energy: 1.1417125967425032
Energy: 1.1381736789764245
Energy: 1.2005339436717362
Energy: 1.332882986125466
Energy: 1.1381225018134036
Energy: 1.3623984092321708
Energy: 1.1381225018254393
Energy: 1.8993987346097396
Energy: 1.1376778223463817
Energy: 1.3380787459871897
Energy: 1.1376778223313373
Energy: 1.5267005205430901
Energy: 1.1403801409013319
Energy: 1.3348577738989442
Energy: 1.1403801408968184
Energy: 1.3327642596092921
Energy: 1.2253161047146934
Energy: 1.7669583710211523
Energy: 1.2253161047192067
Energy: 1.340012110188394
Energy: 1.1392187453682332
Energy: 1.7206155923848747
Energy: 1.13921874536372
Energy: 1.339948537290913
Energy: 1.1377861969958358
Energy: 1.6349689402591134
Energy: 1.1377861969913223
Energy: 1.2195558952484262
Energy: 1.138528575182057
Energy: 2.115757454277543
Energy: 1.1385285751775438
Energy: 1.137743581708281
Energy: 1.1397904180565834
Energy: 1.4109807156974228
Energy: 1.1397904180513179
Energy: 1.1407407150503381
Energy: 1.1374836007102669
Energy: 1.4117954480756012
Energy: 1.1374836007012403
Energy: 1.1368184618075543
Energy: 1.1383478319165419
Energy: 1.92261658926913
Energy: 1.1383478319210556
Energy: 1.7398258763330574
Energy: 1.1380204380252033
Energy: 1.412233431296947
Energy: 1.1380204380192538
Energy: 1.7687458821777249
Energy: 1.2143790335722768
Energy: 1.3359213412257733
Energy: 1.214379033569268
Energy: 1.6339246703317858
Energy: 1.1358994410335883
Energy: 1.527287056570418
Energy: 1.1358994410350927
Energy: 1.3377148299424282
Energy: 1.142359750050579
Energy: 1.6307715566919745
Energy: 1.1423597500528355
Energy: 1.3360067463534815
Energy: 1.1398958000580595
Energy: 1.1462201444522233
Energy: 1.1398958000618207
Energy: 1.3374712989950845
Energy: 1.1374265727488393
Energy: 1.141768112249691
Energy: 1.1374265727526003
Energy: 1.9258043622857606
Energy: 1.139728334287486
Energy: 1.1363373468538684
Energy: 1.1397283342897424
Energy: 1.5245565991839014
Energy: 1.139103767527886
Energy: 1.371823475392898
Energy: 1.1391037675263815
Energy: 1.4131047480978836
Energy: 1.1369449168672483
Energy: 1.333024643580645
Energy: 1.136944916869505
Energy: 1.5239924542445162
Energy: 1.1419574664380145
Energy: 1.3368145338644677
Energy: 1.1419574664432803
Energy: 1.412408370467604
Energy: 1.2209923490078585
Energy: 1.7372742130809353
Energy: 1.2209923490010883
Energy: 1.33354209498138
Energy: 1.1385679935496154
Energy: 1.7669030582769532
Energy: 1.138567993561651
Energy: 1.1404846666543516
Energy: 1.136371435440029
Energy: 1.6344484570888616
Energy: 1.1363714354385246
Energy: 1.3569266832546458
Energy: 1.1444712722389307
Energy: 2.1458966681886227
Energy: 1.144471272242692
Energy: 1.135977635095092
Energy: 1.1431036158381003
Energy: 1.3387658747930222
Energy: 1.1431036158403565
Energy: 1.1372740326352564
Energy: 1.1366810778483205
Energy: 1.6322678366047039
Energy: 1.1366810778475684
Energy: 1.136000303671086
Energy: 1.144813905189435
Energy: 1.9264607289252005
Energy: 1.1448139051871786
Energy: 1.3656378545173748
Energy: 1.138083436738674
Energy: 1.5276418247463988
Energy: 1.1380834367379218
Energy: 1.3327213380128315
Energy: 1.2190356424806832
Energy: 1.3326504408919244
Energy: 1.2190356424829398
Energy: 1.3740148644488985
Energy: 1.223860643648558
Energy: 1.5237198573271993
Energy: 1.2238606436463013
Energy: 1.3359998746129436
Energy: 1.1390733165813292
Energy: 1.3660328404375968
Energy: 1.139073316573807
Energy: 1.3341345920159597
Energy: 1.1436487899343708
Energy: 1.1353418124674146
Energy: 1.1436487899313619
Energy: 1.6339484796508452
Energy: 1.1362381736459863
Energy: 1.1374031352718417
Energy: 1.1362381736459863
Energy: 1.5262591772603906
Energy: 1.138789295709934
Energy: 1.1356063549902053
Energy: 1.1387892957069252

minimum gb energy = 1.1353418124674146 eV
minimum distance =  2.18830728640457 Angstroms
sigma value = 37


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

Energy: 1.7031707184215934
Energy: 1.0401933801978298
Energy: 1.0411521657316483
Energy: 1.1202977363325994
Energy: 1.7846757959144872
Energy: 1.040104230609565
Energy: 1.4026943497531532
Energy: 1.0401042306082706
Energy: 1.7559520845244405
Energy: 1.0384509990245878
Energy: 1.3999025327811994
Energy: 1.0384509990245878
Energy: 1.7092365390562423
Energy: 1.174771424190059
Energy: 1.3997475851452534
Energy: 1.174771424190059
Energy: 1.4003695116362087
Energy: 1.1749410203926165
Energy: 1.3683425271508334
Energy: 1.1749410203926165
Energy: 1.0342097962035812
Energy: 1.038294448429623
Energy: 1.786150729177943
Energy: 1.038294448429623
Energy: 1.0337412120649194
Energy: 1.0385625746144318
Energy: 1.7766849260753343
Energy: 1.0385625746144318
Energy: 1.1524145255018157
Energy: 1.0396773158330033
Energy: 2.0350194515674227
Energy: 1.0396773158330033
Energy: 1.038289986379847
Energy: 1.0398089046375985
Energy: 1.773835623453879
Energy: 1.0398089046375985
Energy: 1.038555262492919
Energy: 1.0400964367769536
Energy: 1.744389998940669
Energy: 1.0400964367769536
Energy: 1.0411521657355307
Energy: 1.1202977363313054
Energy: 1.7031707184228877
Energy: 1.0401933802030066
Energy: 1.4026943497531532
Energy: 1.0401042306082706
Energy: 1.7846757959144872
Energy: 1.0401042306082706
Energy: 1.3999025327799053
Energy: 1.0384509990245878
Energy: 1.7559520845231464
Energy: 1.0384509990245878
Energy: 1.3997475851439594
Energy: 1.174771424190059
Energy: 1.7092365390562423
Energy: 1.1747714241913534
Energy: 1.3683425271508334
Energy: 1.1749410203926165
Energy: 1.4003695116349146
Energy: 1.1749410203926165
Energy: 1.7861507291831196
Energy: 1.038294448428329
Energy: 1.0342097962035812
Energy: 1.038294448428329
Energy: 1.7766849260753343
Energy: 1.0385625746131377
Energy: 1.0337412120662137
Energy: 1.0385625746131377
Energy: 2.0350194515687168
Energy: 1.0396773158330033
Energy: 1.1524145255018157
Energy: 1.0396773158330033
Energy: 1.773835623453879
Energy: 1.0398089046375985
Energy: 1.0382899863824353
Energy: 1.0398089046388925
Energy: 1.744389998940669
Energy: 1.0400964367756595
Energy: 1.0385552624942134
Energy: 1.0400964367769536

minimum gb energy = 1.0337412120649194 eV
minimum distance =  2.19721198866804 Angstroms
sigma value = 25


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

Energy: 2.0772066363525883
Energy: 0.9455145727354979
Energy: 0.9491379461206595
Energy: 1.017058925879563
Energy: 1.966792278277647
Energy: 0.9471460126736126
Energy: 1.2294557487334679
Energy: 0.9471460126705809
Energy: 1.782803439083814
Energy: 0.9455302150028186
Energy: 1.227168833109473
Energy: 0.9455302150068611
Energy: 1.5681126039576405
Energy: 1.0749345815768303
Energy: 1.480686804973031
Energy: 1.0749345815748093
Energy: 1.7322260401966314
Energy: 1.0524433093033199
Energy: 1.739046431089944
Energy: 1.0524433092992778
Energy: 1.6139806985635297
Energy: 1.050912955356791
Energy: 1.7494635263243226
Energy: 1.0509129553527488
Energy: 1.6088957453636898
Energy: 0.9460815452752498
Energy: 1.7352520742077644
Energy: 0.9460815452782817
Energy: 1.2065506063020854
Energy: 1.2243657579237153
Energy: 1.8257312457994248
Energy: 1.2243657579216942
Energy: 1.2109186342322245
Energy: 0.9461288851013023
Energy: 1.735691439308372
Energy: 0.9461288851023131
Energy: 1.212675596886787
Energy: 0.9448897006610555
Energy: 1.9414970490716463
Energy: 0.9448897006650977
Energy: 1.0634749057771387
Energy: 0.9438207914431502
Energy: 1.8207274668488307
Energy: 0.9438207914471927
Energy: 1.0623684141349017
Energy: 0.9459516675348657
Energy: 1.941105540697081
Energy: 0.9459516675288022
Energy: 1.0693021402780882
Energy: 0.9319166849835686
Energy: 1.9571322695299926
Energy: 0.9319166849845791
Energy: 1.13980416607772
Energy: 1.0765825091350285
Energy: 1.9538619426421673
Energy: 1.0765825091350285
Energy: 1.3478433783078827
Energy: 0.9304704626859315
Energy: 1.9350029647013114
Energy: 0.9304704626889633
Energy: 1.3438453534018695
Energy: 0.9458314662634366
Energy: 1.782086457455743
Energy: 0.9458314662634366
Energy: 1.5360442167476593
Energy: 0.9454028579230017
Energy: 1.8181578651509338
Energy: 0.9454028579189596
Energy: 1.3131846727428045
Energy: 1.055411679471009
Energy: 1.4934576224705547
Energy: 1.05541167947303
Energy: 1.6813498216522946
Energy: 1.052940178530291
Energy: 1.6093516425139875
Energy: 1.0529401785292805
Energy: 1.9659771410707538
Energy: 1.0503003511958287
Energy: 1.612738255244747
Energy: 1.0503003511938076
Energy: 1.822321130788121
Energy: 0.949222996417474
Energy: 1.2228787177370912
Energy: 0.9492229964194953
Energy: 1.9418941506057934
Energy: 0.944762795393366
Energy: 1.060387391397538
Energy: 0.9447627953953411
Energy: 1.7818117220429615
Energy: 0.9488209551593686
Energy: 1.2195307988653312
Energy: 0.9488209551553263
Energy: 1.8237640441488616
Energy: 0.9468400530962909
Energy: 0.9493530235160224
Energy: 0.9468400531003331
Energy: 1.9613615191225582
Energy: 0.9462178198163761
Energy: 0.94801302780491
Energy: 0.9462178198163761
Energy: 1.8364441706325871
Energy: 0.9518730410852073
Energy: 0.9459226944753916
Energy: 0.9518730410872285

minimum gb energy = 0.9304704626859315 eV
minimum distance =  2.18541859394852 Angstroms
sigma value = 41


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

Energy: 2.097999416080557
Energy: 0.8538320581706604
Energy: 0.8544212333336825
Energy: 0.9129681841063413
Energy: 1.8904390019725212
Energy: 0.8500081581493228
Energy: 1.060292440801694
Energy: 0.8500081581484943
Energy: 1.988326137763362
Energy: 0.8496824721783719
Energy: 1.062202422033451
Energy: 0.8496824721783719
Energy: 1.6716249059307093
Energy: 0.8545177033135755
Energy: 1.0529631193235538
Energy: 0.8545177033127469
Energy: 1.8926038539376864
Energy: 1.1432686908266718
Energy: 1.5044260092515949
Energy: 1.1432686908266718
Energy: 1.7046510575170182
Energy: 0.8511438856549084
Energy: 1.509549611922176
Energy: 0.8511438856557367
Energy: 1.7050700651204722
Energy: 1.1545678058623217
Energy: 1.6856032556599034
Energy: 1.1545678058648077
Energy: 1.5051397119502006
Energy: 1.1549590016325668
Energy: 1.4655164953633832
Energy: 1.1549590016350522
Energy: 1.2667841048263349
Energy: 1.143661406826642
Energy: 1.8127507238717013
Energy: 1.143661406826642
Energy: 1.2701057453679183
Energy: 0.8487034629376078
Energy: 1.8899337336724917
Energy: 0.8487034629376078
Energy: 1.0550248692482642
Energy: 0.8553373055556265
Energy: 1.885803756282282
Energy: 0.8553373055564548
Energy: 1.056060094575104
Energy: 0.8486248513929793
Energy: 2.0325725223430227
Energy: 0.8486248513921508
Energy: 1.0542466053808373
Energy: 0.8517833403320443
Energy: 2.063499709386462
Energy: 0.8517833403337013
Energy: 0.8490447339179796
Energy: 0.849937980638256
Energy: 1.8852269700677233
Energy: 0.8499379806374275
Energy: 0.8505476777617089
Energy: 0.8502450201701216
Energy: 2.07036195495457
Energy: 0.8502450201709503
Energy: 0.8497892431088602
Energy: 0.8540054802745669
Energy: 2.055412628161
Energy: 0.8540054802745669
Energy: 1.056037477545163
Energy: 0.8583970276483469
Energy: 2.063872569969744
Energy: 0.8583970276466899
Energy: 1.0543439550077263
Energy: 0.851403793918143
Energy: 2.069943972643629
Energy: 0.8514037939164861
Energy: 1.057041902827652
Energy: 0.8523506435669933
Energy: 1.69952903106098
Energy: 0.8523506435661647
Energy: 1.515562775552033
Energy: 0.8507055625522127
Energy: 1.7009470344238737
Energy: 0.8507055625538696
Energy: 1.4646129726802506
Energy: 1.144644162200718
Energy: 1.8484537837262438
Energy: 1.1446441622015466
Energy: 1.5135721437622827
Energy: 1.154784327139495
Energy: 1.7024324490284255
Energy: 1.1547843271386666
Energy: 1.813868690668652
Energy: 0.9353013685143671
Energy: 1.7070064571471026
Energy: 0.93530136851271
Energy: 1.4665455848207114
Energy: 1.1549458717129646
Energy: 1.479756835350064
Energy: 1.1549458717137935
Energy: 1.8538174360538306
Energy: 1.1443224549248154
Energy: 1.2575917804336667
Energy: 1.1443224549231583
Energy: 1.8805230056010493
Energy: 0.8505328982232281
Energy: 1.475502009649771
Energy: 0.8505328982240566
Energy: 1.9010004583849551
Energy: 0.8525703942154055
Energy: 1.0534828542969814
Energy: 0.8525703942154055
Energy: 2.070188222321003
Energy: 0.8523734463568415
Energy: 1.0528549200317951
Energy: 0.8523734463576702
Energy: 1.897160223283297
Energy: 0.8580650171511265
Energy: 1.0538606080618698
Energy: 0.8580650171519549
Energy: 1.8796803585632176
Energy: 0.8556170564601371
Energy: 0.8508419649590897
Energy: 0.8556170564609654
Energy: 2.071321434043072
Energy: 0.8498868841600984
Energy: 0.8517851022801333
Energy: 0.8498868841584413
Energy: 2.0490331930819172
Energy: 0.8493788124003114
Energy: 0.8496446624982845
Energy: 0.8493788123986544

minimum gb energy = 0.8486248513921508 eV
minimum distance =  2.19825144315261 Angstroms
sigma value = 15


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

Energy: 1.82755857956121
Energy: 0.7894697528277452
Energy: 1.1862232158589938
Energy: 0.8384259625261912
Energy: 1.9922159441858915
Energy: 0.7870484100251226
Energy: 0.965531092336304
Energy: 0.7870484100251226
Energy: 2.0762964166814446
Energy: 0.7858620949665311
Energy: 0.9630563984813734
Energy: 0.7858620949672331
Energy: 1.8301112184509445
Energy: 0.7899884129431565
Energy: 1.3261997335819513
Energy: 0.7899884129431565
Energy: 1.8550142138546535
Energy: 0.782480176625817
Energy: 1.317545745852093
Energy: 0.7824801766244133
Energy: 1.7758844053567382
Energy: 0.7831201870668287
Energy: 1.3436001853827337
Energy: 0.7831201870633194
Energy: 1.5012152874858578
Energy: 1.0748738491403589
Energy: 1.6554750513466951
Energy: 1.0748738491410608
Energy: 1.6797101040419917
Energy: 0.8634818266275304
Energy: 1.3001162542404088
Energy: 0.8634818266268284
Energy: 1.5072970653642457
Energy: 0.857487466091457
Energy: 1.6183639299179664
Energy: 0.8574874660921589
Energy: 1.5082146048131677
Energy: 1.0778233388634388
Energy: 1.9555083690915998
Energy: 1.077823338866948
Energy: 1.3271904589991192
Energy: 0.7896056057471964
Energy: 1.6494014454469255
Energy: 0.7896056057457926
Energy: 1.1305721283764878
Energy: 0.782919793036477
Energy: 1.9233275869411963
Energy: 0.7829197930371787
Energy: 1.3221794125132684
Energy: 0.7838061893257706
Energy: 1.956771288286509
Energy: 0.7838061893271744
Energy: 0.9581812500613666
Energy: 0.7897046956337053
Energy: 1.651444470954852
Energy: 0.7897046956337053
Energy: 0.957453942233307
Energy: 0.7833080198305008
Energy: 1.9592606153878753
Energy: 0.7833080198269915
Energy: 0.9570873958899818
Energy: 0.7877646852723978
Energy: 1.987899592685893
Energy: 0.7877646852723978
Energy: 0.7863767174854396
Energy: 0.7918825147343157
Energy: 1.994554647629939
Energy: 0.7918825147329119
Energy: 0.7851521594301509
Energy: 0.7843217346100498
Energy: 2.1441646622322166
Energy: 0.7843217346079444
Energy: 0.7831613635809979
Energy: 0.790755105084784
Energy: 1.8406048121700245
Energy: 0.7907551050868896
Energy: 0.9608490139723186
Energy: 0.788861408874328
Energy: 2.082701692187115
Energy: 0.7888614088757318
Energy: 0.9538872420303441
Energy: 0.7834185883750332
Energy: 1.8532385343304112
Energy: 0.7834185883736295
Energy: 0.9579227517203377
Energy: 0.7893651477816767
Energy: 1.8476477920549608
Energy: 0.7893651477788691
Energy: 1.3447338648586364
Energy: 0.7839300645082915
Energy: 1.8377473571208454
Energy: 0.783930064506186
Energy: 1.302105433289981
Energy: 0.7825307181904385
Energy: 1.9570084425606549
Energy: 0.782530718193246
Energy: 1.3257107295514352
Energy: 0.7913993866842698
Energy: 1.471244547421263
Energy: 0.7913993866870773
Energy: 1.6203343924983868
Energy: 1.0773980809040682
Energy: 1.9575505877604606
Energy: 1.0773980809019625
Energy: 1.3186224976333498
Energy: 0.8583629083620324
Energy: 1.6482852441469757
Energy: 0.8583629083613306
Energy: 1.6914664214851898
Energy: 0.8679724081370609
Energy: 1.471713486563273
Energy: 0.8679724081356572
Energy: 1.6753007338517136
Energy: 1.074824515047612
Energy: 1.6474862350982749
Energy: 1.07482451504691
Energy: 1.6768215051033712
Energy: 0.7908603446312634
Energy: 1.3273629446555388
Energy: 0.7908603446305614
Energy: 1.8546697693439484
Energy: 0.7837396877648081
Energy: 1.1309918986134209
Energy: 0.78373968776551
Energy: 1.6525833850235392
Energy: 0.7885042009729809
Energy: 1.3271958286444814
Energy: 0.7885042009708753
Energy: 1.9600430613468234
Energy: 0.7858793914209764
Energy: 0.9650358796254642
Energy: 0.7858793914230819
Energy: 1.9917693065135005
Energy: 0.7865743754450527
Energy: 0.9647004534862462
Energy: 0.7865743754457546
Energy: 2.0095463928018495
Energy: 0.8478199720473002
Energy: 0.8427370354609139
Energy: 0.8478199720437908
Energy: 1.9543500286068638
Energy: 0.785789190406151
Energy: 0.7909105134625992
Energy: 0.785789190405449
Energy: 2.1377053916592796
Energy: 0.7868452445536642
Energy: 0.7926056639394958
Energy: 0.7868452445564715

minimum gb energy = 0.7824801766244133 eV
minimum distance =  2.20183716117529 Angstroms
sigma value = 85


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

Energy: 1.923249235428421
Energy: 0.70928341498601
Energy: 0.7091065734719018
Energy: 0.7982242845801834
Energy: 2.026227024302656
Energy: 0.710912194352175
Energy: 0.8586877491609943
Energy: 0.710912194352175
Energy: 1.9252447796913552
Energy: 0.7102953927442753
Energy: 0.857545221188624
Energy: 0.7102953927442753
Energy: 1.6106922911996968
Energy: 0.7088413781923674
Energy: 1.1781658330662879
Energy: 0.7088413781923674
Energy: 1.9443984511130188
Energy: 0.7085162733423961
Energy: 1.1887185003922385
Energy: 0.7085162733417874
Energy: 1.6344625688616454
Energy: 0.7091178690329365
Energy: 1.1753456979893655
Energy: 0.7091178690335452
Energy: 1.6311285521462762
Energy: 0.7090163047020975
Energy: 1.4688973245314116
Energy: 0.7090163047014889
Energy: 1.7568467438329354
Energy: 0.7087331432750753
Energy: 1.155241830483361
Energy: 0.7087331432744666
Energy: 1.637828413256847
Energy: 0.7089704739420187
Energy: 1.4653490337414095
Energy: 0.7089704739432362
Energy: 1.6392922163922843
Energy: 1.2203718734003655
Energy: 1.7571013204939376
Energy: 1.2203718734009743
Energy: 1.4655395520231398
Energy: 0.7087051904305197
Energy: 1.4580279385616177
Energy: 0.7087051904311286
Energy: 1.3322123767690845
Energy: 0.7093614401565684
Energy: 1.7213047333355636
Energy: 0.709361440155351
Energy: 1.4656660367805545
Energy: 0.7088424822613035
Energy: 1.7181957675106339
Energy: 0.7088424822613035
Energy: 1.172397862133346
Energy: 0.7094419197325375
Energy: 1.457953342758872
Energy: 0.7094419197325375
Energy: 1.0058871469083948
Energy: 0.7087433372728126
Energy: 2.0211473946469374
Energy: 0.70874333727403
Energy: 1.1627920591896646
Energy: 0.7101702603470822
Energy: 1.7781694924645337
Energy: 0.7101702603464735
Energy: 0.8576793241983265
Energy: 0.7131874182797477
Energy: 1.7788786752531431
Energy: 0.7131874182809652
Energy: 0.8576733618614147
Energy: 0.7097860703827048
Energy: 2.1521486658005444
Energy: 0.7097860703833135
Energy: 0.8587055991086887
Energy: 0.7095023327082055
Energy: 2.011440951168829
Energy: 0.7095023327075967
Energy: 0.7092379080719855
Energy: 0.7100367619804009
Energy: 1.9830593615089631
Energy: 0.7100367619797922
Energy: 0.710403312753784
Energy: 0.7096704539108354
Energy: 2.18484414449057
Energy: 0.7096704539108354
Energy: 0.7095641363112571
Energy: 0.7094363542755647
Energy: 1.9100202691443728
Energy: 0.7094363542755647
Energy: 0.8593308942299482
Energy: 0.7095106651942275
Energy: 2.1410607078982915
Energy: 0.7095106651942275
Energy: 0.8605420804268458
Energy: 0.7091859270063109
Energy: 2.0286644094591986
Energy: 0.7091859270050934
Energy: 0.8574996348391003
Energy: 0.7086658517199111
Energy: 1.608642813982054
Energy: 0.7086658517199111
Energy: 1.1781427233877524
Energy: 0.708931912404726
Energy: 2.1505887438873876
Energy: 0.7089319124035085
Energy: 1.191811304932612
Energy: 0.708738539245896
Energy: 1.8553379349349404
Energy: 0.7087385392452873
Energy: 1.1759323143458666
Energy: 0.7092442025585679
Energy: 1.612138045165433
Energy: 0.7092442025591766
Energy: 1.4909359996956673
Energy: 0.7088237146569476
Energy: 1.9078424345075127
Energy: 0.708823714656339
Energy: 1.4935575774340355
Energy: 0.7101870425910017
Energy: 1.6113421962038366
Energy: 0.7101870425910017
Energy: 1.759391446629789
Energy: 0.7101955866155532
Energy: 1.3179851155016624
Energy: 0.7101955866198142
Energy: 1.473512770745493
Energy: 0.8364012908800912
Energy: 1.6426621520716593
Energy: 0.8364012908794826
Energy: 1.7207185279472579
Energy: 0.7100349931405804
Energy: 1.3420854654944159
Energy: 0.7100349931405804
Energy: 2.055061158930325
Energy: 0.7088411890962067
Energy: 1.339471738727339
Energy: 0.7088411890962067
Energy: 1.4550806366389166
Energy: 0.7094312667683572
Energy: 1.1759294744788327
Energy: 0.7094312667683572
Energy: 1.9883475486523279
Energy: 0.7086343083553049
Energy: 1.1772723178410196
Energy: 0.7086343083559138
Energy: 1.9858699738550554
Energy: 0.7091243149734047
Energy: 1.1775001238147569
Energy: 0.7091243149740134
Energy: 1.7684921830003326
Energy: 0.7087643774039512
Energy: 0.8576329995578252
Energy: 0.7087643774027337
Energy: 2.154387969944901
Energy: 0.708852252636727
Energy: 0.8594881203347102
Energy: 0.7088522526355095
Energy: 2.0170021154461946
Energy: 0.7097123796209349
Energy: 0.8579054068668545
Energy: 0.7097123796215435
Energy: 1.7697859723747555
Energy: 0.7093861966065698
Energy: 0.7106746837658257
Energy: 0.7093861966065698
Energy: 2.184419554893077
Energy: 0.7096724746148199
Energy: 0.7099279937618721
Energy: 0.7096724746148199
Energy: 1.9222769173323404
Energy: 0.7096308528121636
Energy: 0.7102880723543923
Energy: 0.7096308528121636

minimum gb energy = 0.7085162733417874 eV
minimum distance =  2.19721944100955 Angstroms
sigma value = 113


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

Energy: 0.020489253766627684
Energy: 0.7806103411899487
Energy: 1.783644052062188
Energy: 0.023576993289992153
Energy: 1.1709375984788664
Energy: 0.16681875575039937
Energy: 1.1708306650186833
Energy: 0.16681875575227123
Energy: 0.021274648523450342
Energy: 0.16464141789205788
Energy: 1.1674217508056906
Energy: 0.1646414178915899
Energy: 0.023237937716104804
Energy: 0.16426127232119503
Energy: 1.1655404209179971
Energy: 0.1642612723225469
Energy: 1.1623811304183393
Energy: 0.16582522765942365
Energy: 1.1737178561928698
Energy: 0.16582522766124347
Energy: 0.02131913442879443
Energy: 0.16424790380534446
Energy: 1.1668364263283202
Energy: 0.16424790380446055

minimum gb energy = 0.020489253766627684 eV
minimum distance =  2.45438746480711 Angstroms
sigma value = 1