Model name: model_name=EAM_Dynamo_MishinMehlPapaconstantopoulos_2001_Cu__MO_346334655118_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615000084042549
cohesive_energy=3.540278176783594
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4500627800147719e-19, 2.2218985560312e-19, 2.8001080814754597e-19, 3.2501434761997194e-19, 3.61112989360626e-19, 3.9086540945400596e-19, 4.1578886917250993e-19, 4.367950070208839e-19, 4.54813085446848e-19, 4.70746732071978e-19, 4.85161515248076e-19, 4.98281739703902e-19, 5.10166685974914e-19, 5.208371823573539e-19, 5.303140571474639e-19, 5.38624547348022e-19, 5.457974921384399e-19, 5.5185371981495995e-19, 5.5682367173362795e-19, 5.60747402310294e-19, 5.63672976843978e-19, 5.65669288929942e-19, 5.6680843651671595e-19, 5.67170528436e-19, 5.667908125737419e-19, 5.6557636268517e-19, 5.63387789403126e-19, 5.6004885329787e-19, 5.553384539939099e-19, 5.48984221463466e-19, 5.40624063787254e-19, 5.29801360624584e-19, 5.1592490879751e-19, 4.9826892229082995e-19, 4.75963419192282e-19, 4.47983006456106e-19, 4.13066771071344e-19, 3.69530825395662e-19, 3.14976711007962e-19, 2.4603985697684397e-19, 1.5817056231473818e-19, 4.53563387672328e-20, -1.002983401180242e-19, -2.89780881261678e-19, -5.394961314369179e-19, -8.7268157989029e-19, -1.321846992702288e-18, -1.9412773185861e-18, -2.8278257372436595e-18, -4.15178439874956e-18, -6.214458640893839e-18, -9.63174118355244e-18, -1.5870328604554318e-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: -2.00908733476168e-07 eV

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

Energy: 0.013653325063168652
Energy: 0.01428551145235325
Energy: 0.01412760261517005
Energy: 0.013854938735467167
Energy: 0.42589223256422215
Energy: 0.014009727487583232
Energy: 0.014285511452945623
Energy: 0.09808381311224418
Energy: 0.09950521699058414
Energy: 0.09816575152451654
Energy: 0.09817290811271479
Energy: 0.09930697674182788
Energy: 0.014127602615483658
Energy: 0.09950521699027051
Energy: 0.09912702634532215
Energy: 0.014156074045380914
Energy: 0.09818839713560773
Energy: 0.09882061169273093
Energy: 0.013854938735467167
Energy: 0.09816575152604974
Energy: 0.014156074045067303
Energy: 0.013936615405854334
Energy: 0.09813496771391056
Energy: 0.014031761628957177
Energy: 0.42589223256450087
Energy: 0.09817290811515396
Energy: 0.09818839713623495
Energy: 0.09813496771363181
Energy: 0.09814413433696574
Energy: 0.09805392222048345
Energy: 0.014009727487583232
Energy: 0.09930697674182788
Energy: 0.09882061169273093
Energy: 0.014031761628957177
Energy: 0.0980539222214243
Energy: 0.014096951015850635

minimum gb energy = 0.013653325063168652 eV
minimum distance =  2.55236434111542 Angstroms
sigma value = 1


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

Energy: 1.1985948742751378
Energy: 0.7816230578237428
Energy: 0.8025970087773666
Energy: 0.7307428696167064
Energy: 1.132336043386372
Energy: 0.8026750156396933
Energy: 1.1213194766775088
Energy: 0.7424765375326934
Energy: 0.7484516544654084
Energy: 0.7451140650233087
Energy: 0.7491022433818779
Energy: 0.7576233931116874
Energy: 0.7383779445539711
Energy: 0.748071102475006
Energy: 0.7601352127380562
Energy: 0.7624090754351647
Energy: 0.7478234948347524
Energy: 0.747506314576514
Energy: 1.193957993331522
Energy: 0.7487793748771512
Energy: 0.7520701929937342
Energy: 0.7482627541297726
Energy: 0.7476381668856104
Energy: 0.7534414539001875
Energy: 1.0820377174302072
Energy: 0.7564046015211813
Energy: 0.7561108005910483
Energy: 0.7441904796120713
Energy: 0.7573709273106071
Energy: 0.7549156223970788
Energy: 1.0785022924542365
Energy: 0.7671554012892342
Energy: 0.7594010978960638
Energy: 0.7410509507055242
Energy: 0.7605481536318636
Energy: 0.760365975704966
Energy: 1.0805002131953567
Energy: 0.7608522125756694
Energy: 0.7612657833497458
Energy: 0.7506490540978465
Energy: 0.7533029776747243
Energy: 0.760036237035787
Energy: 1.0395808618746232
Energy: 0.7603832840952373
Energy: 0.7612605366625909
Energy: 0.7075159696399945
Energy: 0.7597967541814157
Energy: 0.7613091056016551
Energy: 0.8778434468229488
Energy: 0.7530972745372405
Energy: 0.7511568172828949
Energy: 0.7603492839021159
Energy: 0.7517623975348395
Energy: 0.7581627764517567
Energy: 0.8723709869266493
Energy: 0.7579321192572724
Energy: 0.7564676197760959
Energy: 0.7482414117808006
Energy: 0.7446428856436201
Energy: 0.7567065999137953
Energy: 0.8650628241570343
Energy: 0.7476326924581578
Energy: 0.7462741947467744
Energy: 0.7818195120488897
Energy: 0.7468732540671285
Energy: 0.7508768152907596
Energy: 0.7813844615076705
Energy: 0.7561197500182673
Energy: 0.7492053507390128
Energy: 0.747229146859319
Energy: 0.7608231438377852
Energy: 0.7548639701120994
Energy: 0.7805179066079037
Energy: 0.7454155078845813
Energy: 0.7454174145141935
Energy: 0.7556550279971721
Energy: 0.7582958425759763
Energy: 0.7582502268848225
Energy: 0.8426209301689552
Energy: 0.7457917860146541
Energy: 0.7522932076946146
Energy: 0.7614304340352863
Energy: 0.7471060371320759
Energy: 0.7458568523550358
Energy: 0.8094050984875553
Energy: 0.7443112854296312
Energy: 0.7549797603174403
Energy: 0.7656617973634794
Energy: 0.7438881458915245
Energy: 0.7492890219313323
Energy: 0.8133872545778749
Energy: 0.7540252761638776
Energy: 0.7475160862661605
Energy: 0.7626392302338068
Energy: 0.764479478866538
Energy: 0.7552981057500405
Energy: 1.0001931212209814
Energy: 0.7589437170826223
Energy: 0.7589250371752112
Energy: 0.7417349491196079
Energy: 0.7588467585859485
Energy: 0.7554400570172008
Energy: 0.9752134749660973
Energy: 0.7659882499998104
Energy: 0.7641765494608109
Energy: 0.7622065872530001
Energy: 0.7448754564685286
Energy: 0.7640213881688569
Energy: 0.9771105835552284
Energy: 0.7637970985480829
Energy: 0.7643120765005471
Energy: 0.7477773599129494
Energy: 0.7631599751347106
Energy: 0.7636304764043053
Energy: 1.0330564182464677
Energy: 0.763793516729163
Energy: 0.7644604960651166
Energy: 0.7456432008659867
Energy: 0.7548967718584216
Energy: 0.7636236712578188
Energy: 1.1259340669741786
Energy: 0.7510866324526788
Energy: 0.7471131423400412
Energy: 0.7466538201732678
Energy: 0.7416179790878722
Energy: 0.7488448024658942
Energy: 1.1288593139195366
Energy: 0.766343383596243
Energy: 0.7612308526771867
Energy: 0.7610603581049263
Energy: 0.7656106342509791
Energy: 0.7482248949909063
Energy: 1.120986239638233
Energy: 0.7514167885977611
Energy: 0.7568536976011219
Energy: 0.7516280315739284
Energy: 0.7432840165960647
Energy: 0.7566505584613464

minimum gb energy = 0.7075159696399945 eV
minimum distance =  2.37053939532302 Angstroms
sigma value = 33


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

Energy: 1.4752707047615323
Energy: 0.8379978402529347
Energy: 0.7984760072333801
Energy: 0.7919411947025983
Energy: 0.7854884966624401
Energy: 0.8306336255526787
Energy: 0.9668759848365386
Energy: 0.7633700800205795
Energy: 0.7601085532321281
Energy: 0.7949005346053225
Energy: 0.8098954925879518
Energy: 0.7843663039064261
Energy: 1.0763628126654055
Energy: 0.7946811162563592
Energy: 0.7878898043001804
Energy: 0.8217424632625234
Energy: 0.8076812654989719
Energy: 0.8113948280232752
Energy: 1.1676960004077206
Energy: 0.8536812734938447
Energy: 0.796912580697164
Energy: 0.7987060995159296
Energy: 0.8153771621453174
Energy: 0.8029752252486752
Energy: 1.0700956263039512
Energy: 0.8037248935260733
Energy: 0.8021672461348275
Energy: 0.7956956117737712
Energy: 0.804748383373339
Energy: 0.7943866226056262
Energy: 1.1597896242778796
Energy: 0.7863491259612886
Energy: 0.7857519488633682
Energy: 0.7585999646722116
Energy: 0.7776938273940418
Energy: 0.8515697739562281
Energy: 1.1587645703394471
Energy: 0.8087861809395333
Energy: 0.8105163516162551
Energy: 0.8191947010145096
Energy: 0.8178883779386186
Energy: 0.8080163040877583
Energy: 1.0254372692871228
Energy: 0.8187412759152
Energy: 0.8231059970514972
Energy: 0.7983573059181055
Energy: 0.8182879059619876
Energy: 0.8255009911222082
Energy: 0.9493467794169425
Energy: 0.819434966580662
Energy: 0.8442462858148161
Energy: 0.8651036274992709
Energy: 0.8207575766615673
Energy: 0.8538028799372648
Energy: 0.948820908643239
Energy: 0.8516132355464181
Energy: 0.850560403595417
Energy: 0.8244978425499144
Energy: 0.8481985711156008
Energy: 0.8445026715112944
Energy: 0.9426823106291773
Energy: 0.7419251672292151
Energy: 0.741699606063032
Energy: 0.7989118253819912
Energy: 0.7420879553226544
Energy: 0.7417983763374264
Energy: 0.8734044570511963
Energy: 0.7844210962811741
Energy: 0.8226138953681714
Energy: 0.8403466022582601
Energy: 0.7831738439391007
Energy: 0.8173715009222481
Energy: 0.8717144063637569
Energy: 0.8318999589185271
Energy: 0.8466607647081099
Energy: 0.8575185723817633
Energy: 0.8301552185105561
Energy: 0.8475033206731936
Energy: 0.9332196859779962
Energy: 0.7994766296403744
Energy: 0.8028092418244448
Energy: 0.8532996717763065
Energy: 0.7987333482900004
Energy: 0.7871452431744376
Energy: 0.9414232805784638
Energy: 0.8493107514065206
Energy: 0.8507139768720816
Energy: 0.8641776123794509
Energy: 0.8490202698690363
Energy: 0.8391268600055786
Energy: 0.9374216299986732
Energy: 0.8424935643315016
Energy: 0.8466646279460729
Energy: 0.8656073952858394
Energy: 0.843986692142365
Energy: 0.8480586598067316
Energy: 1.0837430913548194
Energy: 0.8392805801918245
Energy: 0.8396564688333094
Energy: 0.8476938484048678
Energy: 0.8393777049834922
Energy: 0.8393715020951787
Energy: 1.0250032352078613
Energy: 0.8550522178333488
Energy: 0.8554444174874176
Energy: 0.8186913274841155
Energy: 0.8735439514899741
Energy: 0.8237672170670489
Energy: 1.0267265139660293
Energy: 0.8602341432298787
Energy: 0.8611377698971187
Energy: 0.8189643628520143
Energy: 0.8613882956636647
Energy: 0.8529216310992983
Energy: 0.983940565632602
Energy: 0.8623685417244228
Energy: 0.8624329926232247
Energy: 0.8537742587581638
Energy: 0.8686256731578088
Energy: 0.869858153340759
Energy: 1.2274957161098052
Energy: 0.8620263817922521
Energy: 0.8167919629708068
Energy: 0.8174337759296456
Energy: 0.8621953686156093
Energy: 0.8167219633100089
Energy: 0.9606559308191164
Energy: 0.8405972558972501
Energy: 0.8323591041748065
Energy: 0.8478751863370844
Energy: 0.8600699024887545
Energy: 0.8520388597535724
Energy: 1.1095715538573332
Energy: 0.8556447261568348
Energy: 0.8363006304327111
Energy: 0.8611317293301461
Energy: 0.857502766550222
Energy: 0.8514935034783574
Energy: 1.1718159927091447
Energy: 0.855794501993787
Energy: 0.8628019837550343
Energy: 0.7927858803174452
Energy: 0.8702779314387683
Energy: 0.8117262432017291
Energy: 1.1100400474346657
Energy: 0.8608694295429885
Energy: 0.8369009896852916
Energy: 0.8450150968774768
Energy: 0.8600233814145969
Energy: 0.8525896995680594
Energy: 1.0664002456285577
Energy: 0.8310135032456514
Energy: 0.8496566480235408
Energy: 0.8514269274173273
Energy: 0.8459982254525803
Energy: 0.8520835225839284
Energy: 1.162905240362706
Energy: 0.8330761686483513
Energy: 0.8329158318762381
Energy: 0.8327297127576959
Energy: 0.8273441682792558
Energy: 0.8329909099174952
Energy: 1.0683353114502117
Energy: 0.8225777239755379
Energy: 0.8232142480314768
Energy: 0.8513113124750075
Energy: 0.818455931576531
Energy: 0.8527272672552755
Energy: 0.9500408083678363
Energy: 0.8183704844067882
Energy: 0.8175229894462823
Energy: 0.8501090178412661
Energy: 0.8187768880480165
Energy: 0.8480464542484637
Energy: 0.9562286041892599
Energy: 0.8511776262813795
Energy: 0.849091725165501
Energy: 0.8484388336554782
Energy: 0.8468794815455573
Energy: 0.8497581345968481
Energy: 0.9369938805576229
Energy: 0.7415611324505403
Energy: 0.7413128329333555
Energy: 0.835135028474732
Energy: 0.7416784924695683
Energy: 0.7414377534755797
Energy: 0.8707997013418721
Energy: 0.757999034247741
Energy: 0.7400926759268827
Energy: 0.842636546117615
Energy: 0.7847397084554348
Energy: 0.8116014548588958
Energy: 0.8726979305284178
Energy: 0.8394544855640443
Energy: 0.8425954830043288
Energy: 0.8539595678535583
Energy: 0.8167968182507831
Energy: 0.8308037000426016
Energy: 0.8725484452728638
Energy: 0.794781550048209
Energy: 0.7954825968450454
Energy: 0.8401318805097827
Energy: 0.7986309299940727
Energy: 0.7893309240045638
Energy: 0.9366202393696815
Energy: 0.8345038721866601
Energy: 0.8362012033108969
Energy: 0.8641826033789974
Energy: 0.8344688999525549
Energy: 0.8263097020996305
Energy: 0.9359472858636548
Energy: 0.8468799420119534
Energy: 0.782511765664014
Energy: 0.8674712875060044
Energy: 0.876111978330378
Energy: 0.8479638721040025
Energy: 0.9366006728984567
Energy: 0.7789585897056137
Energy: 0.7771740628700974
Energy: 0.7943930762495026
Energy: 0.7791293173747574
Energy: 0.7805875187962528
Energy: 1.0240327694693874
Energy: 0.8684712271117052
Energy: 0.8080959172678588
Energy: 0.8206228190161141
Energy: 0.8042835683552471
Energy: 0.8104883471548932
Energy: 1.0241409803119577
Energy: 0.8035960437750637
Energy: 0.813679352896093
Energy: 0.8182298863964831
Energy: 0.8137306704149689
Energy: 0.8239849737137441
Energy: 1.0697974197317377
Energy: 0.8029866299862808
Energy: 0.8039005306301633
Energy: 0.794510089728061
Energy: 0.803868755043135
Energy: 0.8086744498766749
Energy: 1.21019935660948
Energy: 0.7521183571615581
Energy: 0.7563439209889289
Energy: 0.755660504416354
Energy: 0.7578272091958503
Energy: 0.7921752148028184

minimum gb energy = 0.7400926759268827 eV
minimum distance =  2.34035603440666 Angstroms
sigma value = 51


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

Energy: 1.243239722247967
Energy: 0.7789672928475211
Energy: 0.7780034481729152
Energy: 0.7756306366297833
Energy: 0.7647763285897325
Energy: 0.8232230739204704
Energy: 1.0182662504428053
Energy: 0.8021682282654807
Energy: 0.7896133102834434
Energy: 0.7547744455328446
Energy: 0.8019299978036725
Energy: 0.7749094691115852
Energy: 1.119534355984493
Energy: 0.802303366620857
Energy: 0.7747091380769412
Energy: 0.7750438745464555
Energy: 0.8026838755926419
Energy: 0.7986022262522611
Energy: 1.1157512096797622
Energy: 0.7753302574268258
Energy: 0.7755256059269505
Energy: 0.7859823018198314
Energy: 0.7755385078420592
Energy: 0.7864180073260376
Energy: 0.9516157276491539
Energy: 0.8087816771579102
Energy: 0.8079776737607217
Energy: 0.7691901990284867
Energy: 0.7981329544389225
Energy: 0.8072848103672352
Energy: 0.9509217131239441
Energy: 0.8072326711319279
Energy: 0.8073496295039384
Energy: 0.7982298918171095
Energy: 0.806620161706663
Energy: 0.8071854093390486
Energy: 0.9511224064611266
Energy: 0.7688512302549503
Energy: 0.7682650882713097
Energy: 0.7980865158943373
Energy: 0.7550234669660686
Energy: 0.8067206984490032
Energy: 0.9368971983645602
Energy: 0.7742284377653403
Energy: 0.7747781883514546
Energy: 0.7921001561483354
Energy: 0.7738578937074396
Energy: 0.7746253335280329
Energy: 0.803059072543473
Energy: 0.7783649035751286
Energy: 0.779083869097084
Energy: 0.8028496575627596
Energy: 0.7792814930121352
Energy: 0.7953611710673748
Energy: 0.8020501941820158
Energy: 0.7783113831162775
Energy: 0.7767431462312858
Energy: 0.802169939418718
Energy: 0.778887359547526
Energy: 0.7894351284415893
Energy: 0.8202116600285817
Energy: 0.7754334103529703
Energy: 0.7741981240321767
Energy: 0.7808210527654064
Energy: 0.7777890838092386
Energy: 0.7749882480393435
Energy: 0.837499374941384
Energy: 0.7788543024416654
Energy: 0.7787427795646161
Energy: 0.7854462746722435
Energy: 0.7757521199057315
Energy: 0.8086485709955896
Energy: 0.8371717783629657
Energy: 0.7864452186009641
Energy: 0.7960953273073129
Energy: 0.8061728363701852
Energy: 0.7780868850195451
Energy: 0.7958890255592189
Energy: 0.8381938897190219
Energy: 0.7884808206984119
Energy: 0.7884151088069618
Energy: 0.775283107530849
Energy: 0.7883578273907884
Energy: 0.7884840556348968
Energy: 1.0164755035910427
Energy: 0.7785477084688281
Energy: 0.7777672726245209
Energy: 0.788857021749238
Energy: 0.7871185814209869
Energy: 0.7780135138905544
Energy: 1.0182654404820675
Energy: 0.8090985523121556
Energy: 0.788150456964871
Energy: 0.7909578825628023
Energy: 0.8089005470045285
Energy: 0.79205136468643
Energy: 1.0256258076323346
Energy: 0.8082265483588393
Energy: 0.807484316159778
Energy: 0.8063905130480651
Energy: 0.8084763968817712
Energy: 0.796082933340529
Energy: 1.2111984724426739
Energy: 0.7864068272546629
Energy: 0.7920107584211303
Energy: 0.7732009488710746
Energy: 0.7860815416021485
Energy: 0.7775878571018525

minimum gb energy = 0.7547744455328446 eV
minimum distance =  2.37043778261347 Angstroms
sigma value = 19


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

Energy: 1.0504024040000315
Energy: 0.7688986219037335
Energy: 0.7689642770761943
Energy: 0.8491352615737979
Energy: 0.747659760271111
Energy: 0.7682144000062656
Energy: 1.0556008459471875
Energy: 0.7478882497993379
Energy: 0.7477983473157941
Energy: 0.7757777664269092
Energy: 0.7477211395599382
Energy: 0.74783951470917
Energy: 0.8947146520080402
Energy: 0.7480266198326117
Energy: 0.747972666503653
Energy: 0.7811656790889698
Energy: 0.7479613916518179
Energy: 0.7477666771233484
Energy: 0.8902217160974438
Energy: 0.7481749268101668
Energy: 0.7476656841945801
Energy: 0.7714992182900805
Energy: 0.7475121475649584
Energy: 0.7477945711943231
Energy: 0.8965966472573695
Energy: 0.7477701274433716
Energy: 0.7750632090763708
Energy: 0.7760202420518165
Energy: 0.7476459155309095
Energy: 0.7754876236799216
Energy: 0.8968783399929999
Energy: 0.7267634967470162
Energy: 0.774486469052444
Energy: 0.7765619822549995
Energy: 0.7267759377211679
Energy: 0.7751684855369557
Energy: 0.8964146839114062
Energy: 0.7752412090174894
Energy: 0.7749568951537092
Energy: 0.7765461603808996
Energy: 0.7343291777735235
Energy: 0.7759700265013205
Energy: 0.8423080258664019
Energy: 0.7348372836751951
Energy: 0.7345180620391752
Energy: 0.7484512254168442
Energy: 0.7438499970398201
Energy: 0.7277685492494629
Energy: 0.7478512336935617
Energy: 0.7351875855399312
Energy: 0.7274779051441796
Energy: 0.7478538677161793
Energy: 0.7346085619907478
Energy: 0.7267862790434131
Energy: 0.7488662446962968
Energy: 0.7483650573507202
Energy: 0.747962551784638
Energy: 0.7480083855948773
Energy: 0.7809232225650867
Energy: 0.7478755144222902
Energy: 0.7461735532867538
Energy: 0.7720441927285383
Energy: 0.7724192649266804
Energy: 0.7471436950404664
Energy: 0.7728055778122332
Energy: 0.7476254201639183
Energy: 0.8951675313707002
Energy: 0.7766896337790624
Energy: 0.7745666956277618
Energy: 0.747440774434624
Energy: 0.7807918585324002
Energy: 0.7476572354537669
Energy: 0.7265561473662958
Energy: 0.7756794209985675
Energy: 0.7758665245984079
Energy: 0.7288388242127877
Energy: 0.7765247610583578
Energy: 0.7761166286509071
Energy: 0.8960717285239628
Energy: 0.7755455243246029
Energy: 0.7755812320833184
Energy: 0.7478368728838093
Energy: 0.775559413450957
Energy: 0.775383587778507
Energy: 1.0552223592898746
Energy: 0.7478283517370652
Energy: 0.7479103651557537
Energy: 0.7347559530963128
Energy: 0.7476671606797841
Energy: 0.7272350797138354
Energy: 1.0523037982173287
Energy: 0.749582096879499
Energy: 0.7282145863540092
Energy: 0.7287881839457531
Energy: 0.74797822276709
Energy: 0.7343985385013533
Energy: 0.8967622180582117
Energy: 0.7478290430396719
Energy: 0.7478873402330453
Energy: 0.7755857755475184
Energy: 0.7479194111599018
Energy: 0.7479122695840708
Energy: 0.891525914598748
Energy: 0.7477137223454069
Energy: 0.7478223792187095
Energy: 0.7714966312608513
Energy: 0.7477911115603215
Energy: 0.7478311046747493
Energy: 0.8887169553459378
Energy: 0.7480662896648985
Energy: 0.7479574130431762
Energy: 0.7715631457047494
Energy: 0.7480426042735979
Energy: 0.7479703713904969
Energy: 0.8960669698362247
Energy: 0.7267194964272924
Energy: 0.7755447226464197
Energy: 0.7751525285005402
Energy: 0.7265769102224644
Energy: 0.774097587587454
Energy: 0.8923269043928735
Energy: 0.7749332055377952
Energy: 0.7750465352168396
Energy: 0.7766582099809713
Energy: 0.7477438231636152
Energy: 0.7753956782069608
Energy: 0.8957717150598584
Energy: 0.7752962533352388
Energy: 0.7748713868017264
Energy: 0.7748958618898566
Energy: 0.7345576625403624
Energy: 0.7747504961143384
Energy: 0.8441951666323899
Energy: 0.7287411749552268
Energy: 0.7280303687648499
Energy: 0.8444362051532696
Energy: 0.7278403047463636
Energy: 0.7269459450802063
Energy: 0.747804338340567
Energy: 0.7489212920536574
Energy: 0.7480077737772071
Energy: 0.747686748480129
Energy: 0.7671423236109809
Energy: 0.7478236513209325
Energy: 0.7478640930933345
Energy: 0.7574773429654462
Energy: 0.7479855294974885
Energy: 0.748002044092244
Energy: 0.78107641728225
Energy: 0.7478779045126178
Energy: 0.8454446955236788
Energy: 0.7719680333325049
Energy: 0.7728849231742975
Energy: 0.8451264617025448
Energy: 0.7715113412395349
Energy: 0.7476618276951221
Energy: 0.8957675795801047
Energy: 0.7750986047922676
Energy: 0.7753841690146297
Energy: 0.7477433139530061
Energy: 0.7765952844960665
Energy: 0.7751289205809837
Energy: 0.7266091903857234
Energy: 0.7766052291870287
Energy: 0.7755798628615743
Energy: 0.7267148763938674
Energy: 0.7766211281382386
Energy: 0.7739627611784982
Energy: 0.8447893239560629
Energy: 0.7763519164834706
Energy: 0.7757793477636159
Energy: 0.7348032937733041
Energy: 0.7767603669303449
Energy: 0.7754674015219963
Energy: 1.0538251466248842
Energy: 0.748152760566676
Energy: 0.7267437517227971
Energy: 0.7419142796656895
Energy: 0.7479533730749812
Energy: 0.7355522331893777

minimum gb energy = 0.7265561473662958 eV
minimum distance =  2.39968824347413 Angstroms
sigma value = 27


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

Energy: 0.8964688881653601
Energy: 0.7923710783390947
Energy: 0.898512317188573
Energy: 0.7541749929246263
Energy: 0.7207189232568292
Energy: 0.7905741725470808
Energy: 0.7856866427217215
Energy: 0.7524946977660167
Energy: 0.7035835214070527
Energy: 0.70847366801999
Energy: 0.7524000596424091
Energy: 0.6724758609159531
Energy: 0.8031153253721875
Energy: 0.7533563671635604
Energy: 0.7034173781563591
Energy: 0.6727415772658831
Energy: 0.7535614313628561
Energy: 0.7053301975031278
Energy: 0.7039485841653594
Energy: 0.7044562206691708
Energy: 0.7052036622246148
Energy: 0.6959065933062828
Energy: 0.7202185167189449
Energy: 0.7032837105716365
Energy: 0.8770711967158503
Energy: 0.6843350069802214
Energy: 0.6939138326881044
Energy: 0.7535477975628374
Energy: 0.687137164868077
Energy: 0.6951252720942528
Energy: 0.7524979431567624
Energy: 0.6851933668579583
Energy: 0.6841610257276842
Energy: 0.7525228223697589
Energy: 0.6887372383989148
Energy: 0.6838661448151796
Energy: 0.7535756897204196
Energy: 0.6950672176675722
Energy: 0.6941013494144311
Energy: 0.7538396746074134
Energy: 0.7076955821135092
Energy: 0.704401202839605
Energy: 0.7533740861554671
Energy: 0.69057700712941
Energy: 0.6907243194835729
Energy: 0.7535539212884724
Energy: 0.6903993846960492
Energy: 0.6911837366361581
Energy: 0.8031793852590643
Energy: 0.6900635059818914
Energy: 0.6722120222497194
Energy: 0.752720959006549
Energy: 0.6906725138937073
Energy: 0.7031052704393196
Energy: 0.7021360491213164
Energy: 0.7255598175683644
Energy: 0.7256438935343241
Energy: 0.7399439982121405
Energy: 0.6954402291634963
Energy: 0.7341810075222156
Energy: 0.803405214648529
Energy: 0.7413104953119386
Energy: 0.73920586861118
Energy: 0.7047735449928123
Energy: 0.7410552703557348
Energy: 0.7381645117028797
Energy: 0.7856866422940475
Energy: 0.703550423690348
Energy: 0.7030871122000616
Energy: 0.708750433841335
Energy: 0.7534417324279327
Energy: 0.6724223687768756

minimum gb energy = 0.6722120222497194 eV
minimum distance =  2.41790940143213 Angstroms
sigma value = 9


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

Energy: 1.4935389663984913
Energy: 0.6468851873837907
Energy: 0.6254746553870366
Energy: 0.6503454661901
Energy: 0.7118789726195119
Energy: 0.6543265643058442
Energy: 0.6302184038150133
Energy: 0.6530544417518042
Energy: 0.648258447023397
Energy: 0.6345279554809531
Energy: 0.652813543890382
Energy: 0.6360724546187659
Energy: 0.6850603907934041
Energy: 0.6530915589402758
Energy: 0.6532916007438533
Energy: 0.6511026057651509
Energy: 0.6540057208249042
Energy: 0.6472118951518244
Energy: 0.6873986606157086
Energy: 0.6151174896951804
Energy: 0.6146969875367856
Energy: 0.6484869491045998
Energy: 0.660644054377646
Energy: 0.6146336181575427
Energy: 0.7256297688580885
Energy: 0.6337433421696342
Energy: 0.6655723022267138
Energy: 0.6629254582812711
Energy: 0.6334052489603389
Energy: 0.6447858851111399
Energy: 0.6634536389845874
Energy: 0.6279287108950545
Energy: 0.6647531989154497
Energy: 0.6635435928318218
Energy: 0.634226630336957
Energy: 0.6365968759963119
Energy: 0.663196126483816
Energy: 0.6152844039885945
Energy: 0.614569428662666
Energy: 0.6642755935785342
Energy: 0.634817840166292
Energy: 0.6688262336930594
Energy: 0.665413863649576
Energy: 0.6413659735005702
Energy: 0.6473793251735802
Energy: 0.6629846875866195
Energy: 0.6414651985620909
Energy: 0.6329068410788199
Energy: 0.7858122226829378
Energy: 0.6476369386808689
Energy: 0.6695175845963235
Energy: 0.6678568168949939
Energy: 0.6514776275023249
Energy: 0.6528994556813934
Energy: 0.6351870539716739
Energy: 0.615940728371913
Energy: 0.617801260254559
Energy: 0.6334531947551266
Energy: 0.6562881446360925
Energy: 0.6150336165486504
Energy: 0.6285278192516734
Energy: 0.6633527941906578
Energy: 0.6684045949021142
Energy: 0.6431511200133561
Energy: 0.6633254454157628
Energy: 0.6659665856747089
Energy: 0.7994486266288741
Energy: 0.6638068019658662
Energy: 0.6638224194110444
Energy: 0.6258818541677855
Energy: 0.6638193816397293
Energy: 0.6453053658919988
Energy: 0.91380778724787
Energy: 0.7915254882246301
Energy: 0.6129038245631635
Energy: 0.6168780127454591
Energy: 0.649471871339885
Energy: 0.6162923398795188
Energy: 0.7958071518549511
Energy: 0.6636345311009205
Energy: 0.644423813959028
Energy: 0.6259478647167217
Energy: 0.6631748579117179
Energy: 0.6455407733349876
Energy: 0.6531697362307629
Energy: 0.6459595637356162
Energy: 0.6458262012084203
Energy: 0.6532437716870126
Energy: 0.6476571244957088
Energy: 0.6881642959719383
Energy: 0.6533324765368775
Energy: 0.6351317580201994
Energy: 0.6522738820691275
Energy: 0.6539178898837008
Energy: 0.650773135416903
Energy: 0.6468348787924377
Energy: 0.6519595331687971
Energy: 0.6245739184120147
Energy: 0.643584460692658
Energy: 0.6518072791159243
Energy: 0.6246745429525592
Energy: 0.6357926939916704
Energy: 0.6860626156344919
Energy: 0.6141588456509472
Energy: 0.6432223409159316
Energy: 0.6513778274862466
Energy: 0.6424842324752628
Energy: 0.6463744850643478
Energy: 0.6853551885640735
Energy: 0.6328932109211295
Energy: 0.6331589999030474
Energy: 0.6524255676009131
Energy: 0.6430287956661309
Energy: 0.6299527199011471
Energy: 0.6849129182596961
Energy: 0.6430837646608474
Energy: 0.6353282962705795
Energy: 0.6421256477608211
Energy: 0.6421590940852527
Energy: 0.6382091115902156
Energy: 0.68478721234428
Energy: 0.6549870018569434
Energy: 0.6335823405933072
Energy: 0.6571142164545911
Energy: 0.6537788574383059
Energy: 0.6375485438542046
Energy: 0.7261227574635623
Energy: 0.6690806828580006
Energy: 0.6440042832291323
Energy: 0.6348352323539957
Energy: 0.6523188752060757
Energy: 0.6078886412509961
Energy: 0.7235429909503981
Energy: 0.6521409682635978
Energy: 0.6500469270761771
Energy: 0.6342743238413835
Energy: 0.6521785627842906
Energy: 0.6083266860524227
Energy: 0.6846229216601466
Energy: 0.6556911647127728
Energy: 0.6555151283299525
Energy: 0.658262467711765
Energy: 0.6536821988015095
Energy: 0.6465968958982973
Energy: 0.9197514456035837
Energy: 0.665385329158378
Energy: 0.6453436210851916
Energy: 0.6489227223034963
Energy: 0.6545110644550577
Energy: 0.6473441378582313
Energy: 0.6841109804315576
Energy: 0.6255746240216977
Energy: 0.6150781500122268
Energy: 0.6644078987775903
Energy: 0.6259698928665468
Energy: 0.6458149811443787
Energy: 0.6320080929330074
Energy: 0.6420598609622141
Energy: 0.6176953106685921
Energy: 0.6323871198665042
Energy: 0.6444074683116596
Energy: 0.6415093238241562
Energy: 0.6634886664715843
Energy: 0.6149154316213387
Energy: 0.6152150463168596
Energy: 0.663713573058491
Energy: 0.6258885994637304
Energy: 0.667297619957268
Energy: 0.6633861998800298
Energy: 0.63960853107083
Energy: 0.6675250838386069
Energy: 0.6636371353209535
Energy: 0.6401110227488492
Energy: 0.6691492516635095
Energy: 0.6692941960472106
Energy: 0.6444223052160186
Energy: 0.6467396681521288
Energy: 0.6556341306875592
Energy: 0.6416892067934444
Energy: 0.6184300609319997
Energy: 0.6284918947041621
Energy: 0.624369870949358
Energy: 0.6493067131594406
Energy: 0.6421811815507951
Energy: 0.6484876248850102
Energy: 0.6696272655012712
Energy: 0.6329295466307152
Energy: 0.6630365153818696
Energy: 0.6397416565609044
Energy: 0.6333545941581924
Energy: 0.6627643260740388
Energy: 0.6152044619750544
Energy: 0.7982071390817109
Energy: 0.6637133285356294
Energy: 0.6632216535839017
Energy: 0.6590468621644296
Energy: 0.6653318794140816
Energy: 0.6148416869989302
Energy: 0.6805285282767841
Energy: 0.6634416480614643
Energy: 0.6638862824819993
Energy: 0.6410499043180149
Energy: 0.6632673035488121
Energy: 0.6175565298970174
Energy: 0.6770719913851493
Energy: 0.6451318253725357
Energy: 0.6469391778162553
Energy: 0.6403402102604834
Energy: 0.6629203463783733
Energy: 0.6454769435225706
Energy: 0.6793922983456065
Energy: 0.6463840230007343
Energy: 0.6446623687320738
Energy: 0.6532007372679819
Energy: 0.6499459427742684
Energy: 0.6199968396862829
Energy: 0.6537622803445917
Energy: 0.6508115855125284
Energy: 0.6469793869722691
Energy: 0.653356262243326
Energy: 0.648749073027887
Energy: 0.6476579197180512
Energy: 0.6520202005546926
Energy: 0.6317552745348513
Energy: 0.6315890535671587
Energy: 0.652206840750424
Energy: 0.6371937416436757
Energy: 0.6530569105737245
Energy: 0.6816942642856526
Energy: 0.6137683826779642
Energy: 0.6142547854356116
Energy: 0.6347393189215996
Energy: 0.6142597900698817
Energy: 0.6411266192365462
Energy: 0.6845743630039113
Energy: 0.6332396342621132
Energy: 0.6317530109327313
Energy: 0.651918447393085
Energy: 0.6324956191790095
Energy: 0.6399570563026541
Energy: 0.6836668410964316
Energy: 0.6424739248456027
Energy: 0.639225204019087
Energy: 0.64035658591683
Energy: 0.6443610225941179
Energy: 0.6359866537087111
Energy: 0.6858353402598509
Energy: 0.6444680069794478
Energy: 0.6453413092989493
Energy: 0.654412232908134
Energy: 0.6436549449799442
Energy: 0.6434154952322771
Energy: 0.7236425187509664
Energy: 0.6523004628411229
Energy: 0.6403481859382725
Energy: 0.6342821515363223
Energy: 0.6524543004460726
Energy: 0.6082574205625619

minimum gb energy = 0.6078886412509961 eV
minimum distance =  2.37261543303062 Angstroms
sigma value = 57


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

Energy: 0.706599687559665
Energy: 0.6468964260338501
Energy: 0.3296647300775646
Energy: 0.32751889193086575
Energy: 0.4945336902185414
Energy: 0.6660972962724241
Energy: 0.7075332810655008
Energy: 0.5171110627878829
Energy: 0.5076147785479681
Energy: 0.5176587399782935
Energy: 0.5173112635365635
Energy: 0.48916676627370764
Energy: 0.716788884675235
Energy: 0.7889467340525963
Energy: 0.4887674493808621
Energy: 0.48837149527158175
Energy: 0.48836713878941757
Energy: 0.6833186563015912
Energy: 0.7164500317881357
Energy: 0.4907428023323569
Energy: 0.5582302381423178
Energy: 0.5170230297814257
Energy: 0.6749543501087799
Energy: 0.4895221426970285
Energy: 0.7174219034577309
Energy: 0.4511682409129743
Energy: 0.44938359603027195
Energy: 0.6812163553292023
Energy: 0.451879733355431
Energy: 0.6789095123428293
Energy: 0.687681756674595
Energy: 0.45201193305009557
Energy: 0.45448234171771523
Energy: 0.5002142384799304
Energy: 0.45399719197408084
Energy: 0.43140963549216815
Energy: 0.6887956128443886
Energy: 0.6727511495573193
Energy: 0.4893379159125826
Energy: 0.5063584906989568
Energy: 0.4843666859940764
Energy: 0.676943213947851
Energy: 0.546516823684138
Energy: 0.5559396302058083
Energy: 0.7643424157661569
Energy: 0.7058471834470111
Energy: 0.7646009496338847
Energy: 0.7182814455772065
Energy: 0.7500866592887129
Energy: 0.7264553120810628
Energy: 0.7252446065798467
Energy: 0.7040473656345776
Energy: 0.7028847197332521
Energy: 0.7287222080395487
Energy: 0.5836886994837309
Energy: 0.5026953557172466
Energy: 0.329711922883791
Energy: 0.3273700075749907
Energy: 0.6872379828799534
Energy: 0.5510526302239597
Energy: 0.5788410747113035
Energy: 0.7079403162267788
Energy: 0.6940965603143018
Energy: 0.32759625389791214
Energy: 0.688224300468379
Energy: 0.5336079123896574
Energy: 0.5581134930472749
Energy: 0.7069802973459435
Energy: 0.7113597964018566
Energy: 0.7107285330616628
Energy: 0.7034605639361883
Energy: 0.6682754070018669
Energy: 0.6985075019144695
Energy: 0.48976151130982615
Energy: 0.6743562874509258
Energy: 0.5669762618934242
Energy: 0.4910877416663033
Energy: 0.6766469106940193
Energy: 0.6979276783685954
Energy: 0.6792863797075472
Energy: 0.517503405987158
Energy: 0.5064957522728106
Energy: 0.5485611383945274
Energy: 0.6799260983309762
Energy: 0.49008852074937354
Energy: 0.452025486365896
Energy: 0.45485495890976363
Energy: 0.4996599744007756
Energy: 0.45195789703253414
Energy: 0.4542897900758718
Energy: 0.7013116463901014
Energy: 0.4893841042687662
Energy: 0.510711038717169
Energy: 0.5191899961893597
Energy: 0.453184053447016
Energy: 0.6785648395949642
Energy: 0.7029406082815518
Energy: 0.6929088095581257
Energy: 0.501809742036693
Energy: 0.519618135293305
Energy: 0.7076963499087947
Energy: 0.6851201567007275
Energy: 0.7164380298531726
Energy: 0.5246101266055895
Energy: 0.4892010556442658
Energy: 0.4907000982362518
Energy: 0.48897291408421767
Energy: 0.7663611414123631
Energy: 0.7077505713101951
Energy: 0.516946010878706
Energy: 0.5054305522527119
Energy: 0.3275129813739724
Energy: 0.5191563657601289
Energy: 0.49005809917143733

minimum gb energy = 0.3273700075749907 eV
minimum distance =  2.36972646149939 Angstroms
sigma value = 11


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

Energy: 1.0118090582122121
Energy: 0.5249000194948658
Energy: 0.6331700662307279
Energy: 0.5566954285908051
Energy: 0.5342305757000435
Energy: 0.6277761256271577
Energy: 0.5467069373574713
Energy: 0.5352523690112769
Energy: 0.5358980971145779
Energy: 0.5342838876576672
Energy: 0.5280009525426337
Energy: 0.5313869583653965
Energy: 0.5270189367674366
Energy: 0.5323153792732962
Energy: 0.5339553002064891
Energy: 0.5276100896431303
Energy: 0.5321633148633919
Energy: 0.5247810299259241
Energy: 0.526859026090575
Energy: 0.5388525666089775
Energy: 0.5397027508768812
Energy: 0.5275335959516725
Energy: 0.5254031501305589
Energy: 0.5303022501836122
Energy: 0.5247534710575007
Energy: 0.6170139526047907
Energy: 0.57637782142975
Energy: 0.5441378666056397
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Energy: 0.5303925282713569
Energy: 0.5653229732569256
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Energy: 0.538241646617547
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Energy: 0.538167698697688
Energy: 0.5376375993124306
Energy: 0.5380834048828873
Energy: 0.5654776891767538
Energy: 0.53048920239615
Energy: 0.5225034254895985
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Energy: 0.5250952273465325
Energy: 0.531802484222734
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Energy: 0.5668812050966368
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Energy: 0.5651284775800419
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Energy: 0.5334614681412858
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Energy: 0.5765461736236623
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Energy: 0.6262555191868011
Energy: 0.6166017823952048
Energy: 0.6148008170140958
Energy: 0.5336840693714635
Energy: 0.6198899225747077
Energy: 0.6144958873705375
Energy: 0.6293463599790634
Energy: 0.5374583565762511
Energy: 0.5563978840618916
Energy: 0.5866441141267283
Energy: 0.5425786125190286
Energy: 0.5345001729731539
Energy: 0.7775881263613155
Energy: 0.6168132938620262
Energy: 0.6151403049837785
Energy: 0.5749661052523231
Energy: 0.5804054222383803
Energy: 0.6153226068067189
Energy: 0.8609686490773141
Energy: 0.5759622343661485
Energy: 0.5393778143387382
Energy: 0.7472538409856841
Energy: 0.5883112559912894
Energy: 0.5247980858727487
Energy: 0.9841164284366967
Energy: 0.5732754134185658
Energy: 0.6158237875181205
Energy: 0.5402473786574884
Energy: 0.5744870446247511
Energy: 0.6158540142157288
Energy: 0.7802007982076118
Energy: 0.5343198194412184
Energy: 0.5825576523264996
Energy: 0.5251316989565412
Energy: 0.5342194744686474
Energy: 0.5796521464120146
Energy: 0.7050555224878412
Energy: 0.6464780149146
Energy: 0.5375923584814781
Energy: 0.656959903215393
Energy: 0.6233378302022644
Energy: 0.5382461990068601
Energy: 0.777464651810064
Energy: 0.5786681269731554
Energy: 0.5765094693880082
Energy: 0.5682723454029653
Energy: 0.6163968949231453
Energy: 0.5676634044307788
Energy: 0.7450657470130717
Energy: 0.5449498141027767
Energy: 0.5261246980028026
Energy: 0.7917864520276315
Energy: 0.5415135519196997
Energy: 0.6184376431718714
Energy: 0.5258919486024138
Energy: 0.5805508213920988
Energy: 0.5695866485210307
Energy: 0.5277798292122546
Energy: 0.5790509744239011
Energy: 0.5675197558662995
Energy: 0.5336972024987774
Energy: 0.5296413576974524
Energy: 0.5249781835701497
Energy: 0.533469044228269
Energy: 0.5278349664824796
Energy: 0.5312229165007784
Energy: 0.6238812920205277
Energy: 0.5268499515182725
Energy: 0.5434019702331192
Energy: 0.5990214764238369
Energy: 0.5264131136206746
Energy: 0.5313922586483438
Energy: 0.5937363947142147
Energy: 0.525795825287575
Energy: 0.5288957571549362
Energy: 0.5262890091419697
Energy: 0.5414887522684831
Energy: 0.5096073566325883

minimum gb energy = 0.5096073566325883 eV
minimum distance =  2.3841712254185 Angstroms
sigma value = 41


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

Energy: 1.1233760487659215
Energy: 0.6000530616283584
Energy: 0.5993996300716474
Energy: 0.6467607448740087
Energy: 0.6269738145185625
Energy: 0.6469526742035976
Energy: 0.5881588741662699
Energy: 0.5724118902959361
Energy: 0.5621000610199904
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Energy: 0.5660078392497959
Energy: 0.5612785011667993
Energy: 0.5673776358434783
Energy: 0.5627427754112265
Energy: 0.5623220397729226
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Energy: 0.5672626751567299
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Energy: 0.5670897758414847
Energy: 0.5719700507406932
Energy: 0.5625384743116741
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Energy: 0.5658737426746486
Energy: 0.5663902695412134
Energy: 0.5648494394539096
Energy: 0.5827958333604242
Energy: 0.5740840223114001
Energy: 0.5797354897471237
Energy: 0.5626764562153462
Energy: 0.5628072592781016
Energy: 0.625593787799562
Energy: 0.5729631211289232
Energy: 0.5731141808480918
Energy: 0.5802486303148789
Energy: 0.5691994584048432
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Energy: 0.568279354400162
Energy: 0.5665162531541054
Energy: 0.5799730312627424
Energy: 0.5638539923637379
Energy: 0.587888415237016
Energy: 0.5983509400348062
Energy: 0.5983602711251537
Energy: 0.5416536943744726
Energy: 0.5981069209556258
Energy: 0.5583142536128086
Energy: 0.628277832931783
Energy: 0.5629312724176941
Energy: 0.5620408529318816
Energy: 0.5806844906644275
Energy: 0.5657607866955414
Energy: 0.5622029987504121
Energy: 0.8306208581590517
Energy: 0.5675837390754789
Energy: 0.5652681035959684
Energy: 0.7306390059343719
Energy: 0.5837451065290628
Energy: 0.5718557041421816
Energy: 0.6287407199615737
Energy: 0.5674354833720188
Energy: 0.5615118725293975
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Energy: 0.5795173500950795
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Energy: 0.6799833506443576
Energy: 0.5416541369531102
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Energy: 0.5412570243876552
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Energy: 0.567129627855002
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Energy: 0.5698476390009741
Energy: 0.5948845859384241
Energy: 0.5991321480397122
Energy: 0.5718453882706044
Energy: 0.5949677380588524
Energy: 0.565289125144036
Energy: 0.5809042051456783
Energy: 0.5627223355108315
Energy: 0.5798879002170053
Energy: 0.5659446107306009
Energy: 0.5633436608569791
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Energy: 0.5669094759407296
Energy: 0.5765187965531207
Energy: 0.5908712239794975
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Energy: 0.5673152033424317
Energy: 0.5675069269419333
Energy: 0.5395286070618461
Energy: 0.5786631738499083
Energy: 0.5418703724343701
Energy: 0.5672165814170813
Energy: 0.5679342078132777
Energy: 0.5633862158114814
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Energy: 0.5664176565490436
Energy: 0.5634422938850439
Energy: 0.5656957498984445
Energy: 0.5663083286564329
Energy: 0.5624416873637796
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Energy: 0.5677962599509098
Energy: 0.5638948198176175
Energy: 0.5650330445715468
Energy: 0.5633098988024905
Energy: 0.5610729815443444
Energy: 0.5655633819059854
Energy: 0.5664050409954549
Energy: 0.5612083903701026
Energy: 0.7302814870193979
Energy: 0.5945773272118092
Energy: 0.6183994176987819
Energy: 0.9087048726309986
Energy: 0.5951242487239412
Energy: 0.5764482788952158
Energy: 0.628463179427787
Energy: 0.5628674079159116
Energy: 0.562698359532019
Energy: 0.583744022892124
Energy: 0.5659623656307229
Energy: 0.5619517821848785
Energy: 0.5878900966295708
Energy: 0.5999941352074976
Energy: 0.5677632235143415
Energy: 0.5418186037691074
Energy: 0.6004856556167768
Energy: 0.5448923806536864
Energy: 0.6288687113857571
Energy: 0.5661695133021876
Energy: 0.5642503132888516
Energy: 0.5807088774509286
Energy: 0.5681165481537587
Energy: 0.5626915942589713
Energy: 0.628687540947148
Energy: 0.5672357693786534
Energy: 0.5668281731919429
Energy: 0.5673120905371594
Energy: 0.583116924130178
Energy: 0.5612671012842666
Energy: 0.8303922750516676
Energy: 0.5670477909261258
Energy: 0.5729438363455284
Energy: 0.5682260329670951
Energy: 0.5841165386330853
Energy: 0.5709561362605146
Energy: 0.625614403596972
Energy: 0.5573205155094993
Energy: 0.5738416874883164
Energy: 0.5791826569175575
Energy: 0.5659927984149676
Energy: 0.5714623287711006
Energy: 0.5677423282412561
Energy: 0.5416186677359627
Energy: 0.5415923034092656
Energy: 0.5827252641037887
Energy: 0.541937396710715
Energy: 0.5423072768541698
Energy: 0.5675395182964124
Energy: 0.5688569498436041
Energy: 0.5663837003868513
Energy: 0.5646221337651676
Energy: 0.5782638441906042
Energy: 0.5668511129885887
Energy: 0.5681111673253034
Energy: 0.5623408575723806
Energy: 0.5609389306611027
Energy: 0.5682468076821883
Energy: 0.5676379088768561
Energy: 0.5625130208867342
Energy: 0.5658855293154874
Energy: 0.5669884492202657
Energy: 0.5612667827711565
Energy: 0.5699562183782252
Energy: 0.5665402358332705
Energy: 0.5666560772194666
Energy: 1.0721194839216184
Energy: 0.5661675208048754
Energy: 0.557985394395484
Energy: 0.5509275206432721
Energy: 0.5810197669900092
Energy: 0.5582736908567931

minimum gb energy = 0.5395286070618461 eV
minimum distance =  2.38511074091011 Angstroms
sigma value = 33


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

Energy: 0.7579177074422602
Energy: 0.6080369366332575
Energy: 0.6075622569452993
Energy: 0.603832016116744
Energy: 0.6584216128255888
Energy: 0.6078497244796868
Energy: 0.6472469943085927
Energy: 0.5986760963196418
Energy: 0.5975920754508864
Energy: 0.6131878191535183
Energy: 0.6146288903095686
Energy: 0.5990195569474337
Energy: 0.6170719918386709
Energy: 0.59934477491883
Energy: 0.6000206908639237
Energy: 0.599784014606423
Energy: 0.5995280052382704
Energy: 0.6004482354615923
Energy: 0.6263569193143964
Energy: 0.6006732289007091
Energy: 0.6045718545605492
Energy: 0.6143652137066493
Energy: 0.6001504561511967
Energy: 0.6033268914176226
Energy: 0.6156721135257722
Energy: 0.6019540898660093
Energy: 0.583570651278278
Energy: 0.6162796510474571
Energy: 0.6179588758556235
Energy: 0.6132154444377644
Energy: 0.6498163646215502
Energy: 0.6042627605225456
Energy: 0.603865189646774
Energy: 0.6575273473392274
Energy: 0.6027588593836382
Energy: 0.6053468573483611
Energy: 0.6501890100770737
Energy: 0.6007735602760137
Energy: 0.6171007949767418
Energy: 0.6183857539040346
Energy: 0.6349269760706536
Energy: 0.6016469032834326
Energy: 0.6469274485475719
Energy: 0.6253415525117175
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Energy: 0.583531587505523
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Energy: 0.6492917062196928
Energy: 0.5829970629611206
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Energy: 0.58374231966963
Energy: 0.5843162202700832
Energy: 0.5866941825501998
Energy: 0.7019035021117406
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Energy: 0.599180861617929
Energy: 0.5986271070681526
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Energy: 0.599456026441636
Energy: 0.6163576210820344
Energy: 0.612677295654026
Energy: 0.5988633473669036
Energy: 0.6186303500644534
Energy: 0.6167556309436155
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Energy: 0.9815254620041669
Energy: 0.585033810464836
Energy: 0.6039377604625648
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Energy: 0.5840649938868163
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Energy: 0.6243400564958064
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Energy: 0.5848194377965813
Energy: 0.6044959568266621
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Energy: 0.5851978542869838
Energy: 0.601988955823121
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Energy: 0.6497661730024094
Energy: 0.5978831786046584
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Energy: 0.5822693496349486
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Energy: 0.5995078497749431
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Energy: 0.6266554610095677
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Energy: 0.5858863642824851
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Energy: 0.5833062201537059
Energy: 0.6537763827942753
Energy: 0.6064812196463112
Energy: 0.623370712197095
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Energy: 0.6165504509855295
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Energy: 0.6017876481626271
Energy: 0.6230407684755926
Energy: 0.612141479064514
Energy: 0.6019065456483284
Energy: 0.7048010600029829
Energy: 0.5846105662304851
Energy: 0.5827048690985213
Energy: 0.5822438000244649
Energy: 0.6057131478155052
Energy: 0.581756195943292

minimum gb energy = 0.581196573475683 eV
minimum distance =  2.3910553619192 Angstroms
sigma value = 67


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

Energy: 0.8898992648025777
Energy: 0.649953070734181
Energy: 0.6496281486871658
Energy: 0.6623711891964514
Energy: 0.6698384727722324
Energy: 0.6483880778430077
Energy: 0.7030668807246814
Energy: 0.6327795839258594
Energy: 0.6322864675781423
Energy: 0.6325298928719358
Energy: 0.6339034106003513
Energy: 0.631939067454928
Energy: 0.660109357522179
Energy: 0.6136234748844915
Energy: 0.6331225343362666
Energy: 0.6331652591719524
Energy: 0.6108307889897989
Energy: 0.633005778715808
Energy: 0.6602217376297622
Energy: 0.63251094639599
Energy: 0.6328073218590905
Energy: 0.6311380802774794
Energy: 0.6331219423982736
Energy: 0.6331199626918456
Energy: 0.6629071880906287
Energy: 0.633570424169202
Energy: 0.6345692623219683
Energy: 0.6634324033426623
Energy: 0.6335565735773104
Energy: 0.6349001561252496
Energy: 0.6645737549142452
Energy: 0.6384866145785858
Energy: 0.636864677679546
Energy: 0.6649758128367449
Energy: 0.6380049326292412
Energy: 0.6368196647710199
Energy: 0.7030794062782028
Energy: 0.6333983654751036
Energy: 0.6324522802300115
Energy: 0.6093847097372815
Energy: 0.634107709282824
Energy: 0.6321536227525645

minimum gb energy = 0.6093847097372815 eV
minimum distance =  2.42540364688939 Angstroms
sigma value = 3


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

Energy: 1.020892597771085
Energy: 0.7790058917800544
Energy: 0.7195045036152319
Energy: 0.7049994399755368
Energy: 1.2099504957520177
Energy: 0.7191847370843997
Energy: 0.7287957525111992
Energy: 0.7388200397600057
Energy: 0.7116113396354085
Energy: 0.736060487135243
Energy: 0.7415342942245738
Energy: 0.708805017925671
Energy: 0.7157495269399267
Energy: 0.7222964399440673
Energy: 0.7204023369557851
Energy: 0.7161457338154527
Energy: 0.7206319692910094
Energy: 0.7148928006311007
Energy: 0.7127687121085846
Energy: 0.7100819028751212
Energy: 0.7102302016188553
Energy: 0.7137231199919406
Energy: 0.7143032819053481
Energy: 0.7108937905204193
Energy: 0.723598353172771
Energy: 0.7038406093254664
Energy: 0.7026082112041178
Energy: 0.724739369395421
Energy: 0.704302935787891
Energy: 0.7030215961497538
Energy: 0.71090327987049
Energy: 0.7054157399525728
Energy: 0.7043621993903152
Energy: 0.7118872053663692
Energy: 0.7032767433290782
Energy: 0.7034159957015955
Energy: 0.7097935820160851
Energy: 0.7173187543221762
Energy: 0.7106397046427289
Energy: 0.7064275007212872
Energy: 0.7283301742985752
Energy: 0.7181367489652873
Energy: 0.9190546717128463
Energy: 0.7425269517780303
Energy: 0.709733465965228
Energy: 0.7145246090820034
Energy: 0.7174867234115089
Energy: 0.7086142716887255
Energy: 0.7154764330351921
Energy: 0.7022996269738103
Energy: 0.7201326874308258
Energy: 0.7096869029244536
Energy: 0.7010004314931403
Energy: 0.7319192022479546
Energy: 0.7101519632701382
Energy: 0.6995692913265756
Energy: 0.6983677394866374
Energy: 0.7489732490408454
Energy: 0.7005651533257277
Energy: 0.7253207720038836
Energy: 0.7556714982748699
Energy: 0.7075791993743891
Energy: 0.7140098363581631
Energy: 0.7324129204608953
Energy: 0.6975032273221823
Energy: 0.7159509949188919
Energy: 0.7460392404344216
Energy: 0.7029103536049134
Energy: 0.7031502481493752
Energy: 0.7105253044153388
Energy: 0.7032047496157108
Energy: 0.7036044762787731
Energy: 0.7144430591492476
Energy: 0.7043721189792826
Energy: 0.7045532565601886
Energy: 0.7068954587905453
Energy: 0.7109952559334525
Energy: 0.7030422257035686
Energy: 0.7140461982679983
Energy: 0.7138739388696053
Energy: 0.714769364703907
Energy: 0.7119802481447876
Energy: 0.712266978599064
Energy: 0.7094875154822682
Energy: 0.7478531985360096
Energy: 0.71477989077542
Energy: 0.7712405717871438
Energy: 0.7042583041082424
Energy: 0.7140651919351018
Energy: 0.7155119232896495
Energy: 0.7432476357628577
Energy: 0.7343097849946304
Energy: 0.7312974022556639
Energy: 0.74106171703317
Energy: 0.7373572619300025
Energy: 0.7334153090665393
Energy: 0.8208427328915403
Energy: 0.7118167520274528
Energy: 0.7146411456347924
Energy: 0.8217040244760028
Energy: 0.7136856416265639
Energy: 0.7223270498315005
Energy: 0.7484151108677679
Energy: 0.7344212808237497
Energy: 0.7410679737344898
Energy: 0.7142346874041241
Energy: 0.7092899281446149
Energy: 0.7219866450615329
Energy: 0.8394288745313115
Energy: 0.7138290357988548
Energy: 0.7138117714941448
Energy: 0.7550106900427561
Energy: 0.7415984662391735
Energy: 0.6965258144116442
Energy: 0.7761525051057309
Energy: 0.7050953607403149
Energy: 0.7135132310719997
Energy: 0.731874194405929
Energy: 0.7054262470965234
Energy: 0.6955714268435941
Energy: 0.7045166579944628
Energy: 0.7100223722701275
Energy: 0.7230933764385478
Energy: 0.7033861708185306
Energy: 0.720137803500805
Energy: 0.722301123029026
Energy: 0.7053473140983385
Energy: 0.7074550835443433
Energy: 0.7077252207463516
Energy: 0.7096496435788202
Energy: 0.7080990430416482
Energy: 0.7075444983982916
Energy: 0.711891543602008
Energy: 0.7101751082697126
Energy: 0.7153009503568335
Energy: 0.7127920467397952
Energy: 0.7144021248004384
Energy: 0.7116956417081596
Energy: 0.7054616558207822
Energy: 0.7160641741951309
Energy: 0.716080606271129
Energy: 0.7056952143003942
Energy: 0.7152275753667674
Energy: 0.7067564398620748
Energy: 0.7101303134071352
Energy: 0.708903165990903
Energy: 0.7411303017897128
Energy: 0.7361307759890984
Energy: 0.7131327848425851
Energy: 0.7406448061058876
Energy: 0.850188413030479
Energy: 0.720290927033193
Energy: 0.707861012837471
Energy: 0.7188653275263449
Energy: 0.744760640846707
Energy: 0.7262766281090797
Energy: 0.6956128652980608
Energy: 0.7418415503499624
Energy: 0.7477026392856553
Energy: 0.7258248256805975
Energy: 0.7440428431284863
Energy: 0.7261536418742158
Energy: 0.7111378591797093
Energy: 0.739176055688402
Energy: 0.7397428930891581
Energy: 0.7558009208232723
Energy: 0.735832544734817
Energy: 0.7394417540833991
Energy: 0.7142872667883575
Energy: 0.7294465263957416
Energy: 0.7302597643170198
Energy: 0.714401263550905
Energy: 0.7267569581416732
Energy: 0.7155447276373549
Energy: 0.7129262558906183
Energy: 0.713834161322425
Energy: 0.722124139692362
Energy: 0.7136161676720364
Energy: 0.7132738830413847
Energy: 0.7101671778665738
Energy: 0.7106843836403856
Energy: 0.7119513774674471
Energy: 0.7110475007829005
Energy: 0.7116905208267337
Energy: 0.7112583352900863
Energy: 0.7115575346602336
Energy: 0.7201547528672609
Energy: 0.7119155632166162
Energy: 0.7022560581724783
Energy: 0.7182034625205729
Energy: 0.7208357840496021
Energy: 0.7032924253347085
Energy: 0.8177340428883975
Energy: 0.7261721521892446
Energy: 0.7376725955911
Energy: 0.7131423172839997
Energy: 0.7506917983210705
Energy: 0.7141299629283232
Energy: 0.8053140021240934
Energy: 0.7031834730144025
Energy: 0.7018289113815852
Energy: 0.7432021780437135
Energy: 0.7026319038651744
Energy: 0.7027637949244722
Energy: 0.7100599831208843
Energy: 0.7230143724725502
Energy: 0.7188151597303184
Energy: 0.7002024246281278
Energy: 0.7278399488363976
Energy: 0.7027125045235202
Energy: 0.7485887148777421
Energy: 0.6998276908498023
Energy: 0.6994348032509303
Energy: 0.7491852042893961
Energy: 0.7008415639906931
Energy: 0.7254550012619935
Energy: 0.7473299634104262
Energy: 0.7028779765161922
Energy: 0.7200806661292823
Energy: 0.7328525950955816
Energy: 0.7010809420109851
Energy: 0.7101145684116983
Energy: 0.7164672757765896
Energy: 0.7128134604705484
Energy: 0.7119743196876911
Energy: 0.6939076365351963
Energy: 0.7148244879398321
Energy: 0.7115110635628743
Energy: 0.7021322841350249
Energy: 0.7181716855104718
Energy: 0.7105292034846084
Energy: 0.712568020884776
Energy: 0.7147925227080151
Energy: 0.7039050193211948
Energy: 0.7472556420556763
Energy: 0.7141961606499655
Energy: 0.7145210711912992
Energy: 0.7048206147699696
Energy: 0.713437395999835
Energy: 0.7169378362402733
Energy: 0.8095623826721243
Energy: 0.7085232871281576
Energy: 0.7088597012027968
Energy: 0.731288235182248
Energy: 0.7474649346339057
Energy: 0.738990504906771
Energy: 0.8320732101357377
Energy: 0.7134560768812908
Energy: 0.7155161725708925
Energy: 0.7226054112091215
Energy: 0.7095978737092697
Energy: 0.7093914929020302
Energy: 0.7984172608710138
Energy: 0.7113510247078123
Energy: 0.7080576620634311
Energy: 0.8059772806845122
Energy: 0.7136157564946939
Energy: 0.7391327870652658
Energy: 0.7122759860164585
Energy: 0.7356196530733535
Energy: 0.7360663109747556
Energy: 0.7112031490307172
Energy: 0.739590969660302
Energy: 0.7410359174031659
Energy: 1.0114541109936253
Energy: 0.7072584521833638
Energy: 0.751097607936979
Energy: 0.7496564491542347
Energy: 0.7064508012530516
Energy: 0.7516314860632507
Energy: 0.7139980039288866
Energy: 0.711230692894492
Energy: 0.7093727815268944
Energy: 0.7112431701206545
Energy: 0.7098705208429228
Energy: 0.7115157515418554
Energy: 0.7067884928698643
Energy: 0.7094220154399979
Energy: 0.7073935860355914
Energy: 0.7086827913471474
Energy: 0.7099791114403328
Energy: 0.7082135037468199
Energy: 0.7047687535065386
Energy: 0.7115771417409177
Energy: 0.710310209395246
Energy: 0.7073953961675323
Energy: 0.7095072174616869
Energy: 0.7257098889559909
Energy: 0.7046211579095208
Energy: 0.7120831339604311
Energy: 0.7055876516832918
Energy: 0.7052056826459445
Energy: 0.711323576850204
Energy: 0.7067062875325534
Energy: 0.7147315709549991
Energy: 0.7449821985596652
Energy: 0.7162459537159136
Energy: 0.715295303307221
Energy: 0.7113507775808467
Energy: 0.7129721539935824
Energy: 0.7282077157437838
Energy: 0.7047055144996087
Energy: 0.7223821317572522
Energy: 0.7173415756820077
Energy: 0.7087132751128603
Energy: 0.7159587586092211

minimum gb energy = 0.6939076365351963 eV
minimum distance =  2.36122209738148 Angstroms
sigma value = 81


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

Energy: 1.5192245594461349
Energy: 0.7307151798054266
Energy: 0.73083769961668
Energy: 0.7110918343635195
Energy: 0.7637795679157023
Energy: 0.7115133536950902
Energy: 0.6831989606091942
Energy: 0.7151618506874836
Energy: 0.720998196137152
Energy: 0.729462368620564
Energy: 0.692499796148893
Energy: 0.7231994095985868
Energy: 0.7195693775357804
Energy: 0.6890592916742114
Energy: 0.6901626039870751
Energy: 0.7141854207066237
Energy: 0.7047731854270053
Energy: 0.7353994184172578
Energy: 0.7097718610305164
Energy: 0.691410715688574
Energy: 0.7116877867311825
Energy: 0.7099959385258451
Energy: 0.7059471400813364
Energy: 0.7144002802462679
Energy: 0.7118419897748207
Energy: 0.7107441759683625
Energy: 0.7105249633763855
Energy: 0.7123813610811202
Energy: 0.7167488471363179
Energy: 0.7171256436083251
Energy: 0.7093439697244805
Energy: 0.7035380596584857
Energy: 0.717248747094604
Energy: 0.7123860088441524
Energy: 0.7151680301426439
Energy: 0.7171983771923318
Energy: 0.6984966982987891
Energy: 0.7061642315957085
Energy: 0.714663541359716
Energy: 0.72958651906912
Energy: 0.6919114133060659
Energy: 0.7102778890701379
Energy: 0.8323507654175379
Energy: 0.7532611171006471
Energy: 0.7595227494835121
Energy: 0.6762337513503622
Energy: 0.7719920972646452
Energy: 0.6809384032185142
Energy: 0.737498862874087
Energy: 0.7112850118963133
Energy: 0.7201329788955487
Energy: 0.7515491552557898
Energy: 0.6870354797636867
Energy: 0.7179108057715924
Energy: 0.7339963239670245
Energy: 0.70310259101606
Energy: 0.7022693258359921
Energy: 0.7155824150618292
Energy: 0.7150117419197154
Energy: 0.705100785964766
Energy: 0.700045588173495
Energy: 0.7106311272219112
Energy: 0.7134285226077941
Energy: 0.7230218311911851
Energy: 0.687267555740676
Energy: 0.705814013937891
Energy: 0.7383689209745181
Energy: 0.7018374677142337
Energy: 0.7100634527735941
Energy: 0.7076583614796044
Energy: 0.7113053674714621
Energy: 0.709632664470116
Energy: 0.7375992542791315
Energy: 0.71700412625325
Energy: 0.6993361556130308
Energy: 0.7051291039626969
Energy: 0.7166237223319905
Energy: 0.6890610486970706
Energy: 0.6966924200092043
Energy: 0.7249247725876357
Energy: 0.7176186786344737
Energy: 0.6954499394419724
Energy: 0.6890092186774781
Energy: 0.7169490328605852
Energy: 0.8038260707732995
Energy: 0.7173316887007471
Energy: 0.7243335295444048
Energy: 0.7268518098083487
Energy: 0.7169431404491499
Energy: 0.7197935470155857
Energy: 0.7335014125160713
Energy: 0.7277428782269894
Energy: 0.721996922440493
Energy: 0.724126270531332
Energy: 0.7116387205101208
Energy: 0.7223075249222922
Energy: 0.8051340132812072
Energy: 0.6768843765558109
Energy: 0.6759827119634335
Energy: 0.805476352512745
Energy: 0.6767848167775681
Energy: 0.6814599740043805
Energy: 0.6965573929426263
Energy: 0.7086807878333545
Energy: 0.7215506120050865
Energy: 0.7012369453692787
Energy: 0.7585923651348738
Energy: 0.7087608706740931
Energy: 0.8189058315922803
Energy: 0.7225766512531019
Energy: 0.708543112489368
Energy: 0.7087716031696796
Energy: 0.7232487924449462
Energy: 0.7086369438371685
Energy: 0.8192818407254607
Energy: 0.722924910068171
Energy: 0.707840398645027
Energy: 0.7086638567448659
Energy: 0.7206478889492265
Energy: 0.7083006872928138
Energy: 0.6961247116131863
Energy: 0.7076289585996017
Energy: 0.7183319030791062
Energy: 0.7023443310833591
Energy: 0.7084349864099965
Energy: 0.7191770982206619
Energy: 0.7231741203427104
Energy: 0.6881445376345202
Energy: 0.6859588924082906
Energy: 0.7235992509343412
Energy: 0.6904564024502408
Energy: 0.6870496758951444
Energy: 0.7275094532900547
Energy: 0.709759867910833
Energy: 0.7208162975823251
Energy: 0.7179478924569141
Energy: 0.6985208956651765
Energy: 0.7160022433958864
Energy: 0.7219271017202414
Energy: 0.7211326269427477
Energy: 0.7253580817489723
Energy: 0.7182571375607105
Energy: 0.7160052071795773
Energy: 0.7219284353677486
Energy: 0.6993448728771992
Energy: 0.7230718614120575
Energy: 0.728273269085847
Energy: 0.7013299103822264
Energy: 0.7227524287849815
Energy: 0.7238988491303471
Energy: 0.82882241110218
Energy: 0.7505264562166374
Energy: 0.7531804297120998
Energy: 0.6824871491310507
Energy: 0.7402420056267304
Energy: 0.7551637866409987
Energy: 0.8290860425541275
Energy: 0.7530486663936257
Energy: 0.7544513767783668
Energy: 0.6875591121685611
Energy: 0.7642157865936535
Energy: 0.7539377509614836
Energy: 0.6961065617354826
Energy: 0.7071540169625017
Energy: 0.7143160386584707
Energy: 0.7245091612977501
Energy: 0.6997168898809695
Energy: 0.7071179796466386
Energy: 0.7340856628341987
Energy: 0.7018808336538499
Energy: 0.7022143967575634
Energy: 0.7158033261439993
Energy: 0.7028948966749639
Energy: 0.7024981716471118
Energy: 0.7313971193943017
Energy: 0.7125152090403984
Energy: 0.713097888448659
Energy: 0.7034035768504135
Energy: 0.687135901627985
Energy: 0.7153563915131238
Energy: 0.7371791433399161
Energy: 0.7047083877010386
Energy: 0.71158549433469
Energy: 0.6886036899095903
Energy: 0.7594824790996613
Energy: 0.68893422939709
Energy: 0.7022688956466903
Energy: 0.6879581750881937
Energy: 0.6871175303822493
Energy: 0.6877417012347651
Energy: 0.6882581091561947
Energy: 0.7159040263446357
Energy: 0.7928103248209908
Energy: 0.7038332421333062
Energy: 0.7164348450837713
Energy: 0.7235872719566848
Energy: 0.7062278817996588
Energy: 0.7160892974154021
Energy: 0.7170433094114438
Energy: 0.7100397039639524
Energy: 0.7115501939374338
Energy: 0.7218986723707455
Energy: 0.7125419241521637
Energy: 0.7103970465391257
Energy: 0.7939879779499618
Energy: 0.7153592998972044
Energy: 0.7220917320035051
Energy: 0.7296983319597042
Energy: 0.6831343618824738
Energy: 0.7233438611205122
Energy: 0.7955387081077395
Energy: 0.6774079966961112
Energy: 0.6772701472366954
Energy: 0.7959954083177586
Energy: 0.6762521590580227
Energy: 0.7763593210803121
Energy: 0.7091308426344207
Energy: 0.7165138186930683
Energy: 0.7205328965462499
Energy: 0.7150651938531121
Energy: 0.692871819393566
Energy: 0.7295945336915016
Energy: 0.7774080686859441
Energy: 0.7114181773125489
Energy: 0.711925105418981
Energy: 0.7098154954324561
Energy: 0.7248350671965107
Energy: 0.7133018876732664

minimum gb energy = 0.6759827119634335 eV
minimum distance =  2.38680409811817 Angstroms
sigma value = 43


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

Energy: 1.2624096319862799
Energy: 0.8104820244183849
Energy: 0.7499901667786264
Energy: 0.6984758068534146
Energy: 0.7990379373319124
Energy: 0.6980617515236488
Energy: 0.6703643419213047
Energy: 0.7005942439000302
Energy: 0.6891357722319618
Energy: 0.724900463178395
Energy: 0.6819688547276257
Energy: 0.6878344846483736
Energy: 0.6824931720589361
Energy: 0.6705930907705245
Energy: 0.6701730278278505
Energy: 0.7183399099962768
Energy: 0.6706142789535976
Energy: 0.6839569510454934
Energy: 0.6839782537106375
Energy: 0.669752177933606
Energy: 0.6887497975635015
Energy: 0.6839959564537051
Energy: 0.6751647256048002
Energy: 0.6842041891300501
Energy: 0.6826166819766533
Energy: 0.6953325556746045
Energy: 0.6916068639004264
Energy: 0.6825471882249461
Energy: 0.688927099000628
Energy: 0.6907324016754338
Energy: 0.6829260085159551
Energy: 0.6886796546181547
Energy: 0.6888808913661993
Energy: 0.6888666086597
Energy: 0.6895440404289682
Energy: 0.6891344246461061
Energy: 0.6836948424304145
Energy: 0.683893377396224
Energy: 0.6905444555435422
Energy: 0.6882687313210715
Energy: 0.6838208990548555
Energy: 0.6904171155442796
Energy: 0.7734730955034353
Energy: 0.6822933971054882
Energy: 0.6823798965078863
Energy: 0.7014343584235461
Energy: 0.6829978455189579
Energy: 0.6831195549440149
Energy: 0.6789954697545043
Energy: 0.682796606104658
Energy: 0.6822807304492624
Energy: 0.678901635415077
Energy: 0.7257069357977606
Energy: 0.6903471136099347
Energy: 0.82025094220897
Energy: 0.6873122925943675
Energy: 0.6868133482044473
Energy: 0.7635324143061782
Energy: 0.6880774355763796
Energy: 0.6898633166387151
Energy: 0.6938323680572395
Energy: 0.6954637328169868
Energy: 0.7112295953320578
Energy: 0.6780158057541825
Energy: 0.6822209456089375
Energy: 0.686671933334055
Energy: 0.6876038365894325
Energy: 0.6847079665188354
Energy: 0.6848360292311418
Energy: 0.6938118408795665
Energy: 0.6847643523629349
Energy: 0.6849320912696312
Energy: 0.8034171834168732
Energy: 0.6852056067474444
Energy: 0.6945558859332956
Energy: 0.6733578409542782
Energy: 0.6842585839130233
Energy: 0.6947166897542553
Energy: 0.6927365312751166
Energy: 0.69044270978453
Energy: 0.6901333283903167
Energy: 0.6812827343083482
Energy: 0.6838508309914808
Energy: 0.690019454743469
Energy: 0.6950663457606006
Energy: 0.6958906659589094
Energy: 0.711338306851276
Energy: 0.703069620564643
Energy: 0.6869943542241357
Energy: 0.7117193673189794
Energy: 0.691907736135195
Energy: 0.6904373796579539
Energy: 0.7084388636601583
Energy: 0.6917536513108081
Energy: 0.6937849615947237
Energy: 0.6911449823081064
Energy: 0.6898270009214598
Energy: 0.7042109244562841
Energy: 0.7044635886681204
Energy: 0.6898997279259877
Energy: 0.7106314099006475
Energy: 0.7063044798711434
Energy: 0.6895902846976608
Energy: 0.6960763159803643
Energy: 0.705857257442954
Energy: 0.7080988199682774
Energy: 0.6965371931964723
Energy: 0.7080481798636887
Energy: 0.6931518429197517
Energy: 0.691942667435368
Energy: 0.7011174392251001
Energy: 0.6933145351749979
Energy: 0.6919521609458859
Energy: 0.6857410597783631
Energy: 0.789156391451094
Energy: 0.7010455948927015
Energy: 0.7014769069132383
Energy: 0.6946329929023178
Energy: 0.7015316197622954
Energy: 0.6849166104869181
Energy: 0.6895841042777372
Energy: 0.6963347251313805
Energy: 0.6962225212213611
Energy: 0.7038425491261481
Energy: 0.6904009823503378
Energy: 0.6961870936156344
Energy: 0.7733611893986272
Energy: 0.6994052324424758
Energy: 0.6973926179203678
Energy: 0.7738325337887987
Energy: 0.6783888877587003
Energy: 0.777301805404952
Energy: 0.6964244292309678
Energy: 0.6968224574399317
Energy: 0.6961436875189686
Energy: 0.7044931931148657
Energy: 0.7069276747909983
Energy: 0.7077468659325967
Energy: 0.7471859642863852
Energy: 0.7010837837246452
Energy: 0.7015190890055432
Energy: 0.7308427981565958
Energy: 0.6918060037167285
Energy: 0.7049302589029994
Energy: 0.6978976576174183
Energy: 0.6915078673263504
Energy: 0.7013007449709955
Energy: 0.6967406490970556
Energy: 0.6909812586700098
Energy: 0.7011549046906338
Energy: 0.7203452615644295
Energy: 0.7017985719529096
Energy: 0.704644359628604
Energy: 0.7101696407128384
Energy: 0.6922515943237862
Energy: 0.7097846252271927
Energy: 0.7205654549785039
Energy: 0.7047340628658526
Energy: 0.7051246739989642
Energy: 0.6917158498117432
Energy: 0.7021005941375144
Energy: 0.7100327259305689
Energy: 0.7292193308674543
Energy: 0.6912471242726159
Energy: 0.6908385976412539
Energy: 0.6835353287975585
Energy: 0.6951619279682806
Energy: 0.6894452145353418
Energy: 0.6839684996087818
Energy: 0.6850099261026233
Energy: 0.6848495801737093
Energy: 0.6838286159181306
Energy: 0.7015513343954841
Energy: 0.6846861767609767
Energy: 0.6833612373109189
Energy: 0.6911701224410038
Energy: 0.6906594951413353
Energy: 0.7241088367790364
Energy: 0.6822979809589169
Energy: 0.6881291519012264
Energy: 0.6848803860291612
Energy: 0.7310492201159449
Energy: 0.7058716552824883
Energy: 0.6985238476578888
Energy: 0.7376601371747841
Energy: 0.706614009794545

minimum gb energy = 0.669752177933606 eV
minimum distance =  2.36870899305521 Angstroms
sigma value = 57


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

Energy: 0.9665976469111597
Energy: 0.7026356037743718
Energy: 0.702793569836546
Energy: 0.6685893898290952
Energy: 0.7905429547389068
Energy: 0.7025712051604925
Energy: 0.6615985421092946
Energy: 0.7044887693734052
Energy: 0.6768312351162209
Energy: 0.7075636546475093
Energy: 0.7069633286092885
Energy: 0.6836354806707265
Energy: 0.6765937786910207
Energy: 0.6524883328177153
Energy: 0.6514233420406246
Energy: 0.692952874398885
Energy: 0.6535100867057447
Energy: 0.649655819584081
Energy: 0.6954174616520783
Energy: 0.6779323811770216
Energy: 0.6512803099863248
Energy: 0.6960248140325885
Energy: 0.6507505590764832
Energy: 0.6822712269379881
Energy: 0.6950714252223523
Energy: 0.6739029389072347
Energy: 0.671986305220633
Energy: 0.6775026028326604
Energy: 0.6809451008942363
Energy: 0.6761304435172975
Energy: 0.6522620158183285
Energy: 0.6711164015466907
Energy: 0.6762061748206146
Energy: 0.675076822779966
Energy: 0.6803405749867456
Energy: 0.6768908491554257
Energy: 0.7063637277921575
Energy: 0.6970080266416199
Energy: 0.6829452945850076
Energy: 0.6901092167788637
Energy: 0.6967570243697877
Energy: 0.6817804016139485
Energy: 0.7025908532398928
Energy: 0.6828898056623707
Energy: 0.6744371908395442
Energy: 0.6825830270487455
Energy: 0.6828880221053514
Energy: 0.6953481225658055
Energy: 0.7035830781486277
Energy: 0.6937966849507937
Energy: 0.6919055348638574
Energy: 0.706302288208417
Energy: 0.7023004396211961
Energy: 0.684941615748239
Energy: 0.8360638562292656
Energy: 0.6905515007884073
Energy: 0.6942918168524977
Energy: 0.7049136485693657
Energy: 0.6781613822704808
Energy: 0.6943982117081166
Energy: 0.6809473298839153
Energy: 0.6764391328453273
Energy: 0.6816612288474146
Energy: 0.7083690899860621
Energy: 0.6890442316790454
Energy: 0.7074290665642532
Energy: 0.6624718489919389
Energy: 0.6933556630968755
Energy: 0.7049990714922584
Energy: 0.6643793123236855
Energy: 0.7026982675503637
Energy: 0.7067910288367423
Energy: 0.6621710960841946
Energy: 0.6937032487007264
Energy: 0.722283943246077
Energy: 0.6497487895504886
Energy: 0.694219902454819
Energy: 0.7243595558366775
Energy: 0.6865201410132389
Energy: 0.6849108738200198
Energy: 0.6857676404879139
Energy: 0.7066049230571717
Energy: 0.7074972752202487
Energy: 0.6838406296630156
Energy: 0.6800457078907342
Energy: 0.6620663689619639
Energy: 0.662814462306744
Energy: 0.6981114028921755
Energy: 0.6558625995725537
Energy: 0.6624973422592142
Energy: 0.6957639900134888
Energy: 0.6830475537264744
Energy: 0.6817031942470987
Energy: 0.6962762591270334
Energy: 0.6759402284711546
Energy: 0.6823705399580776
Energy: 0.6989228888689154
Energy: 0.6741568046901851
Energy: 0.6741313034033259
Energy: 0.6782549102987797
Energy: 0.6741650753863075
Energy: 0.6773711641521675
Energy: 0.6979772798541344
Energy: 0.6784150680196139
Energy: 0.6720328238926755
Energy: 0.6797536118086793
Energy: 0.6799324799237608
Energy: 0.681651324358319
Energy: 0.7125045829682337
Energy: 0.6973473297117309
Energy: 0.7039141912090014
Energy: 0.6760918931519662
Energy: 0.6960804594037965
Energy: 0.7073241910056326
Energy: 0.7130488501880273
Energy: 0.6934912259312724
Energy: 0.7045653284767279
Energy: 0.6765653269541266
Energy: 0.6929595624970747
Energy: 0.7071917319402119
Energy: 0.6919681300115577
Energy: 0.7173801723862678
Energy: 0.6902427385022116
Energy: 0.7076904232031926
Energy: 0.7047287093992545
Energy: 0.6815508209143262
Energy: 0.8274287511434891
Energy: 0.6894692248394655
Energy: 0.6766852952751976
Energy: 0.6781760378047688
Energy: 0.688942162464248
Energy: 0.677040583451572
Energy: 0.6864645145342702
Energy: 0.7056168932584418
Energy: 0.6731009306903694
Energy: 0.7065527084650773
Energy: 0.7073771236348235
Energy: 0.6872637356563968
Energy: 0.6622238208423342
Energy: 0.6938062316211296
Energy: 0.7221523787717554
Energy: 0.6747414014192948
Energy: 0.693408066801582
Energy: 0.7242148182986878

minimum gb energy = 0.649655819584081 eV
minimum distance =  2.35194985862544 Angstroms
sigma value = 17


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

Energy: 0.6277704575838182
Energy: 0.7600724191722156
Energy: 0.8078076415611499
Energy: 0.659567957869386
Energy: 0.6961606704601486
Energy: 0.6837392974884106
Energy: 0.6580021233062993
Energy: 0.7238805865166696
Energy: 0.7182811443113433
Energy: 0.7343999318784261
Energy: 0.7245918061739793
Energy: 0.673417995127382
Energy: 0.8972773661162053
Energy: 0.6328748053889397
Energy: 0.6330309169629718
Energy: 0.7247930027855063
Energy: 0.6326998035996334
Energy: 0.6454727395631954
Energy: 0.734239259906228
Energy: 0.6326355765876028
Energy: 0.6471304700353774
Energy: 0.7352835856415427
Energy: 0.6464449534689737
Energy: 0.7168519922455807
Energy: 0.6480850671053456
Energy: 0.633447935907084
Energy: 0.6259718114833964
Energy: 0.6491264716944741
Energy: 0.6331811230172484
Energy: 0.6321173822972549
Energy: 0.6503283936587361
Energy: 0.6324480138966021
Energy: 0.6255656836166728
Energy: 0.6099193029154526
Energy: 0.6433215321139392
Energy: 0.6205169733070469
Energy: 0.6447970754258079
Energy: 0.6399154152168127
Energy: 0.6398737666836576
Energy: 0.6414155074505582
Energy: 0.6432710477373215
Energy: 0.625946425424648
Energy: 0.6295168253282548
Energy: 0.6174376849669088
Energy: 0.612212817062786
Energy: 0.6128341971253743
Energy: 0.6129573805342587
Energy: 0.6149331732393573
Energy: 0.6415994890247367
Energy: 0.6135451772773513
Energy: 0.6133178078409021
Energy: 0.6429551881472375
Energy: 0.6158477128685459
Energy: 0.6315215375754406
Energy: 0.6451662395280242
Energy: 0.6245239194809794
Energy: 0.6248273162556596
Energy: 0.6411418110200904
Energy: 0.6244899050153307
Energy: 0.6248704128992995
Energy: 0.6522375839869621
Energy: 0.631761966366576
Energy: 0.6322676502353347
Energy: 0.6407600353408285
Energy: 0.7304744787183153
Energy: 0.6327967904734046
Energy: 0.6492266569411659
Energy: 0.7303700105805826
Energy: 0.729538383660541
Energy: 0.6292754194700726
Energy: 0.7301178472964694
Energy: 0.7197934078139027
Energy: 0.7293826513917177
Energy: 0.7105944185645399
Energy: 0.7136730965152958
Energy: 0.6267934157813779
Energy: 0.7128820179592119
Energy: 0.7126347685107571
Energy: 0.7352319559141676
Energy: 0.7248233360648938
Energy: 0.71856542200453
Energy: 0.7347989938487374
Energy: 0.7307625069822892
Energy: 0.6575595778264659
Energy: 0.699396622211096
Energy: 0.7222219443544132
Energy: 0.7194126577233617
Energy: 0.7133754528809498
Energy: 0.7183023744483444
Energy: 0.7312442745937325
Energy: 0.8151175869437497
Energy: 0.7309605690933204
Energy: 0.6656250000554563
Energy: 0.7246069380672562
Energy: 0.7347172198051719
Energy: 0.7286475299522743
Energy: 0.7213676654785826
Energy: 0.7187433395279583
Energy: 0.8014315484116091
Energy: 0.6424438324400117
Energy: 0.7250614754949151
Energy: 0.801782751486982

minimum gb energy = 0.6099193029154526 eV
minimum distance =  2.3768725714289 Angstroms
sigma value = 17


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

Energy: 1.1806696049770031
Energy: 0.7703164064983943
Energy: 0.6487310925495777
Energy: 0.6465431093496466
Energy: 0.7227645854281449
Energy: 0.6464765560308953
Energy: 0.6482411225549094
Energy: 0.7047849128573351
Energy: 0.5963262578489411
Energy: 0.7135801064049393
Energy: 0.7018568351819723
Energy: 0.649309254595723
Energy: 0.8540931630811612
Energy: 0.5740533352463008
Energy: 0.6040470598711996
Energy: 0.720917659648457
Energy: 0.5745438618811826
Energy: 0.6077795808105035
Energy: 0.7169089118027065
Energy: 0.6343603640842869
Energy: 0.6289395382335062
Energy: 0.7179720182709702
Energy: 0.5787040783196562
Energy: 0.6485167544668189
Energy: 0.6275042279476102
Energy: 0.6001848664069105
Energy: 0.5966504086223579
Energy: 0.6280024862294559
Energy: 0.6145220125081196
Energy: 0.598213927551426
Energy: 0.6300670552445415
Energy: 0.5934697046614036
Energy: 0.5718080350809435
Energy: 0.5761795059916471
Energy: 0.618602440469867
Energy: 0.572670404970605
Energy: 0.579583284607995
Energy: 0.6186264574384892
Energy: 0.6185422928468938
Energy: 0.5662952722142423
Energy: 0.621850350116272
Energy: 0.5685316587573013
Energy: 0.5805966673839823
Energy: 0.5596338746118212
Energy: 0.5653991507895104
Energy: 0.5686766810074452
Energy: 0.5592377207626792
Energy: 0.5651506150414215
Energy: 0.5812990975518887
Energy: 0.5652882006372694
Energy: 0.5810532266181578
Energy: 0.5820373497018616
Energy: 0.5748422225124958
Energy: 0.5803981841327044
Energy: 0.5797192697571496
Energy: 0.5630575399132993
Energy: 0.5633636147386839
Energy: 0.5798701661641003
Energy: 0.5626786984368788
Energy: 0.5632486409273082
Energy: 0.5900543765927262
Energy: 0.580929625060669
Energy: 0.562559859731891
Energy: 0.5620637497289979
Energy: 0.5800140614069392
Energy: 0.5621917535468185
Energy: 0.5830168373148158
Energy: 0.5807498513482773
Energy: 0.5804152405787362
Energy: 0.5840996547537202
Energy: 0.5845983418178311
Energy: 0.5816907216789724
Energy: 0.5925792190393858
Energy: 0.5651015344710169
Energy: 0.5645466935605872
Energy: 0.565749191749112
Energy: 0.6067359951580491
Energy: 0.5655317551392117
Energy: 0.619651799920721
Energy: 0.5683694498667246
Energy: 0.568309996644524
Energy: 0.6212320016244036
Energy: 0.566583675632408
Energy: 0.618676350388708
Energy: 0.6186163261628627
Energy: 0.5680700989197808
Energy: 0.5739040810632434
Energy: 0.618834267611319
Energy: 0.5668215828272296
Energy: 0.5896920794037152
Energy: 0.7149550591170387
Energy: 0.6165647026811397
Energy: 0.5975959820215789
Energy: 0.6142631392508814
Energy: 0.6248147754219713
Energy: 0.6009951339120299
Energy: 0.5807801770427716
Energy: 0.7142505984051967
Energy: 0.7140669981933192
Energy: 0.5782185924707611
Energy: 0.7200146636712614
Energy: 0.5949962200237539
Energy: 0.6412105919607828
Energy: 0.6961602188648857
Energy: 0.7008868291768717
Energy: 0.6304256290948589
Energy: 0.6989515555251663
Energy: 0.5942528158765614
Energy: 0.7936438049392373
Energy: 0.7139953241734267
Energy: 0.6495184993926603
Energy: 0.7145225943184209
Energy: 0.6241412812908055
Energy: 0.5966725950440444
Energy: 0.8576836844771841
Energy: 0.6123519241850106
Energy: 0.611955761346401
Energy: 0.6972453548214714
Energy: 0.5997024938767108
Energy: 0.7016841162315445
Energy: 0.850496178116706
Energy: 0.6604327652783994
Energy: 0.682687820049716
Energy: 0.7151670563750622
Energy: 0.6974882273962038
Energy: 0.7007609158850912
Energy: 0.5895870203964971
Energy: 0.7086949519167738
Energy: 0.7782590180790132
Energy: 0.6283282123959918
Energy: 0.7020085883748572
Energy: 0.6313660237101557
Energy: 0.5918596447907195
Energy: 0.7067904134999032
Energy: 0.7017171622880074
Energy: 0.5932836175925474
Energy: 0.6976550082990107
Energy: 0.6623691432104671
Energy: 0.84922775773076
Energy: 0.6220426358375507
Energy: 0.7008549879174302
Energy: 0.715266225301453
Energy: 0.5771908658970446
Energy: 0.6615768967509629
Energy: 0.7137351232152199
Energy: 0.5763211528892982
Energy: 0.6043251614140869
Energy: 0.7139103015669872
Energy: 0.576238726875515
Energy: 0.6104507830953424
Energy: 0.6299786324174628
Energy: 0.5941403720107968
Energy: 0.5986565547865368
Energy: 0.6268888168587171
Energy: 0.613677698864209
Energy: 0.6169806566270459
Energy: 0.5707279224171316
Energy: 0.6013896220340661
Energy: 0.6038898818628533
Energy: 0.574219392504033
Energy: 0.5954712575297679
Energy: 0.5747422230465433
Energy: 0.5767833246155659
Energy: 0.6250052449415424
Energy: 0.6189899213592687
Energy: 0.5769607899965302
Energy: 0.6209908051644835
Energy: 0.6187058237036265
Energy: 0.5801345082586616
Energy: 0.5680856209831496
Energy: 0.568760563105486
Energy: 0.5676831040053237
Energy: 0.6186841714325519
Energy: 0.568760288408268
Energy: 0.5800705712786751
Energy: 0.5587094420562394
Energy: 0.565428878461225
Energy: 0.5803164852406694
Energy: 0.5592567450992344
Energy: 0.5649911542100031
Energy: 0.5843829535046482
Energy: 0.5644443208787204
Energy: 0.5645934867725518
Energy: 0.5855029679638063
Energy: 0.5599443987516303
Energy: 0.5747957259191051
Energy: 0.5807972016345224
Energy: 0.5645672361634528
Energy: 0.5644803853363397
Energy: 0.5721484494562624
Energy: 0.5608558369476723
Energy: 0.5644284317324072
Energy: 0.5882470370986915
Energy: 0.5853597073072663
Energy: 0.5805115861449018
Energy: 0.588484551821032
Energy: 0.5815139693983061
Energy: 0.5805189711078667
Energy: 0.6335452259291531
Energy: 0.571346537247839
Energy: 0.5677835761220623
Energy: 0.5661835217432454
Energy: 0.5652410025048855
Energy: 0.5691162219846818
Energy: 0.6252333572877752
Energy: 0.5680132807223937
Energy: 0.5679274771260401
Energy: 0.6256370164940963
Energy: 0.568211356605255
Energy: 0.568770106944131
Energy: 0.6263232807151137
Energy: 0.5667902559454483
Energy: 0.5938174466367189
Energy: 0.6272164793928796
Energy: 0.5669941402389564
Energy: 0.6149935664190204
Energy: 0.7981257160317666
Energy: 0.594384680226571
Energy: 0.5941502463570146
Energy: 0.6165945275468834
Energy: 0.6245062485953629
Energy: 0.5895393988704332
Energy: 0.5865837174537057
Energy: 0.7187955327528337
Energy: 0.7143792673149463
Energy: 0.6063995494367644
Energy: 0.7155920217692702
Energy: 0.6167382885063901
Energy: 0.6104261443925186
Energy: 0.6856293315419625
Energy: 0.611691391545308
Energy: 0.5905017722255507
Energy: 0.6788770170573375
Energy: 0.6038047136144473
Energy: 0.618674610869432
Energy: 0.6977121342045112
Energy: 0.6795809265193975
Energy: 0.6296518187235444
Energy: 0.7171303049173
Energy: 0.6239233145656491
Energy: 0.7995221720187373
Energy: 0.5958353087605877
Energy: 0.6885393042048801
Energy: 0.7012073967707856
Energy: 0.5964875317384765
Energy: 0.6921427169902108
Energy: 0.8555072740553801
Energy: 0.6483674565986742
Energy: 0.5975552046055609
Energy: 0.7153010853761059
Energy: 0.6284960356304619
Energy: 0.681342075373498
Energy: 0.5932224898136871
Energy: 0.7063580459371481
Energy: 0.7012772143974675
Energy: 0.5910035460841012
Energy: 0.7142181984549102
Energy: 0.6620603033030741

minimum gb energy = 0.5587094420562394 eV
minimum distance =  2.37678285709384 Angstroms
sigma value = 57


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

Energy: 0.5396395697182408
Energy: 0.7307571510211675
Energy: 0.6178546079080752
Energy: 0.5521314514582294
Energy: 0.8959869912106772
Energy: 0.618287010933625
Energy: 0.7104145047761006
Energy: 0.5655049807731627
Energy: 0.566954465285199
Energy: 0.6536155330281768
Energy: 0.5700746726749093
Energy: 0.5651568032560093
Energy: 0.8058591614687073
Energy: 0.5420639999223236
Energy: 0.5426175639210693
Energy: 0.6938033014283027
Energy: 0.5419509149089365
Energy: 0.5817233188067599
Energy: 0.6888735632898
Energy: 0.5418351866193393
Energy: 0.6110450819354094
Energy: 0.5915166770462467
Energy: 0.5434304800676475
Energy: 0.6138406452784728
Energy: 0.5938594968716786
Energy: 0.5653208120688729
Energy: 0.5683115703820648
Energy: 0.5936329257278278
Energy: 0.5884470966851718
Energy: 0.5654342804528306
Energy: 0.5461720370957273
Energy: 0.563450189318026
Energy: 0.5409629087399291
Energy: 0.5243864000890239
Energy: 0.5991362101802207
Energy: 0.5417452035607792
Energy: 0.5532695137027429
Energy: 0.605327978141256
Energy: 0.5991180841178568
Energy: 0.531481632568352
Energy: 0.6042661089185493
Energy: 0.536079789811378
Energy: 0.7238153342435226
Energy: 0.520123806231256
Energy: 0.5200675259229419
Energy: 0.5345670454210137
Energy: 0.5198401354670207
Energy: 0.5306433640506956
Energy: 0.5562433610138633
Energy: 0.5525537762075855
Energy: 0.5542399093679719
Energy: 0.5577483526944294
Energy: 0.5596864457301014
Energy: 0.5539309854538838
Energy: 0.5670222049214864
Energy: 0.5259995244815411
Energy: 0.5254486298527485
Energy: 0.5532117458274808
Energy: 0.525371183718048
Energy: 0.5262684331505811
Energy: 0.5386965037966979
Energy: 0.5330032381047621
Energy: 0.5298157846917947
Energy: 0.5147890683508519
Energy: 0.5458904098948695
Energy: 0.5167649211081058
Energy: 0.5570847286631652
Energy: 0.5401581227455128
Energy: 0.5447609978952586
Energy: 0.5337768026683978
Energy: 0.5374690156313029
Energy: 0.5191772288565725
Energy: 0.5333059457129645
Energy: 0.5689191398886895
Energy: 0.5233802550924713
Energy: 0.5219877032117086
Energy: 0.5738397949802923
Energy: 0.5231113706511843
Energy: 0.5341380248950811
Energy: 0.518692309167151
Energy: 0.5341770304888799
Energy: 0.5352939942699875
Energy: 0.5388296070669134
Energy: 0.5445237939268839
Energy: 0.5325919674453484
Energy: 0.5179976799339826
Energy: 0.5173355533407535
Energy: 0.5329375842260288
Energy: 0.5195762469055983
Energy: 0.5172394302069199
Energy: 0.5654757033830946
Energy: 0.5649857804828922
Energy: 0.5234223907048091
Energy: 0.5243339869610969
Energy: 0.5627784169498226
Energy: 0.5222541378035835
Energy: 0.5347452811342437
Energy: 0.5630183955888443
Energy: 0.5532161304109208
Energy: 0.525148599955725
Energy: 0.5598694274110861
Energy: 0.536139016628151
Energy: 0.5362423496232559
Energy: 0.5393364309256176
Energy: 0.5400553460163534
Energy: 0.5368929682267357
Energy: 0.5393560371382826
Energy: 0.5402166343794795
Energy: 0.5996590521380423
Energy: 0.5372067273802007
Energy: 0.5659063244690237
Energy: 0.6013195255629658
Energy: 0.5393988972498508
Energy: 0.5996494104269684
Energy: 0.6808881006707954
Energy: 0.5439251617004255
Energy: 0.5432206214944193
Energy: 0.5882220539350264
Energy: 0.5340837939046065
Energy: 0.5663797472315325
Energy: 0.7512345080576275
Energy: 0.5906598029375207
Energy: 0.589894106609087
Energy: 0.588198157161911
Energy: 0.5898276392332853
Energy: 0.5663985330592939
Energy: 0.5338086822522302
Energy: 0.6990029005421337
Energy: 0.599998123254741
Energy: 0.5324982594931156
Energy: 0.6959727237043966
Energy: 0.5629379734494163
Energy: 0.5577795787400459
Energy: 0.6367522394831288
Energy: 0.6308307550447091
Energy: 0.569616071195161
Energy: 0.6904008919658742
Energy: 0.6282580457064024
Energy: 0.7513794002273966
Energy: 0.5927341495015508
Energy: 0.5658516249826202
Energy: 0.5897648740791768
Energy: 0.5991664794126881
Energy: 0.5692537991756532
Energy: 0.8099477910160636
Energy: 0.5655542290060042
Energy: 0.561960325192233
Energy: 0.6694745615152277
Energy: 0.5656698350488935
Energy: 0.6515829173108731
Energy: 0.8015355737622673
Energy: 0.6321114895434261
Energy: 0.6330543111495068
Energy: 0.6906908605214162
Energy: 0.6534183154591349
Energy: 0.5626501912478882
Energy: 0.5383741793069573
Energy: 0.671509394788946
Energy: 0.6096919170110839
Energy: 0.5441820761283835
Energy: 0.6764540083242864
Energy: 0.5823031937564058

minimum gb energy = 0.5147890683508519 eV
minimum distance =  2.38820621867573 Angstroms
sigma value = 43


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

Energy: 0.46303627451258905
Energy: 0.5934626122164871
Energy: 0.5499441898059174
Energy: 0.46781642351944047
Energy: 0.6875548367963666
Energy: 0.5174711421139212
Energy: 0.6590614048461008
Energy: 0.4815303746139467
Energy: 0.47745995553594756
Energy: 0.5590295183648595
Energy: 0.5125767123382772
Energy: 0.4782011374710674
Energy: 0.6900834289656756
Energy: 0.4541365241074051
Energy: 0.4709970816050576
Energy: 0.5624098487488544
Energy: 0.4533378369022592
Energy: 0.4715595313328753
Energy: 0.6012983593127335
Energy: 0.47022116027447824
Energy: 0.47186211921109256
Energy: 0.514097474296099
Energy: 0.559916645031053
Energy: 0.5309237643159469
Energy: 0.5324405260988991
Energy: 0.4817364052874719
Energy: 0.47689531313967076
Energy: 0.5051117583383222
Energy: 0.5042707058939846
Energy: 0.4774820281426908
Energy: 0.44914980305490876
Energy: 0.5323773830028464
Energy: 0.46451010343323107
Energy: 0.4623802843957424
Energy: 0.5319664263659273
Energy: 0.47172431343810867
Energy: 0.6341159675499206
Energy: 0.5321346757234897
Energy: 0.5320196150531721
Energy: 0.4551728187016718
Energy: 0.5372942624313095
Energy: 0.4532744236503863
Energy: 0.6279489941225644
Energy: 0.43816515613474627
Energy: 0.44635806607379297
Energy: 0.4548433553960392
Energy: 0.43732638352648845
Energy: 0.44514167460645265
Energy: 0.4938763551674301
Energy: 0.4446065790383244
Energy: 0.49992346046335684
Energy: 0.4953928339511562
Energy: 0.4579806742340474
Energy: 0.4918225014901554
Energy: 0.4791630303208139
Energy: 0.4399736011495876
Energy: 0.44009798172501474
Energy: 0.49226306374400924
Energy: 0.4394709921913367
Energy: 0.43975704729955434
Energy: 0.4454868400536931
Energy: 0.4674582379569236
Energy: 0.4377412353377858
Energy: 0.4519768069032668
Energy: 0.4677717654242795
Energy: 0.43512716880657615
Energy: 0.49613590877956953
Energy: 0.46765701827895617
Energy: 0.4677623761076763
Energy: 0.43669802068936825
Energy: 0.4740308560320625
Energy: 0.44298747834075847
Energy: 0.6016880768737551
Energy: 0.46624779553935103
Energy: 0.4714689861341884
Energy: 0.4705501200944309
Energy: 0.46443214264501076
Energy: 0.4719085837522286
Energy: 0.4537596225113598
Energy: 0.43503465614319864
Energy: 0.45360435955481604
Energy: 0.4548904231929633
Energy: 0.4472892840387735
Energy: 0.45372602464318773
Energy: 0.4534012372366547
Energy: 0.4312683189157219
Energy: 0.4308250318259944
Energy: 0.4534736946031289
Energy: 0.4317247299439582
Energy: 0.4303740200314338
Energy: 0.44828671065059805
Energy: 0.44700842463370516
Energy: 0.43259788693087536
Energy: 0.42889443204764144
Energy: 0.44707452682539245
Energy: 0.42835369874853996
Energy: 0.45640897385170875
Energy: 0.44694708253992216
Energy: 0.44709000242959496
Energy: 0.43240892937845704
Energy: 0.4470404869429317
Energy: 0.4336868993851726
Energy: 0.4473270674594436
Energy: 0.4330898298401424
Energy: 0.4339308093834799
Energy: 0.4470189555845636
Energy: 0.4622992664583888
Energy: 0.4336599181480427
Energy: 0.44740947304189527
Energy: 0.4451800754083534
Energy: 0.4472350783391699
Energy: 0.44855799237198707
Energy: 0.5269081259369353
Energy: 0.44711031334529994
Energy: 0.44702920396192075
Energy: 0.4378440295988081
Energy: 0.43836364958196355
Energy: 0.4477517687274165
Energy: 0.4621594127456326
Energy: 0.4383305095286941
Energy: 0.4705422494553991
Energy: 0.45353617099944954
Energy: 0.4536704205253583
Energy: 0.4519523010507647
Energy: 0.4537074664242473
Energy: 0.4383063092687496
Energy: 0.47139501580345805
Energy: 0.4535868541424506
Energy: 0.44908374043416277
Energy: 0.43109255910327804
Energy: 0.453830095602862
Energy: 0.4311116021258124
Energy: 0.4675902640588566
Energy: 0.4340553749796697
Energy: 0.4337717721332538
Energy: 0.4676201721788984
Energy: 0.4337031230288231
Energy: 0.4337398452487066
Energy: 0.467805054749388
Energy: 0.4433443678694292
Energy: 0.46771777097173256
Energy: 0.4691522971480773
Energy: 0.44570860001244966
Energy: 0.46751829815824725
Energy: 0.6123749616884095
Energy: 0.4535558189353785
Energy: 0.46203968831938086
Energy: 0.48465065331420326
Energy: 0.4530142210758807
Energy: 0.4609783873991135
Energy: 0.5656851233524698
Energy: 0.492171310252001
Energy: 0.49180985859323323
Energy: 0.438762869379025
Energy: 0.4922518930688376
Energy: 0.4452388646327065
Energy: 0.4476795763639115
Energy: 0.4917660437158105
Energy: 0.452624269935145
Energy: 0.4381270748762014
Energy: 0.49173657551310346
Energy: 0.4425822775381569
Energy: 0.4920835966183345
Energy: 0.45619557513391534
Energy: 0.4546492596577341
Energy: 0.4966567046370536
Energy: 0.47868573823725147
Energy: 0.4535842946690083
Energy: 0.5344834452531119
Energy: 0.45674592477582693
Energy: 0.5355547288157256
Energy: 0.5357213766021204
Energy: 0.45573818994451953
Energy: 0.5319704186262756
Energy: 0.6494947205099666
Energy: 0.4459230953371486
Energy: 0.45836634820108973
Energy: 0.5127774427824646
Energy: 0.44556217620839955
Energy: 0.45808110877332614
Energy: 0.6483885986943843
Energy: 0.5123571758637696
Energy: 0.5124038679153149
Energy: 0.5125132468502491
Energy: 0.5123037837905057
Energy: 0.48073317120725156
Energy: 0.4553454262555949
Energy: 0.565229404311422
Energy: 0.48459528544323005
Energy: 0.4543243656365563
Energy: 0.6004590905562515
Energy: 0.4719177279917014
Energy: 0.596748394787079
Energy: 0.5154556423317707
Energy: 0.5156761422376313
Energy: 0.515715917281242
Energy: 0.5596557013612011
Energy: 0.5161016027408823
Energy: 0.6502366708142838
Energy: 0.4872810963805049
Energy: 0.4870749417126975
Energy: 0.5140656192046774
Energy: 0.5643187472761777
Energy: 0.5590565579426674
Energy: 0.6910441023941217
Energy: 0.46891044718487457
Energy: 0.4912880697121651
Energy: 0.5624628082596296
Energy: 0.46863886603708227
Energy: 0.5196559375483588
Energy: 0.6590614020579736
Energy: 0.5147038901593977
Energy: 0.5155588126815464
Energy: 0.6006101173089909
Energy: 0.5584585618054295
Energy: 0.47899816468950773

minimum gb energy = 0.42835369874853996 eV
minimum distance =  2.41502009208459 Angstroms
sigma value = 81


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

Energy: 0.036466648997363696
Energy: 0.06705184787601387
Energy: 0.03703587241506681
Energy: 0.03853726643340041
Energy: 0.11415506401191347
Energy: 0.0370464672749759
Energy: 0.06724719471938524
Energy: 0.037402994907642186
Energy: 0.03741708803888029
Energy: 0.06844461823791939
Energy: 0.038437601256276946
Energy: 0.03740470419733484
Energy: 0.06621174850090665
Energy: 0.03711825924324953
Energy: 0.037513940818727616
Energy: 0.06632581812697493
Energy: 0.03700782915535707
Energy: 0.06644525511938362
Energy: 0.03928696482057051
Energy: 0.03714359571338014
Energy: 0.03709946346440641
Energy: 0.04110839091143348
Energy: 0.03703757682951039
Energy: 0.06683011670699357
Energy: 0.0664110459599318
Energy: 0.06629104415855129
Energy: 0.06637662443459937
Energy: 0.067309901105346
Energy: 0.06606885786544532
Energy: 0.06780607345535598
Energy: 0.037533718206490575
Energy: 0.03774056278917091
Energy: 0.03710869154341808
Energy: 0.03876990035605786
Energy: 0.03713664243708156
Energy: 0.03703064295174728
Energy: 0.0664341366695163
Energy: 0.037535455315760774
Energy: 0.037514652188933184
Energy: 0.06662732231979585
Energy: 0.039160025218442016
Energy: 0.037537912976355794
Energy: 0.06618742432097481
Energy: 0.03717531085945964
Energy: 0.03722578153847513
Energy: 0.06617340037380087
Energy: 0.03688810480558818
Energy: 0.06759542354637715
Energy: 0.03819215170011092
Energy: 0.03715224971607512
Energy: 0.06859167052213952
Energy: 0.039138869474864856
Energy: 0.037196077010617196
Energy: 0.06810736109584643
Energy: 0.037346351050724556
Energy: 0.06598968157945126
Energy: 0.06623347727500785
Energy: 0.037401966634698566
Energy: 0.06601777097251288
Energy: 0.06597068003022438

minimum gb energy = 0.036466648997363696 eV
minimum distance =  2.53116377276155 Angstroms
sigma value = 3


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

Energy: 0.5496920669370013
Energy: 0.56591006257585
Energy: 0.538942747348896
Energy: 0.5121518480798803
Energy: 0.5335443437892776
Energy: 0.5140215686752305
Energy: 0.5359297016223253
Energy: 0.5391910142108128
Energy: 0.5415805611738396
Energy: 0.538624121939646
Energy: 0.541924303567309
Energy: 0.541818982026436
Energy: 0.553597794333494
Energy: 0.5158335496059032
Energy: 0.5158501928506718
Energy: 0.5359987988281044
Energy: 0.512836041374975
Energy: 0.5324178713218252
Energy: 0.5193888753044809
Energy: 0.5161659355954692
Energy: 0.5157771988519966
Energy: 0.519118663019437
Energy: 0.46645216155353586
Energy: 0.5329319586524003
Energy: 0.47570168374873895
Energy: 0.5436406422038246
Energy: 0.5426168729961631
Energy: 0.47587248456088227
Energy: 0.5406615448761818
Energy: 0.5420080630112848
Energy: 0.5139449055490216
Energy: 0.5405847471283859
Energy: 0.5259445698047049
Energy: 0.440815282998205
Energy: 0.5406947660253532
Energy: 0.49900761679022626
Energy: 0.5211088503714724
Energy: 0.48319095146487745
Energy: 0.4839102804338892
Energy: 0.5210571436325224
Energy: 0.4868012132146694
Energy: 0.5284854883344718
Energy: 0.5190364690651298
Energy: 0.5066727376929541
Energy: 0.5071113079376348
Energy: 0.5191005049921092
Energy: 0.4842720332980665
Energy: 0.489278189760313
Energy: 0.5323208503995279
Energy: 0.5076064196469765
Energy: 0.5321657113288842
Energy: 0.5349645087984385
Energy: 0.4468695237681712
Energy: 0.5322307757975071
Energy: 0.4921318902523021
Energy: 0.4820518802495025
Energy: 0.48156279962982307
Energy: 0.4925470398178509
Energy: 0.48700169285883677
Energy: 0.4954295145177517
Energy: 0.5094626029559416
Energy: 0.5131903037642627
Energy: 0.5140338131525539
Energy: 0.43217169500270053
Energy: 0.5152571806259407
Energy: 0.49096717479279023
Energy: 0.45190290740024597
Energy: 0.5171137699273343
Energy: 0.5184479638273823
Energy: 0.45120771187063247
Energy: 0.5157512308615464
Energy: 0.4511206274066317
Energy: 0.4526372229659661
Energy: 0.48093982649988043
Energy: 0.495992036818927
Energy: 0.45264879833405375
Energy: 0.4188920667024937
Energy: 0.47445829068789164
Energy: 0.506731777856355
Energy: 0.47466550824403414
Energy: 0.4980636562089307
Energy: 0.45431645531561476
Energy: 0.4336013105654912
Energy: 0.4976178300835313
Energy: 0.5033002491229787
Energy: 0.43007311965867373
Energy: 0.42980110844856495
Energy: 0.5013331620250018
Energy: 0.43509735229608093
Energy: 0.43011919145067146
Energy: 0.5008714043395508
Energy: 0.48718304958563985
Energy: 0.4870371479240352
Energy: 0.4842462438745816
Energy: 0.49783708569185064
Energy: 0.4868224074488005
Energy: 0.42533934235691034
Energy: 0.48670290024103285
Energy: 0.485250050600752
Energy: 0.4190747931877607
Energy: 0.48806877400977644
Energy: 0.4188699149230208
Energy: 0.4199389119917935
Energy: 0.48142127676641794
Energy: 0.48171074620291876
Energy: 0.4199512178682176
Energy: 0.4212500664780258
Energy: 0.48209731695818453
Energy: 0.4939165537345224
Energy: 0.4563386911256489
Energy: 0.48071879631415737
Energy: 0.45353344385038236
Energy: 0.45477163945809596
Energy: 0.48103563614800965
Energy: 0.49746771161184866
Energy: 0.41910746779599245
Energy: 0.41887099370423264
Energy: 0.4985901069209655
Energy: 0.4244583866402743
Energy: 0.4191503519285511
Energy: 0.49738276533699327
Energy: 0.48376511368969194
Energy: 0.48686022999419676
Energy: 0.4971757790286166
Energy: 0.5019720610310293
Energy: 0.4855181890409355
Energy: 0.4333811125314589
Energy: 0.4840037140105498
Energy: 0.48454795928193667
Energy: 0.43110098601838337
Energy: 0.4853138748931191
Energy: 0.4299827848019006
Energy: 0.43009355100208274
Energy: 0.4980079315586597
Energy: 0.49815529092617256
Energy: 0.4301338101353431
Energy: 0.4532776285850925
Energy: 0.4957366452062381
Energy: 0.50407504482247
Energy: 0.45263161658752527
Energy: 0.4801321397029915
Energy: 0.46348324006784575
Energy: 0.452401612568659
Energy: 0.4862458804319272
Energy: 0.5230996178240302
Energy: 0.45113543101348125
Energy: 0.4509278711022606
Energy: 0.5229065733445717
Energy: 0.4569456493817503
Energy: 0.4513485795413222
Energy: 0.5179093200259886
Energy: 0.5000668998095199
Energy: 0.5002852047765501
Energy: 0.5191607927294158
Energy: 0.48113958644676114
Energy: 0.5137087537437101
Energy: 0.485988879835333
Energy: 0.4997518400792563
Energy: 0.49998266229729155
Energy: 0.4854567820510516
Energy: 0.5208064216691465
Energy: 0.4963988883503685
Energy: 0.4617520985642384
Energy: 0.5366175793437002
Energy: 0.5355649621532366
Energy: 0.46173545206693417
Energy: 0.4789745350608987
Energy: 0.5359812772312806
Energy: 0.5130812068748365
Energy: 0.5196349755849926
Energy: 0.5109015495164375
Energy: 0.4319124817944484
Energy: 0.5199872655225921
Energy: 0.49451910009294153
Energy: 0.48448355667153137
Energy: 0.5235996699304912
Energy: 0.5238575779844513
Energy: 0.4846611603881351
Energy: 0.5244625978435616
Energy: 0.5320739499528246
Energy: 0.5213806279237929
Energy: 0.5119791380812927
Energy: 0.5125046331355854
Energy: 0.5216181167426851
Energy: 0.4859593032762243
Energy: 0.5126683284833007
Energy: 0.556018046875037
Energy: 0.5100800685151838
Energy: 0.5407500443364276
Energy: 0.5375629180162642
Energy: 0.48783860673757384
Energy: 0.5419457307008796
Energy: 0.48657085628395125
Energy: 0.5185933331883426
Energy: 0.5178002211184894
Energy: 0.48637468007788404
Energy: 0.5237986668895777
Energy: 0.5140579224241796

minimum gb energy = 0.4188699149230208 eV
minimum distance =  2.35335067177736 Angstroms
sigma value = 67


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

Energy: 0.6622251803247216
Energy: 0.6635894240454168
Energy: 0.6515297981989114
Energy: 0.5515002353947088
Energy: 0.6596345241386885
Energy: 0.6551823627995769
Energy: 0.6353056399368394
Energy: 0.6536646432698922
Energy: 0.6460075578471092
Energy: 0.6514891984381985
Energy: 0.6533111099147634
Energy: 0.6486854741625795
Energy: 0.6703203691062044
Energy: 0.6276018520678533
Energy: 0.6463083734740482
Energy: 0.6507301342378332
Energy: 0.6285782652366864
Energy: 0.6425404729504846
Energy: 0.6195558215796682
Energy: 0.6431399496192336
Energy: 0.6427534202364154
Energy: 0.6195850332899193
Energy: 0.6370787666824593
Energy: 0.6421048870268845
Energy: 0.613146058538316
Energy: 0.6538207415970863
Energy: 0.650814915681016
Energy: 0.613462250902608
Energy: 0.6544438686002281
Energy: 0.6490443261069071
Energy: 0.622588754806751
Energy: 0.6443702321876055
Energy: 0.6299075434548684
Energy: 0.568630807709927
Energy: 0.6444037833792091
Energy: 0.6290296626695552
Energy: 0.6236874836948894
Energy: 0.6212061359633538
Energy: 0.6187995803511569
Energy: 0.6224438997770986
Energy: 0.6189682079852719
Energy: 0.6175061659000252
Energy: 0.6206447609548201
Energy: 0.6099298904918706
Energy: 0.6151090641836546
Energy: 0.6154545344936008
Energy: 0.5417997473083253
Energy: 0.6172532199969893
Energy: 0.630173218244274
Energy: 0.6341153861642856
Energy: 0.6368723373596383
Energy: 0.6321941064424048
Energy: 0.5687303002554269
Energy: 0.6366887499015069
Energy: 0.6334214029770946
Energy: 0.5721532868171119
Energy: 0.5689579729014818
Energy: 0.6336974680909072
Energy: 0.570611808466287
Energy: 0.568955925998006
Energy: 0.630223104192377
Energy: 0.6163015819454521
Energy: 0.6156542735279478
Energy: 0.5423084459609404
Energy: 0.6162296948908653
Energy: 0.61646492343033
Energy: 0.5468400158023011
Energy: 0.6121059588922388
Energy: 0.6123459020702577
Energy: 0.5465657298596837
Energy: 0.5715305732393903
Energy: 0.5409630958761392
Energy: 0.5486004259733466
Energy: 0.6070350663870743
Energy: 0.6057420012797735
Energy: 0.5414989103741791
Energy: 0.544131988146303
Energy: 0.5413398271583046
Energy: 0.6139409067380426
Energy: 0.6077336562702818
Energy: 0.6052538569841434
Energy: 0.5424377583298863
Energy: 0.5821188651621615
Energy: 0.60440421337081
Energy: 0.6159356203519161
Energy: 0.5446644594567381
Energy: 0.5490125060528739
Energy: 0.6160994432003821
Energy: 0.5435803237896936
Energy: 0.5417504019094017
Energy: 0.6164579737225635
Energy: 0.6174181710819265
Energy: 0.613912852537344
Energy: 0.5709268875192407
Energy: 0.5896188073041291
Energy: 0.611921726507202
Energy: 0.5736984580992944
Energy: 0.6080037102269134
Energy: 0.6044980530607641
Energy: 0.5742243955525468
Energy: 0.5365139904910898
Energy: 0.5684707995101694
Energy: 0.5687255898687748
Energy: 0.6339654145671346
Energy: 0.6377450251059027
Energy: 0.5691412404541165
Energy: 0.634008201718101
Energy: 0.6113928682793188
Energy: 0.6138383651069803
Energy: 0.6311405372601098
Energy: 0.6207256531956536
Energy: 0.5500852299341699
Energy: 0.6310877976364455
Energy: 0.6205575917503264
Energy: 0.6235465548773976
Energy: 0.6259945541965651
Energy: 0.6189832529611853
Energy: 0.6237846430451346
Energy: 0.6195375463734782
Energy: 0.6170247964395128
Energy: 0.6174453754388666
Energy: 0.6423326979537816
Energy: 0.6398889118195359
Energy: 0.6176166554467363
Energy: 0.6161345818169852
Energy: 0.641773315114635
Energy: 0.6697910042295131
Energy: 0.615154195980166
Energy: 0.6401861968970609
Energy: 0.6506623957417519
Energy: 0.6151230568129676
Energy: 0.6415029928350529
Energy: 0.6354954205495176
Energy: 0.6199464211057971
Energy: 0.6262333921604375
Energy: 0.6359657754325687
Energy: 0.6178476354728898
Energy: 0.6175049282495918

minimum gb energy = 0.5365139904910898 eV
minimum distance =  2.34849960266993 Angstroms
sigma value = 33


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

Energy: 0.7653274867680563
Energy: 0.7595534182925832
Energy: 0.7617745845652706
Energy: 0.7443187704626124
Energy: 0.7455911405147038
Energy: 0.7222560378726216
Energy: 0.7114803130708687
Energy: 0.6795448832923926
Energy: 0.6793828832438492
Energy: 0.6773404573209701
Energy: 0.7460941134804214
Energy: 0.6355084845656498
Energy: 0.7574747451924988
Energy: 0.6707738342084273
Energy: 0.7180053218298426
Energy: 0.7299794806379487
Energy: 0.677627063420979
Energy: 0.6801625514877689
Energy: 0.6806813120779076
Energy: 0.7018649730760295
Energy: 0.7179742878040105
Energy: 0.6807841927623433
Energy: 0.728397103337736
Energy: 0.7190529016050973
Energy: 0.6792886034346641
Energy: 0.6822311219003131
Energy: 0.6280521449891637
Energy: 0.6791107926324523
Energy: 0.6817956283312423
Energy: 0.6341629977559512
Energy: 0.7144332908376041
Energy: 0.6280819478150383
Energy: 0.627449386968036
Energy: 0.6291945071885587
Energy: 0.6274099810537022
Energy: 0.6363658511387358
Energy: 0.6793500450797431
Energy: 0.6290668831044601
Energy: 0.6280226257498356
Energy: 0.6794536078193737
Energy: 0.6282261753025147
Energy: 0.6790936175098805
Energy: 0.6805351538534923
Energy: 0.6253683529612936
Energy: 0.6416537704351877
Energy: 0.6804115901887382
Energy: 0.6303861353818848
Energy: 0.6337494947300591
Energy: 0.6991300418474573
Energy: 0.6778510929406889
Energy: 0.7058267318024339
Energy: 0.6345034803650732
Energy: 0.6282166089683715
Energy: 0.7025282440174155
Energy: 0.699191455408085
Energy: 0.6309947753264828
Energy: 0.6269895678348221
Energy: 0.7001856986555627
Energy: 0.6272819411547379
Energy: 0.6266692477527217
Energy: 0.6642835941252463
Energy: 0.6722278084909333
Energy: 0.6876608067506782
Energy: 0.6293856964647793
Energy: 0.6646346827123595
Energy: 0.6860818107438971
Energy: 0.6259214449971022
Energy: 0.6278632414138269
Energy: 0.6289650809525571
Energy: 0.6257740819622587
Energy: 0.638321249516473
Energy: 0.6261968315405134
Energy: 0.6264051303290036
Energy: 0.7032978273674259
Energy: 0.7037645430073047
Energy: 0.6263932323394465
Energy: 0.6354422876601081
Energy: 0.6264376243404949
Energy: 0.6137565995292542
Energy: 0.6330309099711626
Energy: 0.6995374409652398
Energy: 0.6144209585633816
Energy: 0.699246634091155
Energy: 0.68440708100358
Energy: 0.7090025620570223
Energy: 0.6831736255763075
Energy: 0.6331844642536089
Energy: 0.6120323607190136
Energy: 0.6801200183607102
Energy: 0.6776191293828057
Energy: 0.6735574883528753
Energy: 0.6114736727741219
Energy: 0.610526493591064
Energy: 0.6743970147555318
Energy: 0.637915733303851
Energy: 0.673934687293341
Energy: 0.7595851601195115
Energy: 0.6375091987829248
Energy: 0.611319498337128
Energy: 0.7303149759990485
Energy: 0.6424893758412247
Energy: 0.6106146404067653
Energy: 0.759718738291948
Energy: 0.6808296322106189
Energy: 0.6791419550217885
Energy: 0.6766857367959537
Energy: 0.6799932138007918
Energy: 0.7279983622649858
Energy: 0.7173138649664662
Energy: 0.7315741058950135
Energy: 0.7346440374555198
Energy: 0.6429544488390235
Energy: 0.7315367100257811
Energy: 0.7048051203090233
Energy: 0.7112022559699769
Energy: 0.6821374300517837
Energy: 0.6827689011651942
Energy: 0.7117141644876798
Energy: 0.6818866195978138
Energy: 0.6341829088400784
Energy: 0.7609555314107771
Energy: 0.7121313748244519
Energy: 0.6297387237382721
Energy: 0.7314361606497383
Energy: 0.6845278647219226
Energy: 0.6296130522274441
Energy: 0.732607776091321
Energy: 0.6711213523234699
Energy: 0.7180441659288596
Energy: 0.7321828948125755
Energy: 0.6711756243138299
Energy: 0.7195219449163749
Energy: 0.679167166959781
Energy: 0.6827487095029935
Energy: 0.6345709604285524
Energy: 0.6793940432174955
Energy: 0.6823622793306782
Energy: 0.6783005857156831
Energy: 0.7143024723681222
Energy: 0.6272394978371993
Energy: 0.6276216053645921
Energy: 0.6253758450817962
Energy: 0.6266786330301104
Energy: 0.6944823844931491
Energy: 0.6788349991291095
Energy: 0.6281836388889223
Energy: 0.6277993333862548
Energy: 0.678987469125336
Energy: 0.6281967023225518
Energy: 0.7243247109846589
Energy: 0.6840259479990712
Energy: 0.6256280925266158
Energy: 0.7021446760017468
Energy: 0.6803537276544237
Energy: 0.6297156954141704
Energy: 0.6351343788359465
Energy: 0.6984485320822285
Energy: 0.6767975988154186
Energy: 0.7069085190573258
Energy: 0.7017486713587321
Energy: 0.6425298476023864
Energy: 0.7034137179995041
Energy: 0.6991419858714318
Energy: 0.6268107546542717
Energy: 0.6268969106341443
Energy: 0.7000773985001235
Energy: 0.6277100766755689
Energy: 0.6265040678638548
Energy: 0.6630621515243996
Energy: 0.6656254150021929
Energy: 0.6844501469957152
Energy: 0.6302033114117818
Energy: 0.6635378117570507
Energy: 0.6879986831585402
Energy: 0.6257863204114499
Energy: 0.6270412805074983
Energy: 0.6286437050329923
Energy: 0.6258482888963873
Energy: 0.640583953793105
Energy: 0.6263876924772793
Energy: 0.6286020193140406
Energy: 0.7015023543144
Energy: 0.6695062513929698
Energy: 0.626722193386451
Energy: 0.6345831996264226
Energy: 0.6262692621953923
Energy: 0.6112529996538434
Energy: 0.6325560243881015
Energy: 0.6987827119162687
Energy: 0.6145899360193222
Energy: 0.7031262736629996
Energy: 0.68502504949558
Energy: 0.7031405961242654
Energy: 0.6841011952107933
Energy: 0.6363538002404372
Energy: 0.6130258649587561
Energy: 0.681010137783678
Energy: 0.6741404465536169
Energy: 0.6733719980357783
Energy: 0.7157662524638658
Energy: 0.673016198397919
Energy: 0.6336858702014837
Energy: 0.6383126148863673
Energy: 0.6727729019145842
Energy: 0.8000935245543155
Energy: 0.6376930435221293
Energy: 0.6112126934223474
Energy: 0.7329579554793894
Energy: 0.6151355608480014
Energy: 0.61082478105233
Energy: 0.7635667959540716
Energy: 0.6822965943264185
Energy: 0.632644912625012
Energy: 0.6823987695885342
Energy: 0.6822417479688648
Energy: 0.6325697769489101
Energy: 0.7175995608544911
Energy: 0.7314238997902877
Energy: 0.7340746992296672
Energy: 0.6407871976400996
Energy: 0.7313935073719185
Energy: 0.7040020724313785

minimum gb energy = 0.610526493591064 eV
minimum distance =  2.36729676686836 Angstroms
sigma value = 41


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

Energy: 0.8735908937750532
Energy: 0.8404464473239187
Energy: 0.840294851261593
Energy: 0.7380287972923613
Energy: 0.7714362639614223
Energy: 0.8391069260902889
Energy: 0.7936193490220108
Energy: 0.7756976653434191
Energy: 0.7768288382662238
Energy: 0.7733148125972016
Energy: 0.7749481606573871
Energy: 0.7525403976503869
Energy: 0.8781669274956665
Energy: 0.7371350376036718
Energy: 0.7347871901304542
Energy: 0.7737744516322473
Energy: 0.7404140879963491
Energy: 0.736793354957932
Energy: 0.776896709181118
Energy: 0.7373510545337427
Energy: 0.735380500051377
Energy: 0.7772114989919443
Energy: 0.7385761027519832
Energy: 0.7617212039469026
Energy: 0.760819643831169
Energy: 0.7765945303504516
Energy: 0.7544757909518048
Energy: 0.7610637845559342
Energy: 0.7761053475575561
Energy: 0.7376578278673106
Energy: 0.7745865709098422
Energy: 0.7788052939774633
Energy: 0.7369828661267326
Energy: 0.7634045177841596
Energy: 0.7786427898609787
Energy: 0.7362314299073333
Energy: 0.7596641172914612
Energy: 0.7397091432108633
Energy: 0.7510040923372331
Energy: 0.7597135822771953
Energy: 0.7381335706075024
Energy: 0.7402781008427224
Energy: 0.7635763543613092
Energy: 0.7388325683187958
Energy: 0.7372962912471623
Energy: 0.7644887760762251
Energy: 0.7646642335892784
Energy: 0.7643642868839706
Energy: 0.8038832233168309
Energy: 0.7385320738412267
Energy: 0.736574988587541
Energy: 0.8037586665704911
Energy: 0.781368144591487
Energy: 0.7366132265241684
Energy: 0.7779755673611288
Energy: 0.7647139145378611
Energy: 0.7723891285463212
Energy: 0.7664089109510772
Energy: 0.7608614528918608
Energy: 0.736519292931695
Energy: 0.8304178234641861
Energy: 0.7741441822927606
Energy: 0.7407671337539107
Energy: 0.8296987647014387
Energy: 0.7232344879855355
Energy: 0.7401175160528662
Energy: 0.8825483031572396
Energy: 0.7228805986581357
Energy: 0.7234241076592709
Energy: 0.8836562439189276
Energy: 0.7226096837379298
Energy: 0.7742045850526454
Energy: 0.8812140547307051
Energy: 0.7628378388991358
Energy: 0.7528637658182696
Energy: 0.7740793239082416
Energy: 0.7637867234428569
Energy: 0.7523787171278452
Energy: 0.7217936391380056
Energy: 0.7754830869140447
Energy: 0.7283759106041674
Energy: 0.7264648110497949
Energy: 0.7751776674866203
Energy: 0.7246734126872388

minimum gb energy = 0.7217936391380056 eV
minimum distance =  2.3549106904969 Angstroms
sigma value = 11


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

Energy: 0.8515465161377851
Energy: 1.1021663048368828
Energy: 0.906769024031827
Energy: 0.8844180016086135
Energy: 0.8832622799145416
Energy: 0.8602554266616634
Energy: 0.9602108058199327
Energy: 0.8557268267786208
Energy: 0.8588069705604985
Energy: 0.8926287882244407
Energy: 0.8549834385986689
Energy: 0.8841989541924311
Energy: 1.008844972557785
Energy: 0.8577975289019425
Energy: 0.8624017614552257
Energy: 0.8614616962989584
Energy: 0.8584926660340347
Energy: 0.8754509258434547
Energy: 0.8844574495086754
Energy: 0.8487223210470953
Energy: 0.879592629859663
Energy: 0.8578822090446595
Energy: 0.8509675888512952
Energy: 0.879181350707086
Energy: 0.8789877123219338
Energy: 0.8567404734351145
Energy: 0.8570054217849984
Energy: 0.8644985210760946
Energy: 0.859484079943948
Energy: 0.8849493725735349
Energy: 0.9011127863862423
Energy: 0.8630426933263812
Energy: 0.8664357052871454
Energy: 0.8566935767042554
Energy: 0.8726182209019402
Energy: 0.8709885494296732
Energy: 0.8728556594759005
Energy: 0.8661872562310319
Energy: 0.8663808940047745
Energy: 0.8727976625535318
Energy: 0.8742586825192857
Energy: 0.8706033064755124
Energy: 0.8707948462094145
Energy: 0.8572758512411413
Energy: 0.8840630177505806
Energy: 0.8569398910609914
Energy: 0.8992964894514538
Energy: 0.8582671004688835
Energy: 0.8504905918719438
Energy: 0.8753024385083339
Energy: 0.8799424034629054
Energy: 0.8451403242527413
Energy: 0.8635477339000518
Energy: 0.8469554780436915
Energy: 0.8503981402862762
Energy: 0.8749906707500424
Energy: 0.8804139678406362
Energy: 0.8472681075863738
Energy: 0.8616063446115628
Energy: 0.8509226926355925
Energy: 0.871180824872689
Energy: 0.8591499379406543
Energy: 0.8850061113111414
Energy: 0.8570153749989456
Energy: 0.8610159077507767
Energy: 0.8577662467221091
Energy: 0.8564344829241354
Energy: 0.8550838781525417
Energy: 0.8616883513954627
Energy: 0.8567684354076902
Energy: 0.8612970387087051
Energy: 0.8714441037395717
Energy: 0.8550489405867651
Energy: 0.8574604638249685
Energy: 0.8571368346768691
Energy: 0.8548783000445471
Energy: 0.8652325772421456
Energy: 0.8856273219102048
Energy: 0.8704654368615455
Energy: 0.8739563122740721
Energy: 0.8689964962830016
Energy: 0.8584530977117149
Energy: 0.893352251955633
Energy: 0.8633988628915807
Energy: 0.8495983211188775
Energy: 0.8568916718591695
Energy: 0.878100768450336
Energy: 0.8539433375139402
Energy: 0.8586311403411901
Energy: 0.878528186929305
Energy: 0.8496588072307455
Energy: 0.8561639316089037
Energy: 0.8796160031474787
Energy: 0.8507621466936598
Energy: 0.8588391869566546
Energy: 0.8493111003742329
Energy: 0.848771066787419
Energy: 0.8536227266031066
Energy: 0.8810243808919123
Energy: 0.8491818151784394
Energy: 0.8546304656158663
Energy: 0.8719495246588513
Energy: 0.8872754092288947
Energy: 0.8734771416644164
Energy: 0.8938087255201774
Energy: 0.8583780292866474
Energy: 0.9228723078540493
Energy: 0.8590122741263748
Energy: 0.8646105812048925
Energy: 0.8542507566266176
Energy: 0.8534855073818137
Energy: 0.8651567895805679
Energy: 0.8544759777870855
Energy: 0.8816418332816474
Energy: 0.8746940336284623
Energy: 0.8475125968660826
Energy: 0.8592599657197987
Energy: 0.8601202817154688
Energy: 0.8514007380770294
Energy: 0.8731941167802457
Energy: 0.9285032031814098
Energy: 0.8507983091030041
Energy: 0.8737956353865509
Energy: 0.8574441064946391
Energy: 0.8510662594755027
Energy: 0.8567145832650548
Energy: 0.8903577764200721
Energy: 0.8569213898412121
Energy: 0.8560846727584014
Energy: 0.8707274678182868
Energy: 0.8579040826629373
Energy: 0.8711128700991061
Energy: 0.8711056995673668
Energy: 0.8691574364926304
Energy: 0.874004366356797
Energy: 0.8582137617186083
Energy: 0.8600600749064792
Energy: 0.862096924235557
Energy: 0.9254259151922847
Energy: 0.8652639076321649
Energy: 0.8725998290825456
Energy: 0.8658726626072312
Energy: 0.8613750720869987
Energy: 0.8532747837987329
Energy: 0.9212400305204633
Energy: 0.857892830212009
Energy: 0.8719921711217206
Energy: 0.922281575672305
Energy: 0.8557554915875024
Energy: 0.8614248791474939
Energy: 0.9193299051615527
Energy: 0.8637560864518639
Energy: 0.8791156378234134
Energy: 0.8584368290128254
Energy: 0.8532736254424196
Energy: 0.8792292404463458
Energy: 0.8984579333803637
Energy: 0.8550574371405669
Energy: 0.8494753025404275
Energy: 0.8587689121014528
Energy: 0.8510781756583191
Energy: 0.8787587719719121
Energy: 0.8987490600236395
Energy: 0.8505204274427638
Energy: 0.8790316987260546
Energy: 0.8583398109992417
Energy: 0.8538122017921159
Energy: 0.878210136333275
Energy: 0.9125929698750971
Energy: 0.8596812622475942
Energy: 0.8606894124736616
Energy: 0.858875057655015
Energy: 0.8813441780826988
Energy: 0.8678698967014491
Energy: 1.0080706897108969
Energy: 0.8554624222006706
Energy: 0.8839818248061481
Energy: 0.8657451574460794
Energy: 0.8551163151108797
Energy: 0.8786911452164111
Energy: 0.8848002447787049
Energy: 0.8585113898367179
Energy: 0.8715139964094267
Energy: 0.8519128479724312
Energy: 0.8575558371539822
Energy: 0.8589502478350242

minimum gb energy = 0.8451403242527413 eV
minimum distance =  2.34926787873833 Angstroms
sigma value = 57


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

Energy: 1.1842159761591318
Energy: 0.9628381180634515
Energy: 0.9652869543674029
Energy: 0.9614824277399059
Energy: 1.2713579764153722
Energy: 0.9635063514896879
Energy: 0.8506141528900683
Energy: 0.8742376837116143
Energy: 0.8714766051869823
Energy: 0.8801894286409062
Energy: 0.8783490048985613
Energy: 0.8687203948398892
Energy: 0.9143992757003131
Energy: 0.8908238960386549
Energy: 0.888948961891388
Energy: 0.9153195006806097
Energy: 0.8752035490127807
Energy: 0.8726002185845748
Energy: 0.8724514149538034
Energy: 0.8764656824034545
Energy: 0.8677969135985462
Energy: 0.8735667541953346
Energy: 0.8713248068803037
Energy: 0.86885927910372
Energy: 0.8773989041447763
Energy: 0.8760554773903422
Energy: 0.8718272358854146
Energy: 0.8743631391637661
Energy: 0.8737847058939694
Energy: 0.869332752273519
Energy: 0.8744140150415711
Energy: 0.8800349665902897
Energy: 0.8779573770377919
Energy: 0.8779580516712754
Energy: 0.9163455457878145
Energy: 0.8715830380174235
Energy: 0.913015691004013
Energy: 0.889169586536479
Energy: 0.8942876374025299
Energy: 0.9140214274520596
Energy: 0.8853424699860278
Energy: 0.9339390221960563
Energy: 0.9553543234922881
Energy: 0.8762046658294824
Energy: 0.8725305915690432
Energy: 0.8767188424050881
Energy: 0.8749139341654935
Energy: 0.8679210363195704
Energy: 0.8512762440825449
Energy: 0.8751157408108499
Energy: 0.8891735185997918
Energy: 0.8557381031393906
Energy: 0.8723237647258121
Energy: 0.8912225690658522
Energy: 0.8506239216118332
Energy: 0.874425567231589
Energy: 0.8893716934137476
Energy: 0.8551050741542191
Energy: 0.873434606285514
Energy: 0.8524344185888354
Energy: 0.9133747286478311
Energy: 0.8773786161561608
Energy: 0.8806366718441133
Energy: 0.8770175531560302
Energy: 0.8751803809903081
Energy: 0.8683437189072755
Energy: 0.9042599933104298
Energy: 0.89204245181453
Energy: 0.8893374495944356
Energy: 0.9044256634565411
Energy: 0.8937658969011517
Energy: 0.875562489028118
Energy: 0.8808564177529408
Energy: 0.8738966367103698
Energy: 0.8993022124433618
Energy: 0.8797388378551344
Energy: 0.8774690453220867
Energy: 0.8680016803147496
Energy: 0.873488306975421
Energy: 0.9153249475521053
Energy: 0.8749876963056135
Energy: 0.878032720711788
Energy: 0.9158764914795383
Energy: 0.8772588345613912
Energy: 0.8781945303650847
Energy: 0.8866333853566497
Energy: 0.8697153462871189
Energy: 0.876432523837017
Energy: 0.8862748531423648
Energy: 0.8680879134825549
Energy: 0.9163396528063545
Energy: 0.8871473658347308
Energy: 0.8869323189454642
Energy: 0.9142285569394072
Energy: 0.8867417248327634
Energy: 0.8781658974110949
Energy: 0.8507042932923851
Energy: 0.8800729981524492
Energy: 0.8712569433601327
Energy: 0.8513052347071094
Energy: 0.8787897509477773
Energy: 0.8723354727583063

minimum gb energy = 0.8506141528900683 eV
minimum distance =  2.35843229929984 Angstroms
sigma value = 9


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

Energy: 1.449161377101277
Energy: 0.9672103155598119
Energy: 0.9250526955280272
Energy: 0.923546460539726
Energy: 1.3640667803776647
Energy: 0.9237383116505203
Energy: 0.9513615578145783
Energy: 0.9172008661959415
Energy: 0.9188833432438992
Energy: 0.9146915903855494
Energy: 0.9395081444109622
Energy: 0.9174014234048808
Energy: 0.9254734543942278
Energy: 0.9243416110425879
Energy: 0.9213813394999399
Energy: 0.9053544794325838
Energy: 0.914140120769608
Energy: 0.9187083477216602
Energy: 0.9110461574458566
Energy: 0.9159958729380363
Energy: 0.9307936040277989
Energy: 0.913753376516296
Energy: 0.9139135485166867
Energy: 0.929034951745804
Energy: 0.9504013363863928
Energy: 0.8915253095128293
Energy: 0.8887802925143299
Energy: 0.8873020217014229
Energy: 0.887847948090024
Energy: 0.8876330105972928
Energy: 0.9218689543824241
Energy: 0.9172849628530498
Energy: 0.9153240682498557
Energy: 0.9227445472794574
Energy: 0.9204412377613473
Energy: 0.9154621870410118
Energy: 0.9055268434937023
Energy: 0.9159316957273448
Energy: 0.9077122578100695
Energy: 0.8866919591997617
Energy: 0.9193389740056039
Energy: 0.9169816026785598
Energy: 0.9417339359724494
Energy: 0.9157331091395118
Energy: 0.919581154234932
Energy: 0.9065500119174511
Energy: 0.914805393086715
Energy: 0.9201957598375017
Energy: 0.9611199454456177
Energy: 0.8911381203401899
Energy: 0.8895391227397894
Energy: 0.9373505488403462
Energy: 0.8879616628200093
Energy: 0.920306377383017
Energy: 0.9609013976426313
Energy: 0.8895524790737058
Energy: 0.887023136616305
Energy: 0.9374028130969346
Energy: 0.9069458797741091
Energy: 0.8868911922627569
Energy: 0.9416717200646694
Energy: 0.9040519779499164
Energy: 0.9033021881939942
Energy: 0.9082161317426947
Energy: 0.9022224303746325
Energy: 0.8886636445796807
Energy: 0.9468762779959574
Energy: 0.9160810709966865
Energy: 0.9225154596091186
Energy: 0.9269839146399409
Energy: 0.9144531300915707
Energy: 0.9168089885146393
Energy: 0.960981936551928
Energy: 0.9162187164495339
Energy: 0.9168171535169
Energy: 0.9275382231454125
Energy: 0.9133604455781584
Energy: 0.9149483490735639
Energy: 0.9474003921654622
Energy: 0.9143655937806167
Energy: 0.9157612692071104
Energy: 0.9278037632558533
Energy: 0.9148332893091315
Energy: 0.9284621413931898
Energy: 0.9410209238468097
Energy: 0.9029879925743816
Energy: 0.8862963264990953
Energy: 0.9266312287363119
Energy: 0.9009470351778623
Energy: 0.8905096468667424
Energy: 0.925686961937512
Energy: 0.9276461912848566
Energy: 0.8853846491014163
Energy: 0.9262885403404287
Energy: 0.9354881531612405
Energy: 0.8855403729732148
Energy: 0.9317785688025478
Energy: 0.9272815131894493
Energy: 0.9294417706072393
Energy: 0.9334870154862849
Energy: 0.9132599947256861
Energy: 0.9155654386846233
Energy: 1.0297311190904668
Energy: 0.9159297004112805
Energy: 0.8875921763847102
Energy: 0.8915439541277663
Energy: 0.93261537588142
Energy: 0.8878585076627685
Energy: 0.9266797089664892
Energy: 0.9149811722327021
Energy: 0.9230310602284257
Energy: 0.9269147595058201
Energy: 0.9088617207435802
Energy: 0.9195658423692417
Energy: 0.9259241470753272
Energy: 0.9299933521051307
Energy: 0.9242710135874527
Energy: 0.887126466357309
Energy: 0.9145261133184747
Energy: 0.9194728058090836
Energy: 0.9310175020847773
Energy: 0.8890184948767467
Energy: 0.9175236537928738
Energy: 0.9145763009413199
Energy: 0.9299329697046566
Energy: 0.8866018995802658

minimum gb energy = 0.8853846491014163 eV
minimum distance =  2.3567606359874 Angstroms
sigma value = 27


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

Energy: 0.8745793166014907
Energy: 0.8597959789668795
Energy: 0.8563599760614723
Energy: 0.8746865626407224
Energy: 1.299104586264648
Energy: 0.8575697451612248
Energy: 0.8548480761278009
Energy: 0.8654379262576337
Energy: 0.867264954409627
Energy: 0.8690769541692567
Energy: 0.8625029795648401
Energy: 0.8690075125592884
Energy: 0.8699743511099516
Energy: 0.8687159524423592
Energy: 0.8684238247339787
Energy: 0.8707337217292724
Energy: 0.876005533136179
Energy: 0.8676225082012297
Energy: 0.8618619903475685
Energy: 0.8633636241082868
Energy: 0.8635177680515778
Energy: 0.8627633189638415
Energy: 0.8676795465492942
Energy: 0.870275002869947
Energy: 0.9048827540323305
Energy: 0.8651372470382875
Energy: 0.8632677199995352
Energy: 0.8660523293821029
Energy: 0.8652753373773127
Energy: 0.8646252742227261
Energy: 0.8747239876956434
Energy: 0.8687524793665716
Energy: 0.8681740196180552
Energy: 0.8732300517059783
Energy: 0.8693299180870592
Energy: 0.8672080533146374
Energy: 0.8645023206304719
Energy: 0.8619548039439006
Energy: 0.860068549909002
Energy: 0.8650275587290049
Energy: 0.8751528006535296
Energy: 0.8574935326557097
Energy: 0.8686900501278157
Energy: 0.8823981529701423
Energy: 0.8644652728296411
Energy: 0.8631610617009425
Energy: 0.8859890718494524
Energy: 0.8626690738016862
Energy: 0.997202778128406
Energy: 0.864901655652591
Energy: 0.866940874223742
Energy: 0.8628056671234204
Energy: 0.864261008831481
Energy: 0.8691256719289185
Energy: 1.0040388773290938
Energy: 0.864342062414413
Energy: 0.8673943310510676
Energy: 0.8629052860731724
Energy: 0.8618067963815282
Energy: 0.8690303787990308
Energy: 0.8751797104150681
Energy: 0.8637650405223195
Energy: 0.86981692871475
Energy: 0.8633824439790323
Energy: 0.8723087341984596
Energy: 0.8672784150982338
Energy: 0.869019840663993
Energy: 0.868689115816319
Energy: 0.8689600634103447
Energy: 0.8623792700388382
Energy: 0.8686214321179646
Energy: 0.8687923983300535
Energy: 0.8831279360189579
Energy: 0.8655070391184733
Energy: 0.8606476898792463
Energy: 0.8813856744112669
Energy: 0.8624596941229109
Energy: 0.8626095711063412
Energy: 0.8760335058991348
Energy: 0.866384590745236
Energy: 0.8679543779550926
Energy: 0.8574372110462002
Energy: 0.8639429028568113
Energy: 0.8585363466781122
Energy: 0.8713940831802249
Energy: 0.8624299768281163
Energy: 0.8678566265961076
Energy: 0.863342644534799
Energy: 0.8628544488423766
Energy: 0.8685000492825956
Energy: 0.8608081541875761
Energy: 0.8650978265175627
Energy: 0.8679229549201107
Energy: 0.8610970926736901
Energy: 0.8633440370187214
Energy: 0.8683865114901018
Energy: 0.8986663884180426
Energy: 0.8655336827394665
Energy: 0.8626494292915942
Energy: 0.8726961587009232
Energy: 0.8630943286317454
Energy: 0.8632992929206886
Energy: 0.8770917669535917
Energy: 0.8652295945001298
Energy: 0.8694148465466294
Energy: 0.868728918702576
Energy: 0.8643992493035028
Energy: 0.8709868793650972
Energy: 0.8596436836913312
Energy: 0.8568109717429517
Energy: 0.8578616499905499
Energy: 0.8604532567287687
Energy: 0.8567111132393087
Energy: 0.8576440956204373
Energy: 0.8700735026687377
Energy: 0.8568816447450278
Energy: 0.8579002872581362
Energy: 0.8721980825382213
Energy: 0.8567796939194638
Energy: 0.8576863145331968
Energy: 0.8745061923751394
Energy: 0.864136403424814
Energy: 0.8696863169031072
Energy: 0.8696071622566591
Energy: 0.8644246881753525
Energy: 0.8623053897473485
Energy: 0.8941734023640202
Energy: 0.8630937930294702
Energy: 0.8681558015864544
Energy: 0.8935105428123196
Energy: 0.8626071074402515
Energy: 0.867923109975953
Energy: 0.8689920516916688
Energy: 0.8676657955719684
Energy: 0.8690772708133773
Energy: 0.8618443487862436
Energy: 0.8677673504102288
Energy: 0.8682756373904179
Energy: 0.872263098767078
Energy: 0.863593655747123
Energy: 0.8670562167277716
Energy: 0.8635142123806808
Energy: 0.862448833239575
Energy: 0.8650549475323263
Energy: 0.8757001327319553
Energy: 0.8656512736774045
Energy: 0.867928555227008
Energy: 0.8572969029080871
Energy: 0.8622974706878364
Energy: 0.8586684908137303

minimum gb energy = 0.8548480761278009 eV
minimum distance =  2.34618228098452 Angstroms
sigma value = 19


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

Energy: 0.9292822993976263
Energy: 0.9335783491504348
Energy: 0.8997817191299626
Energy: 0.8856390151997998
Energy: 0.9184029621998406
Energy: 0.8637633369438444
Energy: 0.9053019010702023
Energy: 0.8749908170787863
Energy: 0.8703660039665109
Energy: 0.8735746799411834
Energy: 0.8750715586232731
Energy: 0.8731523791467256
Energy: 0.9069314772758136
Energy: 0.8734722167208508
Energy: 0.8750005978198285
Energy: 0.8829060325507332
Energy: 0.8763139559489396
Energy: 0.8716660554786306
Energy: 0.9039912849131602
Energy: 0.8762572887534417
Energy: 0.8743356686519204
Energy: 0.8745274172411046
Energy: 0.873251385322323
Energy: 0.8746976290151112
Energy: 0.8977667750643155
Energy: 0.875630659921559
Energy: 0.8764059088164313
Energy: 0.8804481036751872
Energy: 0.8833450919435635
Energy: 0.8779727069304106
Energy: 0.9159578130615225
Energy: 0.9075130535911168
Energy: 0.8771107747155611
Energy: 0.8953417271764
Energy: 0.877713232992466
Energy: 0.8743558353146604
Energy: 0.897859157445319
Energy: 0.8801143054814256
Energy: 0.8765454580226277
Energy: 0.8739463648998306
Energy: 0.883091257187276
Energy: 0.8738585761752974
Energy: 0.9014708208516977
Energy: 0.8781158580632256
Energy: 0.8683511000004335
Energy: 0.8748411036903778
Energy: 0.8722670889813429
Energy: 0.8705530060292083
Energy: 0.8848038040328163
Energy: 0.8704570673904204
Energy: 0.8738797746011604
Energy: 0.8733120864239365
Energy: 0.8691673127531553
Energy: 0.8823409073913837
Energy: 0.8852449205777918
Energy: 0.8837905907957717
Energy: 0.8834662182690469
Energy: 0.8732284216701169
Energy: 0.884140917807981
Energy: 0.8837777025309648
Energy: 0.9064274347437766
Energy: 0.8654929140996415
Energy: 0.8686127181934108
Energy: 0.8842434788500195
Energy: 0.8646154921410567
Energy: 0.8528125046106859
Energy: 0.9057573759201102
Energy: 0.8686965543069463
Energy: 0.856288123934557
Energy: 0.8478436942823584
Energy: 0.8734891311402132
Energy: 0.8563051700783524
Energy: 0.9149566359317274
Energy: 0.8728997425048499
Energy: 0.8602514464285228
Energy: 0.8942617698943995
Energy: 0.87592812792698
Energy: 0.8738143697809571
Energy: 0.9395952561178458
Energy: 0.8844770776123495
Energy: 0.8831748175998287
Energy: 0.8654927337160963
Energy: 0.8937389904712286
Energy: 0.8737026742485202
Energy: 0.904997178590867
Energy: 0.8685233715869134
Energy: 0.8689828374700656
Energy: 0.8582854033961931
Energy: 0.8691228243182895
Energy: 0.8684887334386889
Energy: 0.9058169760387836
Energy: 0.8662959540804112
Energy: 0.8650525706462963
Energy: 0.8586779194150286
Energy: 0.8704379437890346
Energy: 0.8644589313467637
Energy: 0.8967320903687579
Energy: 0.874879399613758
Energy: 0.8812962073882392
Energy: 0.8694911965881355
Energy: 0.8854728715778898
Energy: 0.8802417333162504
Energy: 0.9218815503608901
Energy: 0.8590105447725335
Energy: 0.8641889407933607
Energy: 0.8753562533040706
Energy: 0.8637916450742704
Energy: 0.8642072445647189
Energy: 0.9159527059217689
Energy: 0.8678329310963989
Energy: 0.8684726579442743
Energy: 0.8848604791115616
Energy: 0.8699759856423933
Energy: 0.8716132656927359
Energy: 0.890911483220366
Energy: 0.8674410870858029
Energy: 0.8686325180501544
Energy: 0.8768991288753937
Energy: 0.8671891587730176
Energy: 0.8815875152545566
Energy: 0.8709816648597444
Energy: 0.8751428601769657
Energy: 0.8644120358436921
Energy: 0.8735600199003867
Energy: 0.8597850143699899
Energy: 0.865081995058723
Energy: 0.8685038958400558
Energy: 0.8474069084906992
Energy: 0.8560425963232952
Energy: 0.8696718896413549
Energy: 0.8474485790619226
Energy: 0.8561648824837552
Energy: 0.8946815857516143
Energy: 0.8833578969786265
Energy: 0.8790365805521085
Energy: 0.8921143449958813
Energy: 0.863882012044913
Energy: 0.8663472986766482
Energy: 0.915849444185031
Energy: 0.8634640829539685
Energy: 0.864181227054493
Energy: 0.8959416159341694
Energy: 0.8634539735242607
Energy: 0.8702110427613536
Energy: 0.9134576051994344
Energy: 0.851431483920292
Energy: 0.8473155789745704
Energy: 0.869105549535124
Energy: 0.85526745842011
Energy: 0.8682298188020208
Energy: 0.9010975611945431
Energy: 0.8687925476789168
Energy: 0.8681277801989742
Energy: 0.8725500508259
Energy: 0.8720508144641395
Energy: 0.8734753848138046
Energy: 0.9080970874014015
Energy: 0.8742489213801736
Energy: 0.8741306475834169
Energy: 0.8884546613893268
Energy: 0.8732346061283847
Energy: 0.881256869532301
Energy: 0.9068396653853469
Energy: 0.8775614139237421
Energy: 0.8770504396286054
Energy: 0.8657095404042962
Energy: 0.8724724546740941
Energy: 0.8740622864022217
Energy: 0.930323921004899
Energy: 0.9200427355535088
Energy: 0.9203119470698896
Energy: 0.8622054404946643
Energy: 0.9195693914932377
Energy: 0.8840466971241789

minimum gb energy = 0.8473155789745704 eV
minimum distance =  2.33105417832962 Angstroms
sigma value = 101


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

Energy: 1.3015386760993912
Energy: 0.8625331914293123
Energy: 0.851731968628488
Energy: 0.8162524495553044
Energy: 0.8424462772788682
Energy: 0.8149632661024834
Energy: 0.9308888252914025
Energy: 0.8413937691292835
Energy: 0.8504266027525564
Energy: 0.839099800196411
Energy: 0.8363531754289028
Energy: 0.8494267684049364
Energy: 0.8997440847052162
Energy: 0.8403434155779277
Energy: 0.8461207955509006
Energy: 0.8361289823747657
Energy: 0.8394858539062571
Energy: 0.8370354043388701
Energy: 0.8861096471822661
Energy: 0.8427817160841876
Energy: 0.8515382660975392
Energy: 0.8374331066556119
Energy: 0.8417608456507973
Energy: 0.8527823395067216
Energy: 0.8510921755775915
Energy: 0.8368729416334941
Energy: 0.8382097974012371
Energy: 0.8522678093175798
Energy: 0.8368984683473165
Energy: 0.852892456919095
Energy: 0.8564428522289126
Energy: 0.8492945549775142
Energy: 0.8495326190097854
Energy: 0.83976921124488
Energy: 0.8498887221674527
Energy: 0.849690612148068
Energy: 0.8842853857434435
Energy: 0.8376146918444352
Energy: 0.8445528976924535
Energy: 0.8637526445875031
Energy: 0.8334967474124445
Energy: 0.8348619756522077
Energy: 0.871194010111848
Energy: 0.8420947068668508
Energy: 0.8421627085656908
Energy: 0.8596427730607213
Energy: 0.8406948740046715
Energy: 0.8478715022725617
Energy: 0.8382530118248278
Energy: 0.8353544088359497
Energy: 0.845393742137894
Energy: 0.8364655014636326
Energy: 0.8335987326052082
Energy: 0.8414588365491467
Energy: 0.852784597379496
Energy: 0.843047484796534
Energy: 0.8592977790279164
Energy: 0.8360113688300657
Energy: 0.8605930051504204
Energy: 0.8434706868127292
Energy: 0.8905789385581936
Energy: 0.8437792235879557
Energy: 0.8115859581519524
Energy: 0.8376798376677398
Energy: 0.827621287412817
Energy: 0.8123260011334866
Energy: 0.8989703834415711
Energy: 0.8420313422478529
Energy: 0.8438096571996963
Energy: 0.8451694006988703
Energy: 0.8407451460595747
Energy: 0.8439846007492846
Energy: 0.8581073628521667
Energy: 0.8369130544697044
Energy: 0.8372140774183331
Energy: 0.8333307978051875
Energy: 0.8383414494133332
Energy: 0.8370180310610461
Energy: 0.8707468691006631
Energy: 0.8457894944767197
Energy: 0.8511874392409761
Energy: 0.833503225685098
Energy: 0.8377158752006645
Energy: 0.8483652468964755
Energy: 0.8951427075944496
Energy: 0.8396419820248386
Energy: 0.8425028210504671
Energy: 0.8413152689710826
Energy: 0.8371248549234681
Energy: 0.8448176161852858
Energy: 0.8957764523557745
Energy: 0.846057631693034
Energy: 0.8515001723727887
Energy: 0.8415151871152443
Energy: 0.8403230187267402
Energy: 0.8528296242800733
Energy: 0.8586030402643029
Energy: 0.898756613082752
Energy: 0.8547609704800276
Energy: 0.8157236422577491
Energy: 0.8982054939209028
Energy: 0.8399562003877206
Energy: 0.9332660632824822
Energy: 0.8365736251203079
Energy: 0.8357078630124621
Energy: 0.8525587253879479
Energy: 0.8369207522197986
Energy: 0.8510737483753614
Energy: 0.895480999426612
Energy: 0.8426250988483261
Energy: 0.8449170307327388
Energy: 0.8339578161232551
Energy: 0.8390956518902579
Energy: 0.8481182632821207
Energy: 0.8837868701284973
Energy: 0.8424071657304512
Energy: 0.8465599061523257
Energy: 0.8370149475147061
Energy: 0.8379030761413551
Energy: 0.8482490920824671
Energy: 0.8536555651734887
Energy: 0.8361844998957283
Energy: 0.8365955694139174
Energy: 0.8541629651405364
Energy: 0.8370402538801117
Energy: 0.8480722239235599
Energy: 0.8727366933819586
Energy: 0.8418558134816466
Energy: 0.8423678831179553
Energy: 0.8563077376236188
Energy: 0.8358927002767589
Energy: 0.8423758140612049
Energy: 0.8679702796566938
Energy: 0.8378993047809644
Energy: 0.8440576267067776
Energy: 0.857669822285906
Energy: 0.8350178093508326
Energy: 0.8547310945935944
Energy: 0.8801951380293195
Energy: 0.8393572981844988
Energy: 0.8429516111178045
Energy: 0.8575363730132162
Energy: 0.836436074778038
Energy: 0.8534815246234276
Energy: 0.8497732760006463
Energy: 0.8522190621898778
Energy: 0.8494447008699738
Energy: 0.8400448569946313
Energy: 0.8345903174196274
Energy: 0.8474364526533167
Energy: 0.8388625926055896
Energy: 0.8546677221665077
Energy: 0.8513430320253652
Energy: 0.8368696988732901
Energy: 0.8435948862536351
Energy: 0.8495834792948673
Energy: 0.8568389339109174
Energy: 0.8299630085900859
Energy: 0.8315694263548089
Energy: 0.8256808010764165
Energy: 0.8190228181402622
Energy: 0.8408427113941157
Energy: 0.8961261229428119
Energy: 0.8270650912709503
Energy: 0.8412353706407831
Energy: 0.8413685746617067
Energy: 0.8194089835734847
Energy: 0.8489177257812742
Energy: 0.8571417840343726
Energy: 0.83813317223913
Energy: 0.8524711423277885
Energy: 0.8330422144731225
Energy: 0.8421611880666193
Energy: 0.8454909707339328
Energy: 0.8590590026413915
Energy: 0.8316645373750438
Energy: 0.8457514527195248
Energy: 0.8337767250549513
Energy: 0.8265535085501828
Energy: 0.8507205376380581
Energy: 0.8964455879088473
Energy: 0.8459453342738493
Energy: 0.8470342609517446
Energy: 0.8401825783092651
Energy: 0.8356076275619749
Energy: 0.8481886221431971
Energy: 0.8952962943074363
Energy: 0.8414570925995853
Energy: 0.8421895223805269
Energy: 0.8340968424161421
Energy: 0.8400913664042389
Energy: 0.8500324213437215
Energy: 0.8593866229026164
Energy: 0.8378817166465512
Energy: 0.8475598821735372
Energy: 0.8161049809842063
Energy: 0.8382810640582368
Energy: 0.8469340982819229

minimum gb energy = 0.8115859581519524 eV
minimum distance =  2.32755725011338 Angstroms
sigma value = 33


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

Energy: 0.01544697398584141
Energy: 0.016171090844797214
Energy: 0.015978671932994317
Energy: 0.01719346035199208
Energy: 0.8392544844509702
Energy: 0.01597818833391876
Energy: 0.016512740350781777
Energy: 0.10532445636935789
Energy: 0.10380235845845168
Energy: 0.10623276268313361
Energy: 0.105625877117833
Energy: 0.1035923387559952
Energy: 1.1478399946638635
Energy: 0.8385196623815574
Energy: 0.8371297133922848
Energy: 0.8402441588770085
Energy: 0.8396689157709233
Energy: 0.8369070901474919
Energy: 0.4120378023601949
Energy: 0.10532445637063916
Energy: 0.10380235845803282
Energy: 0.10623276268313361
Energy: 0.10562587711738948
Energy: 0.10359233875685757

minimum gb energy = 0.01544697398584141 eV
minimum distance =  2.52169815297729 Angstroms
sigma value = 1