Model name: model_name=EAM_Dynamo_Ackland_1987_Au__MO_754413982908_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.078000083565712
cohesive_energy=3.78934329297956
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[7.82068878177786e-21, 1.174496409849942e-19, 1.9807068855488397e-19, 2.59502947232346e-19, 3.0889965503519997e-19, 3.500804010589019e-19, 3.85353921833046e-19, 4.1608206749653196e-19, 4.42644553911618e-19, 4.652112118015079e-19, 4.8492279092961e-19, 5.03077054369464e-19, 5.201290202851259e-19, 5.358431687113979e-19, 5.5003364715873595e-19, 5.62609131559002e-19, 5.73537578379516e-19, 5.828302028567159e-19, 5.90520650699916e-19, 5.96664998091306e-19, 6.013225255663439e-19, 6.04563728896926e-19, 6.0645589950168e-19, 6.0707273750577e-19, 6.063549623737379e-19, 6.038091037023119e-19, 5.987606451285779e-19, 5.904197135719739e-19, 5.77852240054878e-19, 5.59959131406366e-19, 5.354362158463619e-19, 5.02897610586456e-19, 4.622407763220719e-19, 4.1427801660664794e-19, 3.6004113319247993e-19, 2.9909112968185198e-19, 2.2933556339076e-19, 1.4811385980078359e-19, 5.206929864602939e-20, -6.351076242475019e-20, -2.0543108801148e-19, -3.8262861937861203e-19, -6.0624761653926e-19, -8.839801295132579e-19, -1.2232794840019739e-18, -1.64450614067028e-18, -2.18451977515998e-18, -2.88901286289612e-18, -3.77854133009292e-18, -4.95059762492928e-18, -6.5994456642776995e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01299248256763415
Energy: 0.01583172189678736
Energy: 0.07864331357591153
Energy: 0.07919717148047388
Energy: 0.015389956201800878
Energy: 0.013806711749666531
Energy: 0.07747010497136224
Energy: 0.07870639497772307
Energy: 0.07879863912849813
Energy: 0.01474980163006734
Energy: 0.013504270183008637
Energy: 0.07734700072593916
Energy: 0.07801096964560758
Energy: 0.5865465315283607
Energy: 0.07920476135841963
Energy: 0.07815256878386141
Energy: 0.07759850801884764
Energy: 0.07799048664253293
Energy: 0.5867283307312042
Energy: 0.07881845829693068
Energy: 0.07907618979762775
Energy: 0.015515564595404503
Energy: 0.013417725575297199
Energy: 0.07778808943943026
Energy: 0.5871471686565806
Energy: 0.0790574753050775
Energy: 0.01495988856766892
Energy: 0.013466266447092716
Energy: 0.07767991246776275
Energy: 0.07915631150177965
Energy: 0.07827285747145415
Energy: 0.014120406609721668
Energy: 0.01397531417028294
Energy: 0.07740381824553409
Energy: 0.07823349224593844
Energy: 0.07900009170121225
Energy: 0.01380851992782933
Energy: 0.01351730251667556
Energy: 0.07725456121065218
Energy: 0.07811890982867414
Energy: 0.07809781275798659
Energy: 0.07889880088494695
Energy: 0.07744491784906438
Energy: 0.01421500628082223
Energy: 0.014086145841337744
Energy: 0.5869299824277203
Energy: 0.07928182847599909
Energy: 0.07792049625004174
Energy: 0.015029676179170686
Energy: 0.07768659442296079
Energy: 0.07747473285045355
Energy: 0.5882669485752806
Energy: 0.0782791106627297
Energy: 0.013932663724593043
Energy: 0.01334475854629545
Energy: 0.07734743465711068
Energy: 0.5879364994871479
Energy: 0.07861929636755106
Energy: 0.014367494571227346
Energy: 0.01337159709054439
Energy: 0.013443238577974009
Energy: 0.07785203942225366
Energy: 0.5875526930665409
Energy: 0.07852214707190384
Energy: 0.07740466256069467
Energy: 0.01601095726212887
Energy: 0.07784911161722231
Energy: 0.5873999886166968
Energy: 0.07918522202064993
Energy: 0.07757450759859935

minimum gb energy = 0.01299248256763415 eV
minimum distance =  2.85017815832822 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 0.7889380753949672
Energy: 0.8021872477392986
Energy: 0.7340015014932548
Energy: 0.7278822059844083
Energy: 0.8949988105177211
Energy: 0.750258493632308
Energy: 0.8008154009923806
Energy: 0.7472681847232311
Energy: 0.7688744192648916
Energy: 0.7127441365876789
Energy: 0.7652649623849985
Energy: 0.7535708686524673
Energy: 0.6701565970052508
Energy: 0.6773693389685848
Energy: 0.6501297047857533
Energy: 0.7764186803183338
Energy: 0.7535489070461551
Energy: 0.6857441111814825
Energy: 0.7839495153454332
Energy: 0.7591277461141019
Energy: 0.7778703273832173
Energy: 0.8129839738858026
Energy: 0.6493970229667967
Energy: 0.6658959990387205
Energy: 0.6489931715408426
Energy: 0.7779451526267405
Energy: 0.7880566845692616
Energy: 0.7047165047826072
Energy: 0.7710388231226376
Energy: 0.7657801072273756
Energy: 0.8238964811379913
Energy: 0.7430862677512993
Energy: 0.6507964309441273
Energy: 0.666786958640083
Energy: 0.6645908013518476
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Energy: 0.7417423531418585
Energy: 0.686921685405769
Energy: 0.7706024481147685
Energy: 0.8821736806019415
Energy: 0.8211863423317223
Energy: 0.7998388042786041
Energy: 0.7633174718497515
Energy: 0.6551529072206382
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Energy: 0.7591052030120308
Energy: 0.8113556343521947
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Energy: 0.6939848067216448
Energy: 0.7875499456639032
Energy: 0.8261802751604326
Energy: 0.8202909137513007
Energy: 0.6981410204269071
Energy: 0.8031825254019782
Energy: 0.7891839707137486
Energy: 0.8269135530994266
Energy: 0.8383801826837295
Energy: 0.7006959771779401
Energy: 0.8273812433709293
Energy: 0.7736221606951099
Energy: 0.8094710760267121
Energy: 0.8291763648612395
Energy: 0.6553429534058641
Energy: 0.7728328077185419
Energy: 0.7724776840383021
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Energy: 0.844081023349958
Energy: 0.6947105020304618
Energy: 0.7782179489065729
Energy: 0.8228140705836074
Energy: 0.7743844114344124
Energy: 0.7773885959805851
Energy: 0.8461900408767513
Energy: 0.7743442152681875
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Energy: 0.7731327760565513
Energy: 0.8936091267003177
Energy: 0.8197206711526466
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Energy: 0.7788670882555825
Energy: 0.7121133191779355
Energy: 0.6543527350746757
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Energy: 0.7870809620970871
Energy: 0.7749550524411906
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Energy: 0.752142995743812
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Energy: 0.6993477383848183
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Energy: 0.805129375893461
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Energy: 0.6892297155235877
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Energy: 0.5982513539494401
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Energy: 0.7565787471284962
Energy: 0.795737002534953
Energy: 0.8255346831201429
Energy: 0.7189467876567851
Energy: 0.6992573583545323
Energy: 0.7567979944574524
Energy: 0.7891019298092631
Energy: 0.7367959468494535
Energy: 0.8543614505488342
Energy: 0.7954421654022493
Energy: 0.7980497109941962
Energy: 0.7410065733665772
Energy: 0.7801382329686312
Energy: 0.8973766629316814
Energy: 0.7668052285032434
Energy: 0.8424965438886992
Energy: 0.7409965181936425
Energy: 0.7373989468008385
Energy: 0.5981386756101361
Energy: 0.8021388116451358
Energy: 0.7907550384231701
Energy: 0.771875627213837
Energy: 0.5985583813466658
Energy: 0.6579169569653945
Energy: 0.8110606216578349
Energy: 0.7416946368786131
Energy: 0.7693089183586117
Energy: 0.5982017302797646
Energy: 0.5995939766770251
Energy: 0.8058491734411625
Energy: 0.789953663904706
Energy: 0.6299504877912268
Energy: 0.6914945658311545
Energy: 0.7123591690689273
Energy: 0.7828587473661324
Energy: 0.7962963481494242
Energy: 0.6898686254319729
Energy: 0.5988404271315709
Energy: 0.6300858759529642
Energy: 0.7043951457978667
Energy: 0.834775137891884
Energy: 0.6720333854621925
Energy: 0.6749987872782661
Energy: 0.7313149165716772
Energy: 0.6818949503857489
Energy: 0.83030447840684
Energy: 0.6304394405273193
Energy: 0.6745414583460022
Energy: 0.7817666685594836
Energy: 0.7888036678053941
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Energy: 0.764726727339011
Energy: 0.7145750522268749
Energy: 0.807468236658066
Energy: 0.8181002312614041
Energy: 0.7968618870536048
Energy: 0.6907532668385912
Energy: 0.5993563221767007
Energy: 0.7871115491896442
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Energy: 0.8065496911284208
Energy: 0.6976757099474673
Energy: 0.8147317991719347
Energy: 0.7887476072866706
Energy: 0.8279521808782179
Energy: 0.8225593484386752
Energy: 0.8024571542746253
Energy: 0.8245625203049654
Energy: 0.8311878676984285
Energy: 0.7613130647820153
Energy: 0.8204252256326934
Energy: 0.7031357184035347
Energy: 0.8190990393430977
Energy: 0.9063682367475578
Energy: 0.823939637362927
Energy: 0.8407145135776827
Energy: 0.6962076086211165
Energy: 0.8206141643204473
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Energy: 0.7767649847761063
Energy: 0.823512691410934
Energy: 0.8195099738252779
Energy: 0.7697326158282263
Energy: 0.8224979993041333
Energy: 0.7701776107902778
Energy: 0.8176110282878157
Energy: 0.8603384820130446
Energy: 0.7725825553800021
Energy: 0.7742957404869205
Energy: 0.7102455150724439
Energy: 0.6450768673793036
Energy: 0.7135754167955166
Energy: 0.8203186390084625
Energy: 0.7752899354706532
Energy: 0.7085970677156904
Energy: 0.6612290119130826
Energy: 0.8161776889039825
Energy: 0.7701903743067215
Energy: 0.7605851645334827
Energy: 0.7068319768603104
Energy: 0.6991713001971211
Energy: 0.7441081143034975
Energy: 0.7460660968191062
Energy: 0.7329834375128167
Energy: 0.739049558387755
Energy: 0.6991676944647948
Energy: 0.7526021881630791
Energy: 0.7682252355277983
Energy: 0.8209068465660238
Energy: 0.6909935394543015
Energy: 0.7292667579156791
Energy: 0.7297368799618049
Energy: 0.6949405184127351
Energy: 0.7467857693160261
Energy: 0.691121755498981
Energy: 0.6921988237795788
Energy: 0.7173645935621951
Energy: 0.7111118129991875
Energy: 0.8637102551063682
Energy: 0.6896296804270793
Energy: 0.6946170679010025
Energy: 0.7407594027374912
Energy: 0.7446107584608647
Energy: 0.7794288237804801
Energy: 0.663918935691971
Energy: 0.7377054850348815
Energy: 0.7776217763770293
Energy: 0.7680838065692055
Energy: 0.8573687537998174
Energy: 0.7980478849659449
Energy: 0.7487996602527058
Energy: 0.828847243693596
Energy: 0.7878439256762568
Energy: 0.7647334928243937
Energy: 0.7198667204640284
Energy: 0.7244534307613418
Energy: 0.8293355916736477
Energy: 0.7845333295349135
Energy: 0.7537733014895047
Energy: 0.7791553113057661
Energy: 0.7484262725069036
Energy: 0.888485883192426
Energy: 0.7659511494432019
Energy: 0.648622638516707
Energy: 0.6744461801803151
Energy: 0.7503187709930778
Energy: 0.8816241747103573
Energy: 0.844590521148603
Energy: 0.860624104210035
Energy: 0.754423267053467
Energy: 0.800346274354564
Energy: 0.7496714194066727
Energy: 0.7270359337628683
Energy: 0.8174268256594772
Energy: 0.7524621015923095
Energy: 0.7976601208008783
Energy: 0.747570212899666
Energy: 0.7916848164954303

minimum gb energy = 0.5981386756101361 eV
minimum distance =  2.62140816123966 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.2689331514693707
Energy: 0.8523537249399512
Energy: 0.7580724530415388
Energy: 0.8774031420956491
Energy: 0.8272222563429039
Energy: 0.8265190133792518
Energy: 0.8725992243687116
Energy: 0.7626178500585528
Energy: 0.8834314248644705
Energy: 0.8479448090516013
Energy: 0.7401205062392979
Energy: 0.7855633277286556
Energy: 0.7672022948668764
Energy: 0.7721241352544396
Energy: 0.7253304823685213
Energy: 0.7814507075122523
Energy: 0.8365576464408377
Energy: 0.7503675198287278
Energy: 0.7767174867789437
Energy: 0.7229659385835228
Energy: 0.8045878666599965
Energy: 0.8645078158362376
Energy: 0.8681418424128077
Energy: 0.7212900954429493
Energy: 0.7526876076724308
Energy: 0.7460787175355792
Energy: 0.9438965488975382
Energy: 0.8681121703159327
Energy: 0.7426337723053928
Energy: 0.75280373421706
Energy: 0.7676053971726695
Energy: 0.742160302550904
Energy: 0.760503018487809
Energy: 0.7470411910642281
Energy: 0.7625837514399477
Energy: 0.7229736003690433
Energy: 0.734416459120935
Energy: 0.6887025266696097
Energy: 0.7824110439805984
Energy: 0.7574930582550483
Energy: 0.7616652768219906
Energy: 0.6922053225128102
Energy: 0.8545721048404625
Energy: 0.9051741227989161
Energy: 0.7136482040580514
Energy: 0.7291296241168659
Energy: 0.6799183375042492
Energy: 0.8666661027564473
Energy: 0.7838313597732771
Energy: 0.7831602689467265
Energy: 0.8685086895950841
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Energy: 0.883597752478685
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Energy: 0.885025476249881
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Energy: 0.891227617910567
Energy: 0.8023455612544932
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Energy: 0.6959793790293101
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Energy: 0.7943203065994812
Energy: 0.7226077872763803
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Energy: 0.7359794253041938
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Energy: 0.7172368878192755
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Energy: 0.7590480870716341
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Energy: 0.6892848578256566
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Energy: 0.6726767031018469
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Energy: 0.9081836068504615
Energy: 0.8714580240452404
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Energy: 0.754960476217723
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Energy: 0.9074423312976679
Energy: 0.8058160506144191
Energy: 0.711237944932006
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Energy: 0.8061289804470692
Energy: 0.7298751748358441
Energy: 0.8421164462321842
Energy: 0.6545377879659438
Energy: 0.7969655288688363
Energy: 0.7878907963454019
Energy: 0.7158706692262152
Energy: 0.8472798122469812
Energy: 0.7459225051227703
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Energy: 0.670460561466014
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Energy: 0.6903066933229516
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Energy: 0.7534612083043657
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Energy: 0.753302201678932
Energy: 0.753449096181276
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minimum gb energy = 0.6440524453777128 eV
minimum distance =  2.54224635845228 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.8579445814960699
Energy: 0.817283483311643
Energy: 0.7384579408049067
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Energy: 0.7924591197192912
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Energy: 0.8362733357462827
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Energy: 0.8363585636432533
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Energy: 0.8423435736470649
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Energy: 0.7091466204423567
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Energy: 0.89417642020719
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Energy: 0.8519040535496625
Energy: 0.7739848768231617
Energy: 0.7744367360589711
Energy: 0.8266859238322953
Energy: 0.8319429829421644
Energy: 0.788025217229525
Energy: 0.7742379136775693
Energy: 0.8763799968476658
Energy: 0.7730842267187565
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Energy: 0.7844150052203601
Energy: 0.7913003987863388
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Energy: 0.7210462838554684
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Energy: 0.7690292836746381
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Energy: 0.7438878787129067
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Energy: 0.7905965493280659
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Energy: 0.7400835419766434
Energy: 0.7413029052460705
Energy: 0.737042504966083
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Energy: 0.7189522929593575
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Energy: 0.7437740221710468
Energy: 0.7570660768751067
Energy: 0.8728348779527081
Energy: 0.8208413019917904
Energy: 0.7459936459964066
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Energy: 0.8713650115488729
Energy: 0.8095573512486381
Energy: 0.7453981955730158
Energy: 0.8145368395577023
Energy: 0.7982326023998051
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Energy: 0.8464711920740736
Energy: 0.8407894362110895
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Energy: 0.7589729570056537
Energy: 0.8687976745562848
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Energy: 0.8041360819911878
Energy: 0.7970104610001686
Energy: 0.7385548918089175
Energy: 0.8392015414331636
Energy: 0.8019373143282168
Energy: 0.7944583703467918
Energy: 0.7872224553496813
Energy: 0.8380826682240454
Energy: 0.8684814040693629
Energy: 0.8023974727662627
Energy: 0.8017591450423996
Energy: 0.7855770737558453
Energy: 0.8381732463195127
Energy: 0.8665594408436627
Energy: 0.8023141505995709
Energy: 0.7986567394991161
Energy: 0.7987861737495621
Energy: 0.7998695675901047
Energy: 0.8076028722745576
Energy: 0.8032375886064151
Energy: 0.8195999081151736
Energy: 0.7982135919922417
Energy: 0.824627946228557
Energy: 0.8030134390417055
Energy: 0.8044119156001883
Energy: 0.7721229522451286
Energy: 0.8027985673467011
Energy: 0.8188829980426561
Energy: 0.8034067572865182
Energy: 0.7556831711884965
Energy: 0.7555104237770008
Energy: 0.8294996369066734
Energy: 0.82789393937823
Energy: 0.7814539869570598
Energy: 0.7822326849014838
Energy: 0.8022123281603866
Energy: 0.8019563323913187
Energy: 0.7377569585733129
Energy: 0.81534557642351
Energy: 0.7317989580266427
Energy: 0.8020986547960416
Energy: 0.8017635152003931
Energy: 0.8266249246064157
Energy: 0.7968852603711418
Energy: 0.7467594237622077
Energy: 0.8252301939837526
Energy: 0.8238215701234327
Energy: 0.7649381583206811
Energy: 0.7970068101114254
Energy: 0.7477804625426694
Energy: 0.8269198628820595
Energy: 0.827080407263141
Energy: 0.7814678055188452
Energy: 0.8377222500302619
Energy: 0.8421330178197569
Energy: 0.8484314723986164
Energy: 0.8425903829430038
Energy: 0.8327796165678087
Energy: 0.8578709978322968
Energy: 0.8476515847570467
Energy: 0.8692677493551453
Energy: 0.8435883097061186
Energy: 0.841589629924645
Energy: 0.800928449834665
Energy: 0.8044925705717029
Energy: 0.7419693862686034
Energy: 0.763929322847446
Energy: 0.8303593805306039
Energy: 0.7188504201941441
Energy: 0.7849875599720243
Energy: 0.7454713339244824
Energy: 0.7636327863878625
Energy: 0.831300501884112
Energy: 0.7666271480678155
Energy: 0.7444182778276386
Energy: 0.7432458315735386
Energy: 0.7382621689585028
Energy: 0.7424585623543204
Energy: 0.7379565224445787
Energy: 0.7381720691015566
Energy: 0.7585235763031369
Energy: 0.7409534082555099
Energy: 0.8267017110868543

minimum gb energy = 0.7091466204423567 eV
minimum distance =  2.60361128182632 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.9923706146114544
Energy: 0.7367753668429777
Energy: 0.7402354429289306
Energy: 0.8010394612495982
Energy: 0.8146431517752131
Energy: 0.8232013700811419
Energy: 0.7606857745475389
Energy: 0.74401520684216
Energy: 0.8092485238275651
Energy: 0.8051461672708656
Energy: 0.7951864302979178
Energy: 0.8644896337864091
Energy: 0.7411190264419917
Energy: 0.8073686655820379
Energy: 0.8300170111639297
Energy: 0.7243490827178879
Energy: 0.7209815784200619
Energy: 0.8059466278475117
Energy: 0.8218807454111119
Energy: 0.8491688506366916
Energy: 0.783007573810338
Energy: 0.8214943198917132
Energy: 0.7898149652491279
Energy: 0.827006471263998
Energy: 0.8451387525441969
Energy: 0.7321043384223631
Energy: 0.8158217723377796
Energy: 0.7942519441242578
Energy: 0.8081988979629371
Energy: 0.8281260260591453
Energy: 0.8717352677027365
Energy: 0.7981144041258004
Energy: 0.7788586329519874
Energy: 0.7599444535359555
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Energy: 0.843245706998698
Energy: 0.8207501331240723
Energy: 0.7214010966397156
Energy: 0.7766043417180589
Energy: 0.8063908465604575
Energy: 0.8379545388106109
Energy: 0.7347940571705142
Energy: 0.7832566811424505
Energy: 0.7752795830568855
Energy: 0.7215048676925777
Energy: 0.827072297689595
Energy: 0.7820699345097356
Energy: 0.7791891936097749
Energy: 0.7332031782137935
Energy: 0.7847509774510067
Energy: 0.8446462497912953
Energy: 0.7682005322978148
Energy: 0.8041723441758849
Energy: 0.7238923125047545
Energy: 0.7883087492945553
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Energy: 0.7330148269123977
Energy: 0.7236392607200849
Energy: 0.7277546509534983
Energy: 0.8549482819716901
Energy: 0.8466690725935774
Energy: 0.8367553028741305
Energy: 0.7793917253335819
Energy: 0.7318614350537129
Energy: 0.7878861661438479
Energy: 0.8338247744679063
Energy: 0.8403814640122544
Energy: 0.7781255408276591
Energy: 0.7392456697864036
Energy: 0.8133547597522182
Energy: 0.8353809502661091
Energy: 0.8228551830175982
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Energy: 0.7516549852611721
Energy: 0.6939633429542935
Energy: 0.8349636501545608
Energy: 0.8763285222795762
Energy: 0.8261225323290143
Energy: 0.6957702985823354
Energy: 0.6935588300618319
Energy: 0.8425173997823432
Energy: 0.7632137740211425
Energy: 0.8231709297402603
Energy: 0.8338773794071349
Energy: 0.69461234676461
Energy: 0.798563415326682
Energy: 0.7624664863016439
Energy: 0.8241812264134372
Energy: 0.8180189140096574
Energy: 0.862991274475308
Energy: 0.7359720805921575
Energy: 0.8338793088432523
Energy: 0.8412042119791016
Energy: 0.8241946713008332
Energy: 0.84405679209991
Energy: 0.7322996410343611
Energy: 0.8318557320060712
Energy: 0.8391352495716111
Energy: 0.8443997225342086
Energy: 0.842763568858057
Energy: 0.8404233417324707
Energy: 0.7374119490887525
Energy: 0.8659700119683228
Energy: 0.7988863685624499
Energy: 0.8414996714727689
Energy: 0.8167529861640367
Energy: 0.7345576017793559
Energy: 0.8565676641407586
Energy: 0.7985085276875368
Energy: 0.8359433406996496
Energy: 0.8623222593713662
Energy: 0.7810522396138604
Energy: 0.779871196934798
Energy: 0.728714997244093
Energy: 0.8273520833122473
Energy: 0.7832689044175303
Energy: 0.7869217048593989
Energy: 0.7878618958240854
Energy: 0.7403484015528864
Energy: 0.8275049124046728
Energy: 0.7918375590472297
Energy: 0.7216125219141659
Energy: 0.720113267998192
Energy: 0.7631974070691052
Energy: 0.8492880328639555
Energy: 0.7978678599702733
Energy: 0.7870035572451919
Energy: 0.7757132776513993
Energy: 0.7631432407014606
Energy: 0.7812721581221898
Energy: 0.7932276853626701
Energy: 0.7441439984521379
Energy: 0.7216778715265653
Energy: 0.7218297469070534
Energy: 0.8020425672657601
Energy: 0.7949352390782585
Energy: 0.7729789065434308
Energy: 0.7216208165223429
Energy: 0.7329382243500613
Energy: 0.7241073353459164
Energy: 0.8361441954519034
Energy: 0.8188970107279704
Energy: 0.7386164730453753
Energy: 0.7661591041756464
Energy: 0.7598723159685846
Energy: 0.821351534613053
Energy: 0.8077077728841877
Energy: 0.7386778689447946
Energy: 0.788462810288637

minimum gb energy = 0.6935588300618319 eV
minimum distance =  2.62223862406184 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.7609126607756542
Energy: 0.6836031928863925
Energy: 0.6584474171967738
Energy: 0.6355693512976818
Energy: 0.6792140998314494
Energy: 0.7060056110746238
Energy: 0.6921240300065983
Energy: 0.662102597135716
Energy: 0.6695507485078257
Energy: 0.7141789481194503
Energy: 0.7097365012702621
Energy: 0.69775425799079
Energy: 0.6348280241363902
Energy: 0.658844190582451
Energy: 0.7014166202644181
Energy: 0.699378168821933
Energy: 0.6884554041869975
Energy: 0.6682438672247832
Energy: 0.6689700999743712
Energy: 0.7472781033154211
Energy: 0.6693799379933122
Energy: 0.7304818546671542
Energy: 0.684594541533558
Energy: 0.6801353747615508
Energy: 0.7029295823583779
Energy: 0.69241689130921
Energy: 0.7379229997282587
Energy: 0.7342740483927832
Energy: 0.7156901271037868
Energy: 0.714106834160932
Energy: 0.7201791136208331
Energy: 0.691945805972115
Energy: 0.6968525541427687
Energy: 0.6921834643651401
Energy: 0.8517721920027143
Energy: 0.7266982049635732
Energy: 0.6736683030603694
Energy: 0.6633639462100523
Energy: 0.6673989449813449
Energy: 0.763891239395942
Energy: 0.7304701042141156
Energy: 0.7525988143503332
Energy: 0.713934758721333
Energy: 0.7068341880193761
Energy: 0.7008811113398283
Energy: 0.6997344934756644
Energy: 0.7416637326964604
Energy: 0.6692722337945699
Energy: 0.7128525325691373
Energy: 0.7489260897205045
Energy: 0.7419652719090511
Energy: 0.6806309144740982
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Energy: 0.7253853434544155
Energy: 0.6812206401020949
Energy: 0.7119357263135729
Energy: 0.7054248739664324
Energy: 0.7204089459942519
Energy: 0.7441088895630897
Energy: 0.7130029072447358
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Energy: 0.7062604246778644
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Energy: 0.6966593653804635
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Energy: 0.7175668174211424
Energy: 0.7117288707765956
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Energy: 0.7403210801544782
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Energy: 0.6996800158090575
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Energy: 0.7498658343437681
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Energy: 0.6533501370554949
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Energy: 0.7059998457462916
Energy: 0.6796550984196369
Energy: 0.6543400608064066
Energy: 0.6728960039479294
Energy: 0.7246158709551987
Energy: 0.6799211230206381
Energy: 0.6559668712993938
Energy: 0.6895716533580895
Energy: 0.6648789394050272
Energy: 0.7246567788092336
Energy: 0.6588245498498652
Energy: 0.7375067772054176
Energy: 0.649333028878179
Energy: 0.7043682911438763
Energy: 0.6794362297611874
Energy: 0.6412261778382384
Energy: 0.6539741915425232
Energy: 0.6572755092567664
Energy: 0.7160124508036488
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Energy: 0.6664482782266479
Energy: 0.6667530145884261
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Energy: 0.7138897801240772
Energy: 0.6982599820717099
Energy: 0.6938909899175207
Energy: 0.6442511426343691
Energy: 0.7018437533031779
Energy: 0.7284674741749194
Energy: 0.7343371536045723
Energy: 0.6618012113234447
Energy: 0.6672564247169666
Energy: 0.6798437864198881
Energy: 0.8196109281572058
Energy: 0.7031937810415722
Energy: 0.6681474010102698
Energy: 0.672744616160362
Energy: 0.6988675272679292
Energy: 0.7215273966034673
Energy: 0.7045018986117471
Energy: 0.7455860819348638
Energy: 0.720959363979325
Energy: 0.7019889011968157
Energy: 0.7026995677917091
Energy: 0.7243000221010796
Energy: 0.6995529289798565
Energy: 0.7230545284139167
Energy: 0.7017600372913786
Energy: 0.7019160369494054
Energy: 0.712472839784672
Energy: 0.7064847360753788
Energy: 0.711573326872626
Energy: 0.6814822807862454
Energy: 0.7107989023358409
Energy: 0.7166623977676962
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Energy: 0.6918948307592724
Energy: 0.6768449989448504
Energy: 0.7021418364361149
Energy: 0.7116679726007002
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Energy: 0.7545246011491138
Energy: 0.6994451824422396
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Energy: 0.7076563205459973
Energy: 0.7184535854374299
Energy: 0.7293197407331315
Energy: 0.7234041157679842
Energy: 0.7855775348845458
Energy: 0.7149393530163234
Energy: 0.7180786119211262
Energy: 0.7261855672848527
Energy: 0.7400824748454184
Energy: 0.7660245855070832
Energy: 0.7257183209123069
Energy: 0.6868092817683713
Energy: 0.7259964203113694
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Energy: 0.7644386720784698
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Energy: 0.6564291231862928
Energy: 0.7025174997336919
Energy: 0.7195964412513461
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Energy: 0.7237434054140148
Energy: 0.7280739749818915
Energy: 0.7210156167501456
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Energy: 0.7546553740866346
Energy: 0.717284528692516
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Energy: 0.6781884721594984
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Energy: 0.7176654287428349
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Energy: 0.6323014854888995
Energy: 0.7241590847154568
Energy: 0.7170993610755559
Energy: 0.6930990877618618
Energy: 0.7280248041128381
Energy: 0.7177007760411557
Energy: 0.7190656486771662
Energy: 0.7318509735203751
Energy: 0.6950543805789846
Energy: 0.7908999024561352
Energy: 0.6920688564866311
Energy: 0.7170755194202958
Energy: 0.7058599752402235
Energy: 0.683914785479965
Energy: 0.767462530874493
Energy: 0.7160430125456588
Energy: 0.7028283606273137
Energy: 0.6317023785168763
Energy: 0.6306104828710883
Energy: 0.6628308577651781
Energy: 0.653719183812291
Energy: 0.69829448292935
Energy: 0.6853827334186675
Energy: 0.6663649213110479
Energy: 0.6626486412385945
Energy: 0.7047809520646325
Energy: 0.6968393895253827
Energy: 0.6365187832865323
Energy: 0.6476309588957897
Energy: 0.6898608371404584
Energy: 0.7036395472489393
Energy: 0.7315067533901332
Energy: 0.6973753640424234
Energy: 0.6732303431392902
Energy: 0.6818909945035767
Energy: 0.7181940740596265
Energy: 0.7272253175299712
Energy: 0.6870252327310682
Energy: 0.6936092831449978
Energy: 0.6480165023134792
Energy: 0.6970188958889352
Energy: 0.6854377837191797
Energy: 0.6368625014216988
Energy: 0.6561028722086177
Energy: 0.7045720703154388
Energy: 0.7180137931958405
Energy: 0.6690137715051167
Energy: 0.6686681972314027
Energy: 0.6683346103732036
Energy: 0.6924674583117809
Energy: 0.7027392621900682
Energy: 0.6357925621219311
Energy: 0.7208637991260978
Energy: 0.6613942875938325
Energy: 0.7031857957421498

minimum gb energy = 0.6306104828710883 eV
minimum distance =  2.60694201382495 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.45693004081913424
Energy: 0.6197923821873792
Energy: 0.5847001715327479
Energy: 0.3388329624703976
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Energy: 0.5135296170375196
Energy: 0.5052397954701879
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Energy: 0.3145437650287602
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Energy: 0.6260029383851897
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Energy: 0.6464530760962482
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Energy: 0.6775072661612234
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Energy: 0.3644267012239017
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Energy: 0.6265166866880506
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Energy: 0.3635382380339593
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Energy: 0.6212421037050522
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Energy: 0.6634187004998712
Energy: 0.638646233550921
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Energy: 0.6228760588896545
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Energy: 0.6555681954890937
Energy: 0.6544598496339941
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Energy: 0.6068194916673202
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Energy: 1.0885356697815927
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Energy: 0.6421830057528425
Energy: 0.5801372027235134
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Energy: 0.6168535258787516
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Energy: 0.632015432972162
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Energy: 0.633370396737174
Energy: 0.6212335401211472
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Energy: 0.640438600062075
Energy: 0.6224112068844165
Energy: 0.34266178013185106
Energy: 0.3370583088445508
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Energy: 0.5228311724334982
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Energy: 0.4867568813295688
Energy: 0.28599671323048775
Energy: 0.28580135581652233
Energy: 0.5480865900208972
Energy: 0.6446165736209992
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Energy: 0.31179623548745566
Energy: 0.3119664604059874
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Energy: 0.6516173457957171
Energy: 0.5883874577854277
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Energy: 0.5206667972287493
Energy: 0.6577818340705726
Energy: 0.6019591513206004
Energy: 0.5006022007530201
Energy: 0.5093730851966792
Energy: 0.5074907510176733
Energy: 0.5659210549367822
Energy: 0.5495321491540628
Energy: 0.33717176376553276
Energy: 0.5355608129960445
Energy: 0.670255445329255
Energy: 0.6473679609781873
Energy: 0.5556024576366847
Energy: 0.35991791065715273
Energy: 0.573762790713898
Energy: 0.61376468257243
Energy: 0.6412608128526779
Energy: 0.3132995318241925
Energy: 0.31307388374274064
Energy: 0.4642074812563186
Energy: 0.6309725162579333
Energy: 0.5325845122217012
Energy: 0.36521302527329935
Energy: 0.36360419156223495
Energy: 0.5575425299667226
Energy: 0.6302537293518059
Energy: 0.5837926450808826
Energy: 0.5260704269293845
Energy: 0.48228049199013406
Energy: 0.5481341385475477
Energy: 0.6560274311184932
Energy: 0.5949953092533639
Energy: 0.530784245793092
Energy: 0.5182628038259147
Energy: 0.5536334812014246
Energy: 0.6304887341055431
Energy: 0.615901254532054
Energy: 0.4754846353899495
Energy: 0.4695307787808738
Energy: 0.6078540745991188
Energy: 0.5574220653064613
Energy: 0.5284242917206409
Energy: 0.33912665670336584
Energy: 0.5265173021035207
Energy: 0.6223472077673886
Energy: 0.6699070867394524
Energy: 0.46515391345943496

minimum gb energy = 0.28580135581652233 eV
minimum distance =  2.77854864355962 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.6323718558228395
Energy: 0.6158362318607246
Energy: 0.6416667823957858
Energy: 0.6200140874129512
Energy: 0.5861690394391749
Energy: 0.5830324190443154
Energy: 0.5861900114740649
Energy: 0.6353456481275442
Energy: 0.6595131285108664
Energy: 0.616240225418804
Energy: 0.5958481941787309
Energy: 0.5986581731770891
Energy: 0.6177829559906297
Energy: 0.5997742589940186
Energy: 0.6376556874623944
Energy: 0.5884528496408185
Energy: 0.6300584917650429
Energy: 0.6222966222631062
Energy: 0.6101765352503419
Energy: 0.634478381990105
Energy: 0.6132584255207714
Energy: 0.6145609706686523
Energy: 0.6128736455060029
Energy: 0.5900986171684912
Energy: 0.5915656412435542
Energy: 0.5867955764085655
Energy: 0.6244563573817339
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Energy: 0.6354292458657653
Energy: 0.5915669780302234
Energy: 0.5933023218219612
Energy: 0.6291373437008398
Energy: 0.6244061163170332
Energy: 0.6036036503258128
Energy: 0.6257769134275196
Energy: 0.5931015205183536
Energy: 0.6291173062208303
Energy: 0.6560530380245168
Energy: 0.6306522722668036
Energy: 0.5962161649645574
Energy: 0.6172811806595525
Energy: 0.6056150655273983
Energy: 0.6101940314493796
Energy: 0.6104779731588758
Energy: 0.5830285076037605
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Energy: 0.6186890207393677
Energy: 0.6094639889262977
Energy: 0.6103986765179967
Energy: 0.6090450124736251
Energy: 0.633425688957965
Energy: 0.6053222010709262
Energy: 0.6070970289734109
Energy: 0.608849772497045
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Energy: 0.6462369604659665
Energy: 0.6186749947117246
Energy: 0.6217677877948333
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Energy: 0.6113622846334089
Energy: 0.6119893543758839
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Energy: 0.6095511517771733
Energy: 0.632985466023364
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Energy: 0.6101598062702307
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Energy: 0.6103090663533349
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Energy: 0.6096086856874449
Energy: 0.6103126838548035
Energy: 0.6429992767654211
Energy: 0.6216559886805357
Energy: 0.6267288428573983
Energy: 0.6244799778014765
Energy: 0.6107145617044735
Energy: 0.6349582981875627
Energy: 0.6208599314546536
Energy: 0.6240792517567115
Energy: 0.6113784828427303
Energy: 0.6383903961051507
Energy: 0.5873689298355317
Energy: 0.5917844187357106
Energy: 0.607286539771606
Energy: 0.6449552197863201
Energy: 0.6251725935555298
Energy: 0.61056252541251
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Energy: 0.651254054052342
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Energy: 0.6149912637567133
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Energy: 0.625410547772553
Energy: 0.6286376137162056
Energy: 0.6320747748104347
Energy: 0.6395761664713143
Energy: 0.6198460209152856
Energy: 0.6254541971474817
Energy: 0.6203602588637724
Energy: 0.5863802119557769
Energy: 0.6446707291228236
Energy: 0.607512109928685
Energy: 0.6176883069547472
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Energy: 0.5922629431769213
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Energy: 0.6108905581696048
Energy: 0.6175807000152779
Energy: 0.6029433665946132
Energy: 0.6013973495849201
Energy: 0.5970257545223508
Energy: 0.5999042459150646
Energy: 0.6102814197026311
Energy: 0.6088985378949878
Energy: 0.6046934662770035
Energy: 0.6483604456832841
Energy: 0.586248738964497
Energy: 0.5874418252963596
Energy: 0.5830579726642383
Energy: 0.6255447669044322
Energy: 0.604371787601415
Energy: 0.5983719310280384
Energy: 0.6264023439962597
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Energy: 0.580979653243015
Energy: 0.585975340910678
Energy: 0.6202125589324653
Energy: 0.6255489401797744
Energy: 0.5917005162737045

minimum gb energy = 0.5801020603215289 eV
minimum distance =  2.66144346112346 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.077565946786891
Energy: 0.8100433339389058
Energy: 0.7832520575587384
Energy: 0.7773537855494235
Energy: 0.8040173863324264
Energy: 0.7957854483593442
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Energy: 0.7685987441314478
Energy: 0.8142355882866141
Energy: 0.8139188861048975
Energy: 0.7663977166195712
Energy: 0.7667526785228979
Energy: 0.8274938422905675
Energy: 0.7819118287080438
Energy: 0.7838015766396266
Energy: 0.7683226977104777
Energy: 0.7671384760368416
Energy: 0.7662718475395899
Energy: 0.7750712529970715
Energy: 0.8218073062867979
Energy: 0.8198029692404756
Energy: 0.8012708751453581
Energy: 0.7790923353148416
Energy: 0.8097733701468877
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Energy: 0.7790474461069186
Energy: 0.7794294044614883
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Energy: 0.7827634893596671
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Energy: 0.8207278595243013
Energy: 0.8301576002262817
Energy: 0.7809580718190702
Energy: 0.7711467089598288
Energy: 0.78372512847043
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Energy: 0.8300180328054526
Energy: 0.8080046909047298
Energy: 0.7788162803708394
Energy: 0.8323007778642063
Energy: 0.8051275353058346
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Energy: 0.7793618717225235
Energy: 0.8323855259144923
Energy: 0.8161970717846823
Energy: 0.8138532709975648
Energy: 0.8465912182657728
Energy: 0.8137693862990939
Energy: 0.8167397764955705
Energy: 0.7875275000424586
Energy: 0.8451193073213036
Energy: 0.8388117034967029
Energy: 0.8151000680626532
Energy: 0.8175646206167242
Energy: 0.7944041057766458
Energy: 0.842609596112786
Energy: 0.8179225722146957
Energy: 0.7756698073460558
Energy: 0.8308010998185037
Energy: 0.7820828990152576
Energy: 0.808520540953512
Energy: 0.8174976505992974
Energy: 0.7984942279570056
Energy: 0.829588882827153
Energy: 0.7813235353503544
Energy: 0.8093350720944035
Energy: 0.8042419909855552
Energy: 0.8296330195612246
Energy: 0.7690593215720368
Energy: 0.7985671054827883
Energy: 0.780100183571023
Energy: 0.8045022747525047
Energy: 0.8311576307414714
Energy: 0.8002238601082718
Energy: 0.8004132994664598
Energy: 0.7806487475607097

minimum gb energy = 0.7662718475395899 eV
minimum distance =  2.67962769473097 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.2515845583185368
Energy: 0.8637705400959539
Energy: 0.8630055110608545
Energy: 0.8442037866489036
Energy: 0.8808435440065608
Energy: 0.8315101858267665
Energy: 0.8610100521242886
Energy: 0.8598492074768513
Energy: 0.8415802025833019
Energy: 0.8962229988351943
Energy: 0.9082809948367102
Energy: 0.840724674489518
Energy: 0.8567448406910958
Energy: 0.8592660454675546
Energy: 0.8415580864015021
Energy: 0.8848098301935013
Energy: 0.8400509563167177
Energy: 0.8649176145917429
Energy: 0.8577303026372525
Energy: 0.8412810916816996
Energy: 0.9395113458714401
Energy: 0.8476554285552772
Energy: 0.8437653738138301
Energy: 0.9469540142378059
Energy: 0.8628692077718977
Energy: 0.9398552030954153
Energy: 0.8483522476088982
Energy: 0.8436740934066909
Energy: 0.9491740598138064
Energy: 0.842145417011674
Energy: 0.8928287877372266
Energy: 0.9768776050748994
Energy: 0.8618934493909178
Energy: 0.9381925003095494
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minimum gb energy = 0.8303296123062658 eV
minimum distance =  2.61007734140063 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.8445296167786737
Energy: 0.8301163498246545
Energy: 0.8550658839450026
Energy: 0.833308122843066
Energy: 0.8464630700444908
Energy: 0.8452505301591061
Energy: 0.8305834507793407
Energy: 0.8552205337639331
Energy: 0.831941128991488
Energy: 0.8309134023787497
Energy: 0.8621024616733421
Energy: 0.8982827460591926
Energy: 0.8305624874615811
Energy: 0.8872745117862773
Energy: 0.8305080241271883
Energy: 0.8490509454768882
Energy: 0.8489805137150328
Energy: 0.8302345111675061
Energy: 0.8870628908061222
Energy: 0.8968373623726832
Energy: 0.8302620690903788
Energy: 0.8290656097884905
Energy: 0.8306105882063023
Energy: 0.8321950534861468
Energy: 0.908658376660274
Energy: 0.8302650656807469
Energy: 0.8288247537268211
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Energy: 0.8303526287771493
Energy: 1.1833745192988168
Energy: 0.8561443444651805
Energy: 0.8607545754092503
Energy: 0.8292715561074201
Energy: 0.8068698593733553
Energy: 0.8132219798058692
Energy: 0.9122825746604649
Energy: 0.8594065733622519
Energy: 0.8287401777387754
Energy: 0.805934473602197
Energy: 0.8746656682586001
Energy: 0.8311863809181471
Energy: 0.828379829985884
Energy: 0.8314082723913788
Energy: 0.8532042513433997
Energy: 0.8786420221926586
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Energy: 0.8125305964346631
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Energy: 0.8317904533193762
Energy: 0.8371813122939056
Energy: 0.829588567012236
Energy: 0.8412174327760892
Energy: 0.8313625177213385
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Energy: 0.8352172921745925
Energy: 0.8297327774816853
Energy: 0.8550267385009206
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Energy: 0.8449602183335186
Energy: 0.8477653734721119
Energy: 0.829781378718866
Energy: 0.8316124422953663
Energy: 0.8750697566823075
Energy: 0.8444825726769636
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Energy: 0.8310247811246366
Energy: 0.8568759850870279
Energy: 0.8748765470073168
Energy: 0.8275755376718726
Energy: 0.8795053352064214
Energy: 0.8330411903413457
Energy: 0.846248540161423
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Energy: 0.8308765014605705
Energy: 0.8300929351638768
Energy: 0.8753244206959654
Energy: 0.9849673665607804
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Energy: 0.8306621608357061
Energy: 0.8300309440423086
Energy: 0.8756984485069597
Energy: 0.984367461583186
Energy: 0.830359976162671
Energy: 0.8289807455412349
Energy: 0.8854987032051064
Energy: 0.8442047927047601
Energy: 0.8307351365385676
Energy: 0.8590828118931225
Energy: 0.8299925341419394
Energy: 0.8459150102767756
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Energy: 0.8300339558968698
Energy: 0.8335594255728602
Energy: 0.8309094286370045
Energy: 0.8139001576570891
Energy: 0.8015810708403669
Energy: 0.9105046452128299
Energy: 0.8329535421930322
Energy: 0.8313324519672621
Energy: 0.8131374299108888
Energy: 0.8017367491795393
Energy: 0.8752533516301472
Energy: 0.8288553416978421
Energy: 0.8286630151920521
Energy: 0.8311597320840923
Energy: 0.8491809781388204
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Energy: 0.8573746977860995
Energy: 0.8578516075462638
Energy: 0.8643524008721322
Energy: 0.8489467065308155
Energy: 0.8308427555220759
Energy: 0.8666487449129333
Energy: 0.8317846435758888
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Energy: 0.8488861147415835
Energy: 0.8618243026922471
Energy: 0.8669322526803869
Energy: 0.8318622377682374
Energy: 0.828805055030604
Energy: 0.8483952295208625
Energy: 0.8294886638460217
Energy: 0.8064138980932591
Energy: 0.8477575669129054
Energy: 0.882920817975758
Energy: 0.8491980611690062
Energy: 0.8094739833667419
Energy: 0.849004640962075
Energy: 0.8297953949993173
Energy: 0.8829814473573762
Energy: 0.8667111250570226
Energy: 0.8062307375038099
Energy: 0.8960623493103395
Energy: 0.8327390481235317
Energy: 0.8273738233418448
Energy: 0.8623743052979765
Energy: 0.8054337071495561
Energy: 0.9138930798364675
Energy: 0.8356593214253961
Energy: 0.8283036108691162
Energy: 0.8642427006379271
Energy: 0.8054713332469113
Energy: 0.8294678479453232
Energy: 0.8551652332024099
Energy: 0.8312327447433997
Energy: 0.8794181922674169
Energy: 0.828566498957005
Energy: 0.830609755758535
Energy: 0.8381162567308793
Energy: 0.8317946775738649
Energy: 0.8791463998010521
Energy: 0.8529626367403507
Energy: 0.8303810597455978
Energy: 0.8582460203183732
Energy: 0.8745791799138429
Energy: 0.8487530195854303
Energy: 0.8440794166984894
Energy: 0.8307877679838177
Energy: 0.8744316672121346
Energy: 0.8729835894315945
Energy: 0.8630041212192521
Energy: 0.8448493652557605
Energy: 0.8296891743677662
Energy: 0.8975948325893619
Energy: 0.8798377676810285
Energy: 0.8382056398246048
Energy: 0.8930409414959086
Energy: 0.8473545427045205
Energy: 0.8451878692597146
Energy: 0.8547620690397502
Energy: 0.8381944003589887
Energy: 0.8543978570745653
Energy: 0.8309864558806085
Energy: 0.8489035718584561
Energy: 0.8291215733545795
Energy: 0.8299977265876924
Energy: 0.9203184450061715
Energy: 0.8305630235612773
Energy: 0.8488970498904883
Energy: 0.8607056509949349
Energy: 0.8304869820626459
Energy: 0.8870075777020958
Energy: 0.8022242151945177
Energy: 0.8304564802724661
Energy: 0.8287848643310927
Energy: 0.8300436530890256
Energy: 0.8337230275675095
Energy: 0.8342296959164064
Energy: 0.830402415051191
Energy: 0.8276969971103905
Energy: 0.8299656213035151
Energy: 0.815092744123566

minimum gb energy = 0.8015810708403669 eV
minimum distance =  2.61123624579972 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.7873143149118678
Energy: 0.6874272979921344
Energy: 0.7500077724607984
Energy: 0.7992499080283219
Energy: 0.6873546036352435
Energy: 0.7869200387253676
Energy: 0.6992127661858869
Energy: 0.7524910904661922
Energy: 0.799341170344286
Energy: 0.6874658684227971
Energy: 0.6897181124438387
Energy: 0.6986381502815975
Energy: 0.6977637443978397
Energy: 0.6970114243462856
Energy: 0.6981487784125161
Energy: 0.7543418241301293
Energy: 0.6990723503655114
Energy: 0.6878387550343938
Energy: 0.8000380710873108
Energy: 0.6983320639241362
Energy: 0.7001030117710878
Energy: 0.7984494681594881
Energy: 0.7446058489767694
Energy: 0.7550502767345423
Energy: 0.8089511019678356
Energy: 0.6990497313858992
Energy: 0.7990529419735841
Energy: 0.7009128217866497
Energy: 0.7539089895898281
Energy: 0.7551257263633714
Energy: 0.7533081665917063
Energy: 0.6889274916730015
Energy: 0.6878562950295953
Energy: 0.6975824319281496
Energy: 0.7553138388863608
Energy: 0.7530646926969963
Energy: 0.6883927933138962
Energy: 0.6875518303842476
Energy: 0.6983617397115438
Energy: 0.6917131447495829
Energy: 0.7992084793357743
Energy: 0.6876369156311833
Energy: 0.6884216893598415
Energy: 0.7024343770220742
Energy: 0.7011158082573613
Energy: 0.7999243238686329
Energy: 0.687882001116499
Energy: 0.6888718156811316
Energy: 0.704304362020618
Energy: 0.6997217714706161
Energy: 0.6992419725718148
Energy: 0.7553612299019169
Energy: 0.6986561805919973
Energy: 0.7440961642796252
Energy: 0.687457471919845
Energy: 0.7993751030528075
Energy: 0.7532842699590776
Energy: 0.7988226830774036
Energy: 0.744625476113792
Energy: 0.6872065896940092
Energy: 0.7017411284155487
Energy: 0.691058953259371
Energy: 0.6978393638581386
Energy: 0.698984245575203
Energy: 0.7032796081971292
Energy: 0.7050352678695574
Energy: 0.6910599393491093
Energy: 0.6975544873020751
Energy: 0.6989624487691313
Energy: 0.7544241563534622
Energy: 0.6987029438863364
Energy: 0.7603343585253681
Energy: 0.7008650256712243
Energy: 0.7854084383373007
Energy: 0.6869202552985335
Energy: 0.6996451833573148
Energy: 0.9087798850264057
Energy: 0.7453721229716364
Energy: 0.786980711379886
Energy: 0.686809619353148
Energy: 0.6986779085017252
Energy: 0.6879228028239075
Energy: 0.6971734464167157
Energy: 0.6883325641132934
Energy: 0.7020488732917107
Energy: 0.6985168308669952
Energy: 0.6971481356162091
Energy: 0.6965906923580936
Energy: 0.688688593666893
Energy: 0.7014985828518364
Energy: 0.7445095298550399
Energy: 0.7440473026095946
Energy: 0.9102595512857549
Energy: 0.7527378346730946
Energy: 0.7987414125101493
Energy: 0.7444613880213454
Energy: 0.7441405747937668
Energy: 0.908550024483914
Energy: 0.6992722337668016
Energy: 0.7985979152507516
Energy: 0.6886787023441837
Energy: 0.69808381145191
Energy: 0.7002646408404215
Energy: 0.7033706535273269
Energy: 0.6987810034009664
Energy: 0.6884909074907077
Energy: 0.6981492843311939
Energy: 0.6911768203245601
Energy: 0.7040335727214865
Energy: 0.699304405294859
Energy: 0.7872488079770239
Energy: 0.6993828745808638
Energy: 0.750582259397044
Energy: 0.7993027429354673
Energy: 0.6872934269484987
Energy: 0.7875802865039442
Energy: 0.6992523946276022
Energy: 0.7534229296467789
Energy: 0.7993243105707901
Energy: 0.6877869746193244
Energy: 0.7541977720122427
Energy: 0.6985651814915329
Energy: 0.6975058430500664
Energy: 0.6970965465563245
Energy: 0.6981531151173411
Energy: 0.7544411846554245
Energy: 0.6987410486837194
Energy: 0.6879438367615279
Energy: 0.6989324755272074
Energy: 0.6984816704265213
Energy: 0.7002101347815651
Energy: 0.7986384751328162
Energy: 0.7447306515889952
Energy: 0.7536118403813042
Energy: 0.8093034479141564
Energy: 0.6992567053259531
Energy: 0.7990314415750738
Energy: 0.7013608722749652
Energy: 0.7531255341151633
Energy: 0.7546048460581928
Energy: 0.7534921282124837
Energy: 0.6889077017640806
Energy: 0.6879261530070327
Energy: 0.6973552832421099
Energy: 0.7552571939930162
Energy: 0.7532480960666502
Energy: 0.6892046440634778
Energy: 0.6875836805143974
Energy: 0.6981443342702527
Energy: 0.8072135909231023
Energy: 0.7991580165621541
Energy: 0.6877435010823643
Energy: 0.6886698143282124
Energy: 0.8584004175946459
Energy: 0.7417467310108287
Energy: 0.7997344208561663
Energy: 0.6878312532826641
Energy: 0.6887873683027509
Energy: 0.7025654332660405
Energy: 0.7000006021963007
Energy: 0.6991608170968723
Energy: 0.7540464795847593
Energy: 0.6984518833243087
Energy: 0.7428061559770602
Energy: 0.6875452914872513
Energy: 0.7996388773008819
Energy: 0.7525980685723584
Energy: 0.7987732058204576
Energy: 0.7442973075399493
Energy: 0.6873409471468057
Energy: 0.7025677914013775
Energy: 0.6911123713185436
Energy: 0.6980287880602819
Energy: 0.6992915177922796
Energy: 0.7016062455238137
Energy: 0.7049861977407531
Energy: 0.6912963427107665
Energy: 0.6975662711527048
Energy: 0.6992573604520982
Energy: 0.701283870247927
Energy: 0.6989658199008505
Energy: 0.7599173893752176
Energy: 0.7008306968519284
Energy: 0.7835540373660972
Energy: 0.6872056809895318
Energy: 0.6993916374052535
Energy: 0.9086685885950008
Energy: 0.7455583092554936
Energy: 0.7869431530339414
Energy: 0.6871674167547261
Energy: 0.6987053535714418
Energy: 0.6878629833246994
Energy: 0.697147465235961
Energy: 0.6882543474401082
Energy: 0.7008384602641557
Energy: 0.6985473258744547
Energy: 0.697005381119725
Energy: 0.6968197181571242
Energy: 0.6886453682561402
Energy: 0.7015276702630897
Energy: 0.7445934588579722
Energy: 0.7442838866771575
Energy: 0.9092809684636042
Energy: 0.6992366283622778
Energy: 0.7985446993802829
Energy: 0.7445718199838586
Energy: 0.7441200270466487
Energy: 0.908633407997688
Energy: 0.6993658981474814
Energy: 0.798602755475412
Energy: 0.6887280089775456
Energy: 0.6981415908461335
Energy: 0.6999877653361357
Energy: 0.7038623977737037
Energy: 0.7007531201671354
Energy: 0.688898686791096
Energy: 0.6980617690031806
Energy: 0.6910877400543126
Energy: 0.703329562434277
Energy: 0.7013932338157572

minimum gb energy = 0.686809619353148 eV
minimum distance =  2.72581119289587 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.3174081477269326
Energy: 0.7954154129914652
Energy: 0.8882138525142939
Energy: 0.8533008093105253
Energy: 0.782917041330478
Energy: 0.7799817015499031
Energy: 0.8327220668133789
Energy: 0.8941897235006698
Energy: 0.8491828648252343
Energy: 0.7942987466280714
Energy: 0.7803272597571678
Energy: 0.8480432065396164
Energy: 0.7936307288483262
Energy: 0.7941917142535267
Energy: 0.7860732551353791
Energy: 0.7834511521050064
Energy: 0.8475869837460583
Energy: 0.7935249199797041
Energy: 0.8492467145366835
Energy: 0.7839788588008239
Energy: 0.8713996026643513
Energy: 0.8108280632199453
Energy: 0.782226651848291
Energy: 0.8582465716968909
Energy: 0.9023766683487802
Energy: 0.8778763027866655
Energy: 0.8063627506230211
Energy: 0.7832922358951933
Energy: 0.8467188706706482
Energy: 0.876074244467147
Energy: 0.8493577295233248
Energy: 0.7861954083081069
Energy: 0.8606713242874684
Energy: 0.8910060772917483
Energy: 0.8797657179767514
Energy: 0.8540339303090466
Energy: 0.7854819589656241
Energy: 0.8610235705735811
Energy: 0.8872274546100247
Energy: 0.8909243379908462
Energy: 0.8907514562610461
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Energy: 0.842839777715071
Energy: 0.8480054842738991
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Energy: 0.8939238860817883
Energy: 0.7944747808268338
Energy: 0.7919926510490778
Energy: 0.8463814454742901
Energy: 0.7818576856867009
Energy: 0.781785701289502
Energy: 0.789501015604241
Energy: 0.7892484474631095
Energy: 0.8789545750737442
Energy: 0.9414482846754474
Energy: 0.8500902594650546
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Energy: 0.7910370433600669
Energy: 0.8777934208240019
Energy: 1.038791049521257
Energy: 0.7876593441472896
Energy: 0.8002791038538398
Energy: 0.7872347769285958
Energy: 0.7903406914304412
Energy: 0.9262919731015866
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Energy: 0.7884645222164888
Energy: 0.8011271122630607
Energy: 0.818857353303556
Energy: 0.7882674647570319
Energy: 0.8024020724804558
Energy: 0.8176443955020171
Energy: 0.8468157931705161
Energy: 0.8577755840733086
Energy: 0.7909168301151799
Energy: 0.792718603048396
Energy: 0.8169536950455173
Energy: 0.8792775745649202
Energy: 0.8043963750372702
Energy: 0.7842650214182257
Energy: 0.9448387232795233
Energy: 0.8037123847860651
Energy: 0.9494970276406804
Energy: 0.7902029486983904
Energy: 0.7844920443784147
Energy: 0.9408493345811414
Energy: 0.8043950078482498
Energy: 0.9402514479081091
Energy: 0.7904929873832187
Energy: 0.8252516020320404
Energy: 0.7962150815507044
Energy: 0.7857230537003411
Energy: 0.808552367220515
Energy: 0.7969818959499888
Energy: 0.7960184069890853
Energy: 0.7965460156021391
Energy: 0.7851781078319462
Energy: 0.8098556818886745
Energy: 0.7952797092669077
Energy: 0.8403774858325848
Energy: 0.8040392141113785
Energy: 0.7965599865199748
Energy: 0.7986190684425183
Energy: 0.7952127550640523
Energy: 0.8416620530841133
Energy: 0.8039360385970145
Energy: 0.7949678350048672
Energy: 0.7990401882544
Energy: 0.7949696180723981
Energy: 0.9281841207134449
Energy: 0.855578889105193
Energy: 0.7983064121516745
Energy: 0.788490403203672
Energy: 0.8556529137670317
Energy: 0.928711837433365
Energy: 0.8552142006370452
Energy: 0.7975123482783334
Energy: 0.789362828065575
Energy: 0.8560245372997526
Energy: 0.9171713769305528
Energy: 0.8423376572025788
Energy: 0.7836173660801119
Energy: 0.7811162354694111
Energy: 0.842882837274062
Energy: 0.7856513656445057
Energy: 0.9022265171413114
Energy: 0.7796105701562605
Energy: 0.7800801037952585
Energy: 0.7862040447565412
Energy: 0.826747746230195
Energy: 0.8552175286157455
Energy: 0.8376899253007783
Energy: 0.8357647185998271
Energy: 0.8000658383653473
Energy: 0.8246522623411748
Energy: 0.8607856138299189
Energy: 0.7801993050801064
Energy: 0.8313405812302764
Energy: 0.7995754700348658
Energy: 0.7902676774489066
Energy: 0.8614248080264539
Energy: 0.879765499705768
Energy: 0.8078301602094372
Energy: 0.8015170928701625
Energy: 0.8021045918382091
Energy: 0.7977489616601987
Energy: 0.8795412586579002
Energy: 0.8161259641012947
Energy: 0.7832164729641882
Energy: 0.8800740796420214
Energy: 0.8899311064396221
Energy: 0.7989892011671652
Energy: 0.8577246205219545
Energy: 0.8615008929215002
Energy: 0.8805085311922085
Energy: 0.8794034740099158
Energy: 0.7977846653207334
Energy: 0.8579624006744967
Energy: 0.8583701847363004
Energy: 0.7919164666261003
Energy: 0.8482873086075693
Energy: 0.8802548516513591
Energy: 0.9083629087959164
Energy: 0.8641434954169587
Energy: 0.7809905403920058
Energy: 0.8628616892005764
Energy: 0.8353082757661802
Energy: 0.9091914275370313
Energy: 0.8791612199412372
Energy: 0.792579733187968
Energy: 0.9453991395848014
Energy: 0.9414073917143652
Energy: 0.8638354320455609
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Energy: 1.0027351554268862
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Energy: 0.7953625749524205
Energy: 0.8402272376099973
Energy: 0.8029469721345386
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Energy: 0.798088501975616
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Energy: 0.8431712712905453
Energy: 0.8032722505983748
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Energy: 0.8069858307848344
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Energy: 0.9279835019495434
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Energy: 0.7982867553437536
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Energy: 0.785057810445879
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Energy: 0.7967346257647331
Energy: 0.7887605784742892
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Energy: 0.8406998502968933
Energy: 0.7878392112297404
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Energy: 0.7807101933372831
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Energy: 0.8563301953281851
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Energy: 0.799603605392753
Energy: 0.807934630380973
Energy: 0.9039841417626615
Energy: 0.794291287598105
Energy: 0.8152152708275096
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Energy: 0.8212381874559214
Energy: 0.9005615197105575
Energy: 0.7941580203501006
Energy: 0.8156779070146344
Energy: 0.7844337035202865
Energy: 0.8798055515074313
Energy: 0.8808966627475785
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Energy: 0.8794029736825997
Energy: 0.8500758144342954
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Energy: 0.88201969963041
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Energy: 0.880213151855953
Energy: 0.784032940060911
Energy: 0.793572883194074
Energy: 0.9101041283958365
Energy: 0.9144177394820759
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Energy: 0.7927737797549876
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Energy: 0.908370334552683
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Energy: 0.9319940241796705
Energy: 0.9283317696405133
Energy: 0.8113206929977007
Energy: 0.7860812731093936
Energy: 0.8802282120753331
Energy: 0.941004005116793
Energy: 0.9409110029708458
Energy: 0.8512748653564707
Energy: 0.7862136475655389
Energy: 0.7915188559587955
Energy: 0.8386430742619456
Energy: 0.7872983966035341
Energy: 0.7922583796920498
Energy: 0.7857575918483224
Energy: 0.7924073995915679
Energy: 0.7945188465175879
Energy: 0.7861740870338696
Energy: 0.8010590233132201
Energy: 0.7848066540138158
Energy: 0.8075455395970604
Energy: 0.8580374400824117
Energy: 0.7893166549735763
Energy: 0.7888863873607781
Energy: 0.7867069770098816
Energy: 0.8407401126272422
Energy: 0.8582089166914683
Energy: 0.7885611331832797
Energy: 0.7880813766023034
Energy: 0.7860748757195462
Energy: 0.7991451316105654
Energy: 0.7865700770649321
Energy: 0.7940026291064383
Energy: 0.8560979687408524
Energy: 0.8092524871455757
Energy: 0.794055500848133
Energy: 0.7967939571046553
Energy: 0.7890737613188317
Energy: 0.7975477062296684
Energy: 0.7900009441392928
Energy: 0.7901907711107157
Energy: 0.7908061107749251
Energy: 0.7907345610919103
Energy: 0.9434248282754338
Energy: 0.7949591974405319
Energy: 0.7946506781331435
Energy: 0.7838966425686621
Energy: 0.809655019014843
Energy: 0.9452274258809592
Energy: 0.7833375194641681
Energy: 0.78723146277596
Energy: 0.8017757072015479
Energy: 0.7892630454203855
Energy: 0.7933358904590656
Energy: 0.7870280700080303
Energy: 0.7922849229821283
Energy: 0.7995173795892998
Energy: 0.7935719124391231
Energy: 0.8002984579761948
Energy: 0.7917620416223314
Energy: 0.7881930063217374
Energy: 0.8512233488917241
Energy: 0.8746383814422833
Energy: 0.8766715722347361
Energy: 0.8165681806567799
Energy: 0.7820878058673096
Energy: 0.8606533315859559
Energy: 0.8748503594966897
Energy: 0.8476533516364408
Energy: 0.7954232374081823
Energy: 0.8079663185112642
Energy: 0.871776321413721
Energy: 0.7827559187102869
Energy: 0.8455307711288286
Energy: 0.7782256497110769
Energy: 0.7801333216960303
Energy: 0.8552121905667452
Energy: 0.7995234877892546
Energy: 0.8567066158091726
Energy: 0.7912896615100417

minimum gb energy = 0.7780031082226923 eV
minimum distance =  2.61743249113697 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.0385086299461586
Energy: 0.7447670040128871
Energy: 0.7616522483946381
Energy: 0.8481659770021576
Energy: 0.7447577135929194
Energy: 1.018193443785346
Energy: 0.8098344832655081
Energy: 0.842938756364241
Energy: 0.8305861293181828
Energy: 0.8781915288498688
Energy: 0.7542499344774868
Energy: 0.8148826185902296
Energy: 0.927329826658998
Energy: 0.8776338401421325
Energy: 0.7602773852615973
Energy: 0.7514496497114818
Energy: 0.813865827875751
Energy: 0.9296557703498698
Energy: 0.8636938408950651
Energy: 0.7607477864304888
Energy: 0.8120255315890162
Energy: 0.8374727523043067
Energy: 0.8122621110487005
Energy: 0.75910129824982
Energy: 0.8214490888333167
Energy: 0.8128585627209611
Energy: 0.8373429911649105
Energy: 0.7496088266731826
Energy: 0.7586769016995344
Energy: 0.8202981430939296
Energy: 0.7704727590023134
Energy: 0.7603783074496091
Energy: 0.863404127256223
Energy: 0.8328826435330094
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Energy: 0.7598195389327828
Energy: 0.7641198130894816
Energy: 0.8614013322795244
Energy: 0.8317455677670251
Energy: 0.8205091255811611
Energy: 0.8142254390926212
Energy: 0.9484835254383739
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Energy: 0.7679715893717532
Energy: 0.9896749162986027
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Energy: 0.9500351862285741
Energy: 0.7631472106730346
Energy: 0.7678608075715291
Energy: 0.9895475169553944
Energy: 0.7636183937800896
Energy: 0.7603223475493577
Energy: 0.8037285328115112
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Energy: 1.0194282240402668
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Energy: 0.7602286173668532
Energy: 0.7496150527293021
Energy: 0.7584598392093387
Energy: 1.0190876699475317
Energy: 0.8317321503961632
Energy: 0.8133577853505232
Energy: 0.8150614906653585
Energy: 0.7593696339285316
Energy: 0.7509796135664217
Energy: 0.8312068117935609
Energy: 0.8142253338026593
Energy: 0.813979395871822
Energy: 0.7596389438815647
Energy: 0.7517348767833182
Energy: 0.8387740037332817
Energy: 0.7494265912022611
Energy: 0.7600579030705178
Energy: 0.7725095095573403
Energy: 0.8633458159724353
Energy: 0.8374365491388115
Energy: 0.7489353995269106
Energy: 0.7602276646158534
Energy: 0.9120403397594198
Energy: 0.8629769374011818
Energy: 0.757016219720752
Energy: 0.9889594891855479
Energy: 0.839278873320991
Energy: 0.8318133445586584
Energy: 0.759043990927445
Energy: 0.7669497096806117
Energy: 0.9514542076638438
Energy: 0.8881690654541397
Energy: 0.8479764434702843
Energy: 0.758026757532197
Energy: 0.7501650408554594
Energy: 0.7635086509939177
Energy: 0.7519988627171461
Energy: 0.7468409106836194
Energy: 0.9686119635473991
Energy: 0.8135201789243351
Energy: 0.756627858978325
Energy: 0.7520468508367825
Energy: 0.7468265345736091
Energy: 0.9680401773857306
Energy: 0.7508405999235759
Energy: 0.7510048044149609
Energy: 0.7517404485369883
Energy: 1.023041546042245
Energy: 0.7466754652566021
Energy: 0.751302453363011
Energy: 0.7514262928651364
Energy: 0.7514902284226777
Energy: 1.0233894573404878
Energy: 0.7606735531741268
Energy: 0.7509510191944662
Energy: 0.7492629362890423
Energy: 0.756172342780417
Energy: 0.8660847274875305
Energy: 0.750432133752715
Energy: 0.7488600779022074
Energy: 0.7494494652248167
Energy: 0.7565072992581575
Energy: 0.8642714738482303
Energy: 0.7547809677667278
Energy: 0.7501056988970327
Energy: 0.7511542912715352
Energy: 0.9486298022935686
Energy: 0.9483844716060718
Energy: 0.7507687600590889
Energy: 0.7495827866179534
Energy: 0.7513834002126247
Energy: 0.9487340255629777
Energy: 0.9484774729955228
Energy: 0.7503578374187938
Energy: 0.8742131391156702
Energy: 0.7528842769096933
Energy: 0.9359763113392037
Energy: 0.758530332011618
Energy: 0.7477509652399005
Energy: 0.9548860858354826
Energy: 0.7530713343550878
Energy: 0.8469127256904712
Energy: 0.758735882866541
Energy: 0.762884587907066

minimum gb energy = 0.7447577135929194 eV
minimum distance =  2.70026255636844 Angstroms
sigma value = 33