Model name: model_name=MEAM_LAMMPS_LeeLee_2010_FeAl__MO_332211522050_002
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.0419338792562485
cohesive_energy=3.370440303774132
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[0.0, 6.537761863868699e-23, 3.0893970945105e-19, 3.43223085065382e-19, 3.71669731202052e-19, 3.95846576609112e-19, 4.1669890550062203e-19, 4.34853168940476e-19, 4.50754772032926e-19, 4.647257522814059e-19, 4.77017651417454e-19, 4.87824332813784e-19, 4.97304411957162e-19, 5.05586062978308e-19, 5.12778233888334e-19, 5.18967442225476e-19, 5.242353989980679e-19, 5.286477934481039e-19, 5.32260701757774e-19, 5.351269957559999e-19, 5.37293138565168e-19, 5.387959802478599e-19, 5.39675575219926e-19, 5.399623648374119e-19, 5.3965314474705e-19, 5.38196766186744e-19, 5.35308041715642e-19, 5.322062277522179e-19, 5.28226420993362e-19, 5.229071945684819e-19, 5.15987393686236e-19, 5.07159400432896e-19, 4.96046703299472e-19, 4.82189477592006e-19, 4.65022154958696e-19, 4.4383497115068e-19, 4.177435246659899e-19, 3.85624689684192e-19, 3.4604451811785596e-19, 2.97152495954712e-19, 2.36527734300786e-19, 1.6096267553481e-19, 6.61503484292652e-20, -5.380381506999779e-20, -2.0710376041737598e-19, -4.0543720594023593e-19, -6.65874222150204e-19, -1.014064054780986e-18, -1.489963386907908e-18, -2.15842031779212e-18, -3.1302045333784797e-18, -4.6072031069640596e-18, -6.989223195797219e-18, -1.116234858731166e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.012735529861429253
Energy: 0.4273765657479955
Energy: 0.6613927979297963
Energy: 0.6054927230555073
Energy: 0.7076211932903735
Energy: 0.45353877168120965
Energy: 0.08290220338560182
Energy: 0.3350378468807779
Energy: 0.6618657250771581
Energy: 0.41458621369854864
Energy: 0.40361914762253187
Energy: 0.48779124241623995
Energy: 0.013703394247158383
Energy: 0.19474532900933084
Energy: 0.013262005225173075
Energy: 0.7609963734323721
Energy: 0.6319220452502877
Energy: 0.5716888679291247
Energy: 0.551898315259245
Energy: 0.20555841343466902
Energy: 0.20565212168448638
Energy: 0.01449724639646694
Energy: 0.3835083526703764
Energy: 0.6655879442358584
Energy: 0.6191281128936772
Energy: 0.6376544529271194
Energy: 0.22943291036426733
Energy: 0.09016126916907229
Energy: 0.4533022882853162
Energy: 0.6367435561350875
Energy: 0.3156941876445579
Energy: 0.3706428224927048
Energy: 0.3618248043606537
Energy: 0.057142546354162965
Energy: 0.192485278623865
Energy: 0.044938366161630085
Energy: 0.4147856541274209
Energy: 0.6262325173376868
Energy: 0.5524568755935749
Energy: 0.4693352251408321
Energy: 0.19438215118260171
Energy: 0.16520037339314955

minimum gb energy = 0.012735529861429253 eV
minimum distance =  2.79121610581842 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 0.7411262794783879
Energy: 0.8861716299453034
Energy: 0.7781484494551185
Energy: 0.8444114527773163
Energy: 0.8299436772957917
Energy: 0.814374426337766
Energy: 0.8536469248233018
Energy: 0.683864486599923
Energy: 0.815860275017501
Energy: 0.7232175961009171
Energy: 0.877237516462172
Energy: 0.8125117760411839
Energy: 0.7338545262141272
Energy: 0.8112229274911026
Energy: 0.7696743531982121
Energy: 0.7909772316928559
Energy: 0.7833723204194142
Energy: 0.8053046643534926
Energy: 0.7701918597263583
Energy: 0.7668666598224793
Energy: 0.7474349225311793
Energy: 0.7348613420024999
Energy: 0.8613634319085081
Energy: 0.7209365443990703
Energy: 0.7849832941037957
Energy: 0.8028041037311744
Energy: 0.7457787690701775
Energy: 0.8606518251296323
Energy: 0.7670565965421293
Energy: 0.8499279878555666
Energy: 0.7401752565108974
Energy: 0.7810855945263678
Energy: 0.7812767835698107
Energy: 0.8036755231282078
Energy: 0.9052429805171409
Energy: 0.6862710488004667
Energy: 0.8536443872635342
Energy: 0.7018985220118955
Energy: 0.7957120791793921
Energy: 0.8352427039931656
Energy: 0.6810925086960594
Energy: 0.8226464057047693
Energy: 0.7812667015844654
Energy: 0.7866228285631096
Energy: 0.7451530357316121
Energy: 0.7724429723956019
Energy: 0.7895154839557831
Energy: 0.7348394932504992
Energy: 0.830172772863476
Energy: 0.7020668450456008
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Energy: 0.8133743004747847
Energy: 0.8019878472024369
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Energy: 0.8230102267666047
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Energy: 0.718608219298189
Energy: 0.7457525598726553
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Energy: 0.8451751261602342
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Energy: 0.7703272493592581
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Energy: 0.8434691117053166
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Energy: 0.6794026923702683
Energy: 0.8137767691501051
Energy: 0.722981957736601
Energy: 0.8447423214418569
Energy: 0.8308434490402932
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Energy: 0.7925073948112508
Energy: 0.7749799292978489
Energy: 0.8313793206364409
Energy: 0.7918543599489865
Energy: 0.7778788639355061
Energy: 0.8023643106636709
Energy: 0.7808055511252747
Energy: 0.8450363255786357
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Energy: 0.7978871162071263
Energy: 0.8145575697735514
Energy: 0.731009722198787
Energy: 0.8386060610257384
Energy: 0.6991851707539726
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Energy: 0.7375038379230076
Energy: 0.7888981158569707
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Energy: 0.7895635880555308
Energy: 0.9102812979089633
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Energy: 0.8600005879790867
Energy: 0.7364622044788615
Energy: 0.796786367810044
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Energy: 0.7316148633818585
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Energy: 0.708711808176306
Energy: 0.8457714590919458
Energy: 0.681029094716996
Energy: 0.8158251091731299
Energy: 0.7728181483135675
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Energy: 0.8123118377802313
Energy: 0.7704640625477978
Energy: 0.7627168259049423
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Energy: 0.770134340114577
Energy: 0.8198588610256198
Energy: 0.7226970065835722
Energy: 0.8399790642039566
Energy: 0.7465180144239199
Energy: 0.7728490112689437
Energy: 0.7491040162540838
Energy: 0.7523296930789548
Energy: 0.8510766975999584
Energy: 0.7839202556493102
Energy: 0.7732098088203764
Energy: 0.7352477648963781
Energy: 0.7263789813890869
Energy: 0.7781647967270037
Energy: 0.7962039887381365
Energy: 0.7964487248092383
Energy: 0.7058332190296516
Energy: 0.8173679453261513
Energy: 0.684867497577705
Energy: 0.7868505975052268
Energy: 0.8153155670087905
Energy: 0.6823747277178183
Energy: 0.8145273035567888
Energy: 0.774724779469125
Energy: 0.8589195408293578
Energy: 0.7496756586677343
Energy: 0.7869901192515645
Energy: 0.7630768248314689
Energy: 0.7696408231150675
Energy: 0.8049695724283105
Energy: 0.6793859867751065
Energy: 0.8459489809444286
Energy: 0.7093098502720965
Energy: 0.7950354678459457
Energy: 0.8142433478208168
Energy: 0.7188668354067872
Energy: 0.8531763151841081
Energy: 0.7522586414006066
Energy: 0.7386529369460227
Energy: 0.759593429370266
Energy: 0.7719392157559241
Energy: 0.8091354218210333
Energy: 0.7781647489456675
Energy: 0.7286667496894379
Energy: 0.6919713530143932
Energy: 0.8136731031003109
Energy: 0.7867594444899523
Energy: 0.8420018660490719
Energy: 0.7938118064070291
Energy: 0.7526870672261933
Energy: 0.8099306651957763
Energy: 0.7447904524777651
Energy: 0.8460727164732773
Energy: 0.790576224882669
Energy: 0.8151581252702377
Energy: 0.8185341713489387
Energy: 0.7636323982350446
Energy: 0.8103710739848589

minimum gb energy = 0.6788440378619063 eV
minimum distance =  2.51143191303375 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 0.7222834093577206
Energy: 0.8172958511990437
Energy: 0.7778682882575186
Energy: 0.8498817231617718
Energy: 0.8256875020498531
Energy: 0.7771390523564912
Energy: 0.7768118555966411
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Energy: 0.7519195314279616
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Energy: 0.81879379832906
Energy: 0.7996387358034903
Energy: 0.7682188033824838
Energy: 0.8695640374382628
Energy: 0.7472040399039366
Energy: 0.7511182766745889
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Energy: 0.7321920207694675
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Energy: 0.7784370606903486
Energy: 0.8460335456155725
Energy: 0.7391370912023627
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Energy: 0.7401103446202751
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Energy: 0.7745660388495562
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Energy: 0.7432131033538516
Energy: 0.795507655328915
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Energy: 0.7945379359377912
Energy: 0.7506162545383119
Energy: 0.675281911865197
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Energy: 0.8837938470908994
Energy: 0.7862389342165802
Energy: 0.8645768731023261
Energy: 0.7095327221971915
Energy: 0.7386730992246515
Energy: 0.806307915943239
Energy: 0.8153760900064332
Energy: 0.9520340113228355
Energy: 0.8047527208293711
Energy: 0.7602514900738713
Energy: 0.7529268517583468
Energy: 0.7606426928250553
Energy: 0.7338486679276263
Energy: 0.7228424214066882
Energy: 0.9004060193848704
Energy: 0.7970415907195875
Energy: 0.828921226885907
Energy: 0.7425889384608688
Energy: 0.7546827592247541
Energy: 0.7526931364424178
Energy: 0.7880470892600201
Energy: 0.8407826279919354
Energy: 0.6880535979842102
Energy: 0.7914536346010848
Energy: 0.7362577787780212
Energy: 0.8412624986549463
Energy: 0.8548826091442873
Energy: 0.8212188489897406
Energy: 0.7836926528412782
Energy: 0.7126905054389503
Energy: 0.7704614778751625
Energy: 0.7919957489554198
Energy: 0.8719447468770546
Energy: 0.7995175419472113
Energy: 0.7305409180285597
Energy: 0.7610968049625649
Energy: 0.6802356756390987
Energy: 0.7612577404948441
Energy: 0.7605110296094559
Energy: 0.7387425569913603
Energy: 0.7095373932296656
Energy: 0.8009125391576284
Energy: 0.7729921026364638
Energy: 0.6863869634767303
Energy: 0.763641443527877
Energy: 0.8151985895407249
Energy: 0.8258219000975473
Energy: 0.8036044355540769
Energy: 0.8014765501981679
Energy: 0.7407258834945007
Energy: 0.7081451150138216
Energy: 0.798838444209969
Energy: 0.749734173477566
Energy: 0.8457153800703276
Energy: 0.8290952776754844
Energy: 0.7527176057587233
Energy: 0.7610057293707664
Energy: 0.7399223877729352
Energy: 0.82363655277143
Energy: 0.7495115818254054
Energy: 0.7431417710878064
Energy: 0.7556221430841732
Energy: 0.7995740901347426
Energy: 0.7914820961479048
Energy: 0.7452868374991992
Energy: 0.8552642354896897
Energy: 0.68315745946807
Energy: 0.7651566969530069
Energy: 0.7520997038374633
Energy: 0.706975026989418
Energy: 0.9081434741877157
Energy: 0.7787941118502797
Energy: 0.8565245407295953
Energy: 0.7476577304797385
Energy: 0.7408522279204202
Energy: 0.8149459045970636
Energy: 0.8120098168929872
Energy: 0.8709324618909695
Energy: 0.779207572675227
Energy: 0.7848235661971904
Energy: 0.6798525402661756
Energy: 0.759823584763552
Energy: 0.7320268493316301
Energy: 0.7014257998242159
Energy: 0.8741498551546061
Energy: 0.7875828034654819
Energy: 0.7633399016850116
Energy: 0.7315352081476324
Energy: 0.7580241430919098
Energy: 0.7548909439828323
Energy: 0.7936847860059747
Energy: 0.8356166536588339
Energy: 0.6926250789738013
Energy: 0.7953557485757247
Energy: 0.7697611609328553
Energy: 0.8417797048798623
Energy: 0.867662963608748
Energy: 0.8260236832302494
Energy: 0.7385075173449004
Energy: 0.7242283643747219
Energy: 0.7446553971468022
Energy: 0.7918002246149485
Energy: 0.7989275938714382
Energy: 0.7544789016927852
Energy: 0.7882210509936345
Energy: 0.7655193964745532
Energy: 0.695572359076308
Energy: 0.7495962543365877
Energy: 0.6935562830151716
Energy: 0.7647484327669919
Energy: 0.8332927576131433
Energy: 0.6733115873967799
Energy: 0.7591369555545012

minimum gb energy = 0.6718365381486241 eV
minimum distance =  2.48750572043231 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.7618173800492738
Energy: 0.8110615846205879
Energy: 0.7419191618222901
Energy: 0.8288709155352346
Energy: 0.7601322119122507
Energy: 0.76003957100475
Energy: 0.7927182565477684
Energy: 0.7822175386880242
Energy: 0.8038230851269867
Energy: 0.7468335173156384
Energy: 0.8017394078323182
Energy: 0.787969087957532
Energy: 0.7815936542262442
Energy: 0.8240361037607462
Energy: 0.7521272420310517
Energy: 0.784818111835975
Energy: 0.7257819980605573
Energy: 0.7689934305552485
Energy: 0.7829394513535362
Energy: 0.7668816102528909
Energy: 0.7533917779402148
Energy: 0.7249721638769026
Energy: 0.8320243056147356
Energy: 0.7244763383835862
Energy: 0.8249502757830824
Energy: 0.821015225102516
Energy: 0.7282548743318524
Energy: 0.7992802286692963
Energy: 0.7555749375249197
Energy: 0.8208079242768566
Energy: 0.7733177685381011
Energy: 0.7841547437499877
Energy: 0.7627677611529052
Energy: 0.7407298226806833
Energy: 0.7730279811213928
Energy: 0.719310672099857
Energy: 0.7664961737216652
Energy: 0.7281077870834738
Energy: 0.8307148688578565
Energy: 0.7046514163618343
Energy: 0.7244092191905762
Energy: 0.8216785443003239
Energy: 0.7386169650083976
Energy: 0.7669535735498727
Energy: 0.7456094177886204
Energy: 0.7777428679592272
Energy: 0.7898201164823326
Energy: 0.7489784971273784
Energy: 0.7786650879104287
Energy: 0.7591929531670337
Energy: 0.7923664719158244
Energy: 0.7712154338308814
Energy: 0.8205480632259742
Energy: 0.7484067391625034
Energy: 0.7276823167370333
Energy: 0.7967686997885308
Energy: 0.7451059728689964
Energy: 0.7217797017560824
Energy: 0.7396532787448996
Energy: 0.7548022397765483
Energy: 0.794224599963136
Energy: 0.700799261080142
Energy: 0.7705411478028849
Energy: 0.7241871976749169
Energy: 0.8228219197995216
Energy: 0.7196966605902972
Energy: 0.7795393184526148
Energy: 0.8063865302121294
Energy: 0.745917607244133
Energy: 0.8203763536130333
Energy: 0.7744732321538541
Energy: 0.7985248952797509
Energy: 0.7576968019208269
Energy: 0.7779345226916374
Energy: 0.7722426199105117
Energy: 0.7678789225257754
Energy: 0.8652245735962772
Energy: 0.7258771872353935
Energy: 0.7955751552811589
Energy: 0.7165646286823948
Energy: 0.7641627413108759
Energy: 0.7830526663688078
Energy: 0.6841581271895512
Energy: 0.7862522897121293
Energy: 0.7395603331843167
Energy: 0.7890208584273279
Energy: 0.7423471625761286
Energy: 0.7724262356732523
Energy: 0.7978426675831781
Energy: 0.7549766082052879
Energy: 0.73238624972086
Energy: 0.7435611780018396
Energy: 0.827094770085015
Energy: 0.7616017794277675
Energy: 0.8076979507836192
Energy: 0.7768215217184714
Energy: 0.7667305990962799
Energy: 0.7977149800536967
Energy: 0.7156854919336317
Energy: 0.722938680608099
Energy: 0.7619430299923541
Energy: 0.7191828225091335
Energy: 0.8106454626101125
Energy: 0.7288299075504675
Energy: 0.7275228084037402
Energy: 0.7220381203672237
Energy: 0.8193253367500333
Energy: 0.7723562502916685
Energy: 0.7725664689315355
Energy: 0.8019120290852336
Energy: 0.7132100532248848
Energy: 0.8016276286241236
Energy: 0.7503182886051808
Energy: 0.8184868384879534
Energy: 0.759388226072609
Energy: 0.7756872931612956
Energy: 0.7895917348597641
Energy: 0.7925409595485566
Energy: 0.8447728661034578
Energy: 0.6971650567839909
Energy: 0.8041748688397113
Energy: 0.6866992296648036
Energy: 0.802223952161262
Energy: 0.754711130163677
Energy: 0.752940486377736
Energy: 0.7886299371974682
Energy: 0.7403821840283924
Energy: 0.7661931041905373
Energy: 0.736715754120155
Energy: 0.7427702044693856
Energy: 0.7033298412441022
Energy: 0.7485738958587652
Energy: 0.7712744027311134
Energy: 0.7506166398788765
Energy: 0.8184785328349338
Energy: 0.7420971663534309
Energy: 0.7920428300351912
Energy: 0.7862491325903384
Energy: 0.7746181431661682
Energy: 0.8688321585900521
Energy: 0.7385506518537449
Energy: 0.7706265765738652
Energy: 0.7185814111609274
Energy: 0.7101117932159804
Energy: 0.8230956800267731
Energy: 0.7338859392106332
Energy: 0.7990348933645441
Energy: 0.7341160746558877
Energy: 0.7874288676918628
Energy: 0.7886059021381856
Energy: 0.8280920781922879
Energy: 0.8210912411521254
Energy: 0.7406013313660251
Energy: 0.7772128278500712
Energy: 0.7598327201542661
Energy: 0.8560442858507586
Energy: 0.7890871779993148
Energy: 0.8116496472783519
Energy: 0.7778831712674116
Energy: 0.7709963460012821
Energy: 0.8192338286980889
Energy: 0.7313251926132823
Energy: 0.813833376466762
Energy: 0.7339200150761706
Energy: 0.8062873329992454
Energy: 0.7905259524142481
Energy: 0.8087979387762673
Energy: 0.8501542687002079
Energy: 0.7328031815627473
Energy: 0.8315471290368914
Energy: 0.7489557462157725
Energy: 0.7333983864275065
Energy: 0.8267980600173427
Energy: 0.7744713396305437
Energy: 0.7940849124668736
Energy: 0.7626780206007141
Energy: 0.8182942853581862
Energy: 0.7750740952868639
Energy: 0.8210414764661149
Energy: 0.7789438155026577
Energy: 0.7428717263649568
Energy: 0.8068775773681574
Energy: 0.7097258115651963
Energy: 0.7190112549012541
Energy: 0.7221319065251637
Energy: 0.7721421222302666
Energy: 0.7651605092173965
Energy: 0.7295967576851807
Energy: 0.7283391890314187
Energy: 0.6932666754382706
Energy: 0.7826873227705697
Energy: 0.7467505358171723
Energy: 0.7952034035194152
Energy: 0.7808589941372948
Energy: 0.7530816582103133
Energy: 0.8270777538914611
Energy: 0.7692479897178471
Energy: 0.8365428707210524
Energy: 0.7593155651696918
Energy: 0.7882480069901022
Energy: 0.75930803678472
Energy: 0.7644411531533875
Energy: 0.8332595505583736
Energy: 0.736425498876118
Energy: 0.813431897751261
Energy: 0.7526762526841153
Energy: 0.8131024068223404
Energy: 0.7834937991075406
Energy: 0.7425452477878777
Energy: 0.8344272238456077
Energy: 0.7497473635272704
Energy: 0.7968238011474463
Energy: 0.6900149154176539
Energy: 0.7798510530792484
Energy: 0.7732966220511537
Energy: 0.7492231406991112
Energy: 0.7583244127040902
Energy: 0.7375364429725724
Energy: 0.8111999863982792
Energy: 0.7666911505203902
Energy: 0.801597908809344
Energy: 0.79047856706797
Energy: 0.7604644808357152
Energy: 0.7852108739204805
Energy: 0.7228624273257525
Energy: 0.749909841587249
Energy: 0.7452895237808035
Energy: 0.7595483305566484
Energy: 0.7830305343767731
Energy: 0.7394182129226159
Energy: 0.7638848787369165
Energy: 0.7341905218552947
Energy: 0.7912688582055122
Energy: 0.7656620156593649
Energy: 0.7625035535040342
Energy: 0.7289920754523979
Energy: 0.6978739902031944
Energy: 0.7461299544072205
Energy: 0.7740098900809748
Energy: 0.8342112345732705
Energy: 0.7459437235774544
Energy: 0.7800961217292793
Energy: 0.7937282309211262
Energy: 0.8037425780884969
Energy: 0.8356080662405507
Energy: 0.7652644512569394
Energy: 0.8521337574040224
Energy: 0.7408325687606904
Energy: 0.8241947253109433
Energy: 0.7956224979447308
Energy: 0.761890727178145
Energy: 0.8094528674113759

minimum gb energy = 0.6841581271895512 eV
minimum distance =  2.48644750618096 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.6567509862203176
Energy: 0.8517125212523912
Energy: 0.7967789010452596
Energy: 0.8519532588149457
Energy: 0.8250214468145728
Energy: 0.8031749453197812
Energy: 0.725778477042588
Energy: 0.7276070122301505
Energy: 0.7370248309822304
Energy: 0.7608846825187278
Energy: 0.6848891026177807
Energy: 0.7071564423024378
Energy: 0.7104228712910061
Energy: 0.7442188547905184
Energy: 0.7564471627740802
Energy: 0.6775841714548337
Energy: 0.7348524171226566
Energy: 0.6692079528639567
Energy: 0.6824197116788893
Energy: 0.6991553415970573
Energy: 0.756499502348008
Energy: 0.6780753488559293
Energy: 0.8172041013287785
Energy: 0.7166723636414543
Energy: 0.7285733164783403
Energy: 0.7337853094873596
Energy: 0.7346695229040345
Energy: 0.8184404836514465
Energy: 0.6945754513118173
Energy: 0.682368726655131
Energy: 0.7082748710828762
Energy: 0.7020058272818674
Energy: 0.7514810654200005
Energy: 0.815996888219322
Energy: 0.7979097320658652
Energy: 0.6637634261806775
Energy: 0.6815282787029706
Energy: 0.8299970799737636
Energy: 0.8007223773320963
Energy: 0.7276690548022019
Energy: 0.7133510333752144
Energy: 0.7983759094980513
Energy: 0.8006621933636762
Energy: 0.9208453083296151
Energy: 0.8098917952802497
Energy: 0.7866583406802332
Energy: 0.7161048505070282
Energy: 0.6723802920193181
Energy: 0.8027035891534792
Energy: 0.657559296674051
Energy: 0.7446670197274581
Energy: 0.85306329054915
Energy: 0.791274107344936
Energy: 0.7377018837549135
Energy: 0.7126672481715383
Energy: 0.8457180021346299
Energy: 0.6583418284901447
Energy: 0.753147329686594
Energy: 0.802903298828747
Energy: 0.7016978562770972
Energy: 0.690681779703961
Energy: 0.8064821386702666
Energy: 0.7648450277373569
Energy: 0.8195351816088366
Energy: 0.8441659260121032
Energy: 0.7354041056595134
Energy: 0.7049469241619847
Energy: 0.7038099649926398
Energy: 0.700045231068867
Energy: 0.8187695065177465
Energy: 0.6927879910527269
Energy: 0.7038886325010821
Energy: 0.7270965470600034
Energy: 0.7210928915690767
Energy: 0.7021746897575563
Energy: 0.7230243229338229
Energy: 0.8288018995901806
Energy: 0.6939222719086118
Energy: 0.7019519225318469
Energy: 0.7290004257690004
Energy: 0.6625179706406088
Energy: 0.6749273201609035
Energy: 0.7414777858914884
Energy: 0.737560591768636
Energy: 0.6573008084597306
Energy: 0.692643417855141
Energy: 0.7514449019326941
Energy: 0.7739433194276205
Energy: 0.7517825462830328
Energy: 0.7820986865824096
Energy: 0.7931341816438519
Energy: 0.8066389691347179
Energy: 0.79889585383484
Energy: 0.7800952014119128
Energy: 0.7511894245859208
Energy: 0.7214755185209729
Energy: 0.678964459997093
Energy: 0.7792276652181127
Energy: 0.6664506071651295
Energy: 0.768526973560857
Energy: 0.8170953096211271
Energy: 0.7498094942760981
Energy: 0.743775398297536
Energy: 0.6684701362591328
Energy: 0.697354582490309
Energy: 0.6568834211629229
Energy: 0.7721561656445252
Energy: 0.7933611353269239
Energy: 0.792287368805803
Energy: 0.8160327870448599
Energy: 0.8052813785794579
Energy: 0.7434744935338781
Energy: 0.733144491688986
Energy: 0.8175806087673676
Energy: 0.7282298241748859
Energy: 0.7183825864961981
Energy: 0.7097418508857579
Energy: 0.6970858478274153
Energy: 0.7596053095291984
Energy: 0.6985399074433795
Energy: 0.6929480715418994
Energy: 0.7308879205810915
Energy: 0.6748275600611483
Energy: 0.6836809985462519
Energy: 0.7095790781001715
Energy: 0.7311584278058126
Energy: 0.685631943620035
Energy: 0.7857755232941713
Energy: 0.7101456042153564
Energy: 0.7355805928265859
Energy: 0.7408382455554887
Energy: 0.7325385210566838
Energy: 0.8085050647912471
Energy: 0.6930522360256854
Energy: 0.6786915869204052
Energy: 0.7090911794066462
Energy: 0.7043377225606271
Energy: 0.7199297161964501
Energy: 0.798550814214657
Energy: 0.7957382660181619
Energy: 0.6646078644489565
Energy: 0.7143518738963623
Energy: 0.8224749289281964
Energy: 0.8013640178188206
Energy: 0.7345453282257315
Energy: 0.6830930255907681
Energy: 0.8429549403108137
Energy: 0.798284181763303
Energy: 0.9156763385501574
Energy: 0.798504516197013
Energy: 0.7545015516364727
Energy: 0.7111068836464867
Energy: 0.6717819972848782
Energy: 0.7963791298442936
Energy: 0.6586589115641571
Energy: 0.7547961255259302
Energy: 0.8391596541769121
Energy: 0.795758322120008
Energy: 0.7435576132841214
Energy: 0.7778434895672208
Energy: 0.7759220705569859
Energy: 0.6597509780283101
Energy: 0.7451976787377255
Energy: 0.7922472575410815
Energy: 0.6964606805110559
Energy: 0.7731938023770946
Energy: 0.7998982867099277
Energy: 0.7557325446748663
Energy: 0.8252629647959074
Energy: 0.8577462892490921
Energy: 0.7314378868137882
Energy: 0.7344077509934539
Energy: 0.6793735683126672
Energy: 0.7086465180920333
Energy: 0.8125454286252293
Energy: 0.6853753427625575
Energy: 0.7121908386293649
Energy: 0.7275095524822336
Energy: 0.7149706790993255
Energy: 0.6951193473198664
Energy: 0.7422792967276005
Energy: 0.8261115163312895
Energy: 0.6939522587726263
Energy: 0.7057424829279769
Energy: 0.7064455125834714
Energy: 0.654788229966615
Energy: 0.6724492647268601
Energy: 0.7422628617431274
Energy: 0.7286720377404455
Energy: 0.6566268727679904
Energy: 0.699777533921839
Energy: 0.7805098736507867
Energy: 0.7658865538685253
Energy: 0.7226728064072238
Energy: 0.7832172340840611
Energy: 0.8004882924700993
Energy: 0.8187164437633274
Energy: 0.868098478486658
Energy: 0.8084537863239856
Energy: 0.7479869145696062
Energy: 0.7219875252230811
Energy: 0.6758176551238306
Energy: 0.7819478410559354
Energy: 0.6644094560593866
Energy: 0.7653990430472517
Energy: 0.7897838075200992
Energy: 0.7803484148610981
Energy: 0.7140508094930541
Energy: 0.691016447270007
Energy: 0.7551292083144522

minimum gb energy = 0.654788229966615 eV
minimum distance =  2.54920561105024 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 0.8297850317217265
Energy: 0.8719146895828443
Energy: 0.840593285625034
Energy: 0.8593365968257176
Energy: 0.7681631933676206
Energy: 0.8093731768889065
Energy: 0.7989313270391377
Energy: 0.8455420920855026
Energy: 0.790907174707714
Energy: 0.8867943676383228
Energy: 0.809136372064906
Energy: 0.8253831553755101
Energy: 0.7905667030519942
Energy: 0.8496054220912194
Energy: 0.842122217263063
Energy: 0.789810641730114
Energy: 0.8122827236843878
Energy: 0.787624454994303
Energy: 0.8096807220143921
Energy: 0.8278561548591146
Energy: 0.8743086449563469
Energy: 0.8494354281967594
Energy: 0.8406341207682757
Energy: 0.7349199169779717
Energy: 0.8230089422647544
Energy: 0.7539084253101257
Energy: 0.728724056241385
Energy: 0.8419210512131137
Energy: 0.7473679185397732
Energy: 0.75795542254051
Energy: 0.700243524112735
Energy: 0.7577567524935445
Energy: 0.7904470301883428
Energy: 0.7017617995044313
Energy: 0.7747211220650051
Energy: 0.6567048323368287
Energy: 0.7103828225425114
Energy: 0.8057444559382204
Energy: 0.7810073768404266
Energy: 0.8454438365239723
Energy: 0.721254959898358
Energy: 0.7060464131032146
Energy: 0.8306970528030081
Energy: 0.9146688466140981
Energy: 0.7230590506724046
Energy: 0.7663546873585589
Energy: 0.7046978831350817
Energy: 0.660940580013041
Energy: 0.7046183635343855
Energy: 0.8076011595217805
Energy: 0.6932690815065705
Energy: 0.8153159878047329
Energy: 0.7380133611123317
Energy: 0.7780805554178858
Energy: 0.760485820236361
Energy: 0.7685615206902191
Energy: 0.7239579600720654
Energy: 0.8557687987323571
Energy: 0.8206785158224705
Energy: 0.8039439784223429
Energy: 0.84114704044534
Energy: 0.9007978292505658
Energy: 0.8510067579507046
Energy: 0.8164875966816004
Energy: 0.7791482130527657
Energy: 0.7431621928744627
Energy: 0.7685645552810961
Energy: 0.6987865617462165
Energy: 0.8004492332014282
Energy: 0.8332592783131413
Energy: 0.8170588034604033
Energy: 0.7783900447544457
Energy: 0.7827373324276505
Energy: 0.8893728421301557
Energy: 0.7795761346717623
Energy: 0.7124569645514546
Energy: 0.8401605075369193
Energy: 0.8196507474951048
Energy: 0.8833882089908036
Energy: 0.8688206404339327
Energy: 0.8822106958940782
Energy: 0.8459624401112081
Energy: 0.8509990328662476
Energy: 0.8713911973850182
Energy: 0.8287242377209667
Energy: 0.8052021241710584
Energy: 0.8561619548883543
Energy: 0.8270182859678875
Energy: 0.7696564758468417
Energy: 0.7388218466868328
Energy: 0.8099287867207019
Energy: 0.7292704482250693
Energy: 0.8206283877442684
Energy: 0.8895551525039137
Energy: 0.7731627615219395
Energy: 0.8237532888365736
Energy: 0.8435768176722429
Energy: 0.8035614114631238
Energy: 0.7980683352541534
Energy: 0.6989632933373272
Energy: 0.7532473921844771
Energy: 0.7968740118981956
Energy: 0.80167035335654
Energy: 0.8282520918996609
Energy: 0.8765529303859296
Energy: 0.8963383660349238
Energy: 0.7897635835706256
Energy: 0.7593889953724434
Energy: 0.8237785397029579
Energy: 0.8008929799906318
Energy: 0.8039100354551532
Energy: 0.8704258232423662
Energy: 0.7555537067853093
Energy: 0.7638334276557212
Energy: 0.7715558311958614
Energy: 0.7396826206696251
Energy: 0.7135087950632335
Energy: 0.8213043485902894
Energy: 0.768004388995226
Energy: 0.6678574212387588
Energy: 0.7109730476627307
Energy: 0.8289531760801613
Energy: 0.896288869980775
Energy: 0.8723458379359731
Energy: 0.862915481479283
Energy: 0.7939719378505009
Energy: 0.7573631477736481
Energy: 0.6822210895881392
Energy: 0.8165663733931242
Energy: 0.7014952728648671
Energy: 0.7045809175487229
Energy: 0.6897376915846698
Energy: 0.7058807075292061
Energy: 0.8463034144883771
Energy: 0.67326681631137
Energy: 0.7797597446152494
Energy: 0.7575393769369434
Energy: 0.7330469891626122
Energy: 0.7374283495001995
Energy: 0.7680174701918369
Energy: 0.7083863637645084
Energy: 0.7436379464494951
Energy: 0.8261362637408105
Energy: 0.8057321548557732
Energy: 0.844145814816028
Energy: 0.8568334184666316
Energy: 0.8422293356843684
Energy: 0.8110959165573813
Energy: 0.7686885017919902
Energy: 0.7301380812561576
Energy: 0.7640965589675756
Energy: 0.756038261349439
Energy: 0.8377934279128759
Energy: 0.8277304413242308
Energy: 0.79427528819146
Energy: 0.79384639410499
Energy: 0.8524999475042414
Energy: 0.8591960365697915
Energy: 0.7999323043042345
Energy: 0.7931042416371562
Energy: 0.8350008594054809
Energy: 0.8106294548585778
Energy: 0.8258896656153178
Energy: 0.8010667121055569
Energy: 0.8598423828770844
Energy: 0.8462067032708408
Energy: 0.8235674749741528
Energy: 0.8876066980123583
Energy: 0.7237446319928972
Energy: 0.783600692981395
Energy: 0.8791577801718063
Energy: 0.8877443354340164
Energy: 0.7933178708239321
Energy: 0.788228409995435
Energy: 0.8074080927162973

minimum gb energy = 0.6567048323368287 eV
minimum distance =  2.46874741309589 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.8491841946619553
Energy: 0.8779724139862833
Energy: 0.8523431441423182
Energy: 0.880277104395879
Energy: 0.8184811885821816
Energy: 0.8378721669969778
Energy: 0.9095552391816992
Energy: 0.8868576312588974
Energy: 0.8952376616598058
Energy: 0.8503738121508975
Energy: 0.8719485360705869
Energy: 0.8802627194254747
Energy: 0.856835618685067
Energy: 0.8574598528236682
Energy: 0.8981118408426131
Energy: 0.8291471101326318
Energy: 0.809926742282357
Energy: 0.8249784239759789
Energy: 0.84296197902559
Energy: 0.8486781406809268
Energy: 0.8712908008983492
Energy: 0.8111187801207044
Energy: 0.8933808712499826
Energy: 0.8116262721862089
Energy: 0.8462308822172117
Energy: 0.8389110367561066
Energy: 0.8144627245927046
Energy: 0.8920957319704406
Energy: 0.7969883871799963
Energy: 0.8376611034434077
Energy: 0.8955149268445326
Energy: 0.8620686114559979
Energy: 0.8524517385997855
Energy: 0.8394715813820866
Energy: 0.8294928380160578
Energy: 0.7905004065567
Energy: 0.8247232200066787
Energy: 0.8166083417445411
Energy: 0.813419961659554
Energy: 0.807916848241572
Energy: 0.751147557343441
Energy: 0.7996146189136332
Energy: 0.8534164747922764
Energy: 0.8873084747011823
Energy: 0.8585197451126774
Energy: 0.7858916653783137
Energy: 0.8050673389135428
Energy: 0.8689349922664082
Energy: 0.8738618661298445
Energy: 0.8378485140002225
Energy: 0.7222728542297723
Energy: 0.8213165392712095
Energy: 0.8242206925116524
Energy: 0.8076271322972458
Energy: 0.803420353312328
Energy: 0.7520940067032772
Energy: 0.8013110397890927
Energy: 0.8537227498772494
Energy: 0.8235791935035943
Energy: 0.8101782462617447
Energy: 0.8142827383152852
Energy: 0.8138976427799035
Energy: 0.8496196949717322
Energy: 0.8261871050786265
Energy: 0.7835734751696732
Energy: 0.8296033263399244
Energy: 0.8546603487741766
Energy: 0.838845706867398
Energy: 0.8114359332919067
Energy: 0.7687700468997943
Energy: 0.8216421612143787
Energy: 0.772300979957507
Energy: 0.8055488314418506
Energy: 0.7641878611759143
Energy: 0.8207585652011645
Energy: 0.7756936537873812
Energy: 0.7636681149886436
Energy: 0.8200608641330207
Energy: 0.8576117411528638
Energy: 0.8174714319779888
Energy: 0.8021269991725957
Energy: 0.798717612922817
Energy: 0.8182351859734853
Energy: 0.8622015201700076
Energy: 0.8575300696558618
Energy: 0.7262742702838901
Energy: 0.795120225978657
Energy: 0.8044890290658033
Energy: 0.8059003170194163
Energy: 0.8094068417405351
Energy: 0.7240678743395654
Energy: 0.838553710511383
Energy: 0.7697036541476688
Energy: 0.8663206999086088
Energy: 0.8180054238273935
Energy: 0.7809748916172038
Energy: 0.8702449636960151
Energy: 0.7795437115343054
Energy: 0.7768688187293614
Energy: 0.8005740974317309
Energy: 0.8105316887627139
Energy: 0.8160642312155985
Energy: 0.8124783547553914
Energy: 0.7851999969345279
Energy: 0.8188571787601293
Energy: 0.783254681101707
Energy: 0.7887101520903562
Energy: 0.8727578808163592
Energy: 0.8132691646714085
Energy: 0.8059361484050633
Energy: 0.8394652203422251
Energy: 0.7859577499302335
Energy: 0.8537367875686319
Energy: 0.8971733803049108
Energy: 0.8258308357041021
Energy: 0.8225826093373967
Energy: 0.8394709144446044
Energy: 0.8366780323798457
Energy: 0.8907233074110343
Energy: 0.8281578786732386
Energy: 0.8033714034788892
Energy: 0.8129982678867391
Energy: 0.7969378748528597
Energy: 0.7886953638385138
Energy: 0.8293186905099521
Energy: 0.826104549250583
Energy: 0.8812560069544368
Energy: 0.8402574574131284
Energy: 0.8911026830233708
Energy: 0.8936316283475398
Energy: 0.8687723501644431
Energy: 0.926531355481075
Energy: 0.8672827209513385
Energy: 0.8405502697450834
Energy: 0.844437372068229
Energy: 0.8218948764277947
Energy: 0.841092836225739
Energy: 0.840329208227369
Energy: 0.8394741788603227
Energy: 0.8803173165943096
Energy: 0.8750015686923451
Energy: 0.8235328568189905
Energy: 0.8349772378879219
Energy: 0.8830067982025048
Energy: 0.8700836905707565
Energy: 0.7980235488317793
Energy: 0.8348953581726511
Energy: 0.8757971036490724
Energy: 0.8491554181793098
Energy: 0.8126308444811288
Energy: 0.9128566091610081
Energy: 0.8514889699956604
Energy: 0.8062068922924972
Energy: 0.8623729399585992
Energy: 0.851336141393476
Energy: 0.8753000036032749
Energy: 0.8372682035949203
Energy: 0.8387260844257637
Energy: 0.8550180200619691
Energy: 0.8426268925075182
Energy: 0.8699569833655503
Energy: 0.8879869688508043
Energy: 0.8744252442887049
Energy: 0.8539802615558948
Energy: 0.8775422556279401
Energy: 0.9188574091623765
Energy: 0.8794853221100701
Energy: 0.8604185562108926
Energy: 0.8504689636336389
Energy: 0.8232604825096299
Energy: 0.8259920692568784
Energy: 0.8367772652753175
Energy: 0.8301685713161638
Energy: 0.8373382172831559
Energy: 0.8089947948924848
Energy: 0.8064624251480914
Energy: 0.8994087279518136
Energy: 0.8168601180008326
Energy: 0.8222030215670312
Energy: 0.8357293871953518
Energy: 0.8186619141933014
Energy: 0.8815641179466601
Energy: 0.8029260518158091
Energy: 0.8267456418336095
Energy: 0.8767302312598556
Energy: 0.8415836066980998
Energy: 0.872223366821676
Energy: 0.860658840135901
Energy: 0.8273958415637555
Energy: 0.7721625907787951
Energy: 0.8304123759311522
Energy: 0.7987074049016718
Energy: 0.7719754494192561
Energy: 0.8167139046490873
Energy: 0.76997818245078
Energy: 0.8171593801694294
Energy: 0.8489277655050763
Energy: 0.8745291205977114
Energy: 0.8591670924513198
Energy: 0.8058647267395533
Energy: 0.8072285253780016
Energy: 0.8729842089291072
Energy: 0.8297284399689417
Energy: 0.8498061286311825
Energy: 0.7354880554130677
Energy: 0.799742133070265
Energy: 0.831162109751637
Energy: 0.8143910952574356
Energy: 0.800432699640492
Energy: 0.7377739286813271
Energy: 0.8101123278359159
Energy: 0.8673060256189076
Energy: 0.8206752272435278
Energy: 0.8392479231278016
Energy: 0.7980757224744208
Energy: 0.8086840943263489
Energy: 0.8395955989572048
Energy: 0.8189521455134596
Energy: 0.7755505292700065
Energy: 0.830167117208672
Energy: 0.715606612739981
Energy: 0.8073859690062244
Energy: 0.8010961150069684
Energy: 0.7722797570488299
Energy: 0.8318320504943801
Energy: 0.7588532148942201
Energy: 0.8110448647141408
Energy: 0.7675878058889514
Energy: 0.8550270164308853
Energy: 0.7779419741965914
Energy: 0.7742137850622669
Energy: 0.8271536254810894
Energy: 0.8728663829840196
Energy: 0.8133890810423101
Energy: 0.8077777191061009
Energy: 0.8007281867989691
Energy: 0.8142206466413786
Energy: 0.8624453186408928
Energy: 0.8546635277360177
Energy: 0.718678189185565
Energy: 0.7991478846839125
Energy: 0.8032988882236486
Energy: 0.8071984935989436
Energy: 0.8290531553380798
Energy: 0.7229532171937877
Energy: 0.8150456496465838
Energy: 0.845259117208225
Energy: 0.879109538963577
Energy: 0.8241218647880547
Energy: 0.7899003834710958
Energy: 0.8614312689054012
Energy: 0.8193896339878793
Energy: 0.7868824217431156
Energy: 0.8146174430487041
Energy: 0.7946068113447736
Energy: 0.8157306661221705
Energy: 0.796847159763341
Energy: 0.7818060464968256
Energy: 0.8283608408324968
Energy: 0.7937617008092622
Energy: 0.7898892960374553
Energy: 0.8768391890390819
Energy: 0.8601130256599039
Energy: 0.8536160743102607
Energy: 0.8190713161291556
Energy: 0.7815811177288366
Energy: 0.8312601245799481
Energy: 0.8832883937805108
Energy: 0.8210952165290774
Energy: 0.8268034284866771
Energy: 0.8129164231598255
Energy: 0.7925877378038229
Energy: 0.8843755568420855
Energy: 0.8326748193074788
Energy: 0.7936318925243713
Energy: 0.7969099547941076
Energy: 0.8097336471981921
Energy: 0.8261533643172642
Energy: 0.8257389482781347
Energy: 0.8059937400372011
Energy: 0.8631139014731691
Energy: 0.8631756700813735
Energy: 0.8752981079733918
Energy: 0.8771775554453729
Energy: 0.885701506859313
Energy: 0.8998116405959852
Energy: 0.8989126746899273
Energy: 0.8380241692586465
Energy: 0.8392502775979757
Energy: 0.8194807826149493
Energy: 0.865242392150304
Energy: 0.8115736941556919
Energy: 0.8346593233468618
Energy: 0.8993194585736461
Energy: 0.8859839620850896
Energy: 0.8308380432909833
Energy: 0.8162954806018833
Energy: 0.9199087168047593
Energy: 0.8162670447951142
Energy: 0.7952333297888079
Energy: 0.9137123511403487
Energy: 0.8600496115829319
Energy: 0.8154511589969747
Energy: 0.8325951631221864
Energy: 0.8862626511573274
Energy: 0.8288291534116042
Energy: 0.8014325190448057
Energy: 0.8738026368395057
Energy: 0.8445154328568765
Energy: 0.8544223007111781
Energy: 0.8439414410793364
Energy: 0.8624155760376915
Energy: 0.8271389788420046
Energy: 0.8462370971313822
Energy: 0.8969322041196879

minimum gb energy = 0.715606612739981 eV
minimum distance =  2.47832486630422 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.786200678699234
Energy: 0.8414332319336129
Energy: 0.7631829130023039
Energy: 0.7419740521600224
Energy: 0.738321111291734
Energy: 0.7616659856972987
Energy: 0.7325456612625331
Energy: 0.764603880609034
Energy: 0.9302392102700756
Energy: 0.7610115057508776
Energy: 0.7707371172748012
Energy: 0.7520611032521292
Energy: 0.7531806137531311
Energy: 0.913171724441475
Energy: 0.7679201140701587
Energy: 0.8593096061603958
Energy: 0.7584025934048498
Energy: 0.7458010419690358
Energy: 0.752678707531884
Energy: 0.7537128436713549
Energy: 0.7456172797300882
Energy: 0.7593191054370216
Energy: 0.843382169583292
Energy: 0.7514133796612422
Energy: 0.7494821998793691
Energy: 0.7488672126831616
Energy: 0.7398457416729771
Energy: 0.7365757035864645
Energy: 0.7750665016780243
Energy: 0.9595778909282052
Energy: 0.7050689615760403
Energy: 0.9313846616150118
Energy: 0.7629072044358015
Energy: 0.700624326240601
Energy: 0.9135036277775457
Energy: 0.7531736546569671
Energy: 0.8636614977592512
Energy: 0.7624726308260141
Energy: 0.7451757226353403
Energy: 0.7552483105619978
Energy: 0.7492092925079726
Energy: 0.7313581842015809
Energy: 0.7659893576895588
Energy: 0.9273338089422507
Energy: 0.748026548680032
Energy: 0.7503120224623122
Energy: 0.734319585966456
Energy: 0.758844390845697
Energy: 0.9248430928114515
Energy: 0.7603761726284433
Energy: 0.9247731611797837
Energy: 0.7502181522212298
Energy: 0.7524118099476884
Energy: 0.7642630989741548
Energy: 0.7451841064543687
Energy: 0.9168267614097046
Energy: 0.7616467335982845
Energy: 0.8494985243077611
Energy: 0.7726804465982643
Energy: 0.7388587673772414
Energy: 0.7501060906993405
Energy: 0.75364461454993
Energy: 0.7369686158841652
Energy: 0.7875145915474442
Energy: 0.9203011883393676
Energy: 0.7050445554211984
Energy: 0.8987457859613104
Energy: 0.9093185530645379
Energy: 0.7021211082449795
Energy: 0.9181649656389392
Energy: 0.7613111496467178
Energy: 0.8721458434348416
Energy: 0.7584506058841952
Energy: 0.760603183258458
Energy: 0.7522503541836698
Energy: 0.7517864251715438
Energy: 0.7490555923852023
Energy: 0.762370945643554
Energy: 0.9173440591844856
Energy: 0.7566952684010291
Energy: 0.7529607350425626
Energy: 0.7461615836056713
Energy: 0.76124933655655
Energy: 0.9177675929230109
Energy: 0.7706115642332099
Energy: 0.9235403545919365
Energy: 0.7592112859686233
Energy: 0.7587971359016755
Energy: 0.7496124790252744
Energy: 0.7443793220018711
Energy: 0.921149318957127
Energy: 0.7801493813820074
Energy: 0.8712897934541622
Energy: 0.7498716103705279
Energy: 0.7462384928684166
Energy: 0.7457490879400129
Energy: 0.748359165998469
Energy: 0.7364128366156235
Energy: 0.7846560964161943
Energy: 0.9235300675440116
Energy: 0.7050271410652974
Energy: 0.7433820375783123
Energy: 0.748332656415032
Energy: 0.7627671273908443
Energy: 0.9173388411361196
Energy: 0.757194644564941
Energy: 0.8779475012041001
Energy: 0.7482450525311726
Energy: 0.7435200157656752
Energy: 0.751446385200597
Energy: 0.7733536537542116
Energy: 0.7524536531366832
Energy: 0.7663591683807868
Energy: 0.8645360148572767
Energy: 0.7589543014078838
Energy: 0.7624729113248471
Energy: 0.750789180116557
Energy: 0.7455507525196687
Energy: 0.7442670295429039
Energy: 0.779144752364247
Energy: 0.9239512081194757
Energy: 0.7478584935984331
Energy: 0.7570388097826788
Energy: 0.7587413755489346
Energy: 0.7460451307879403
Energy: 0.9238474655861219
Energy: 0.7800884569472846
Energy: 0.8780985477942295
Energy: 0.7446511110266526
Energy: 0.7424401706526664
Energy: 0.7431960460014088
Energy: 0.7597360553433741
Energy: 0.7326253462342343
Energy: 0.7785786452718957
Energy: 0.9160175959528047
Energy: 0.7711166565184842
Energy: 0.7701912394051221
Energy: 0.7531410815575059
Energy: 0.7612962690188381
Energy: 0.9052848679796514

minimum gb energy = 0.700624326240601 eV
minimum distance =  2.49864452956147 Angstroms
sigma value = 23