Model name: model_name=EAM_Dynamo_OnatDurukanoglu_2014_CuNi__MO_592013496703_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615001678466797
cohesive_energy=3.5402785184955947
mass=63.546
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=[1.5555645091870378e-19, 2.23171989879762e-19, 2.75048867112048e-19, 3.17384782488864e-19, 3.53021997358926e-19, 3.8357550576930596e-19, 4.10072302942398e-19, 4.3322055095042997e-19, 4.53532946316282e-19, 4.7139881796201595e-19, 4.871209772714579e-19, 5.009381485630739e-19, 5.130506039161139e-19, 5.23618560993978e-19, 5.327814091638239e-19, 5.40657709496568e-19, 5.47345194766884e-19, 5.52933586866276e-19, 5.574997902731759e-19, 5.61112698582846e-19, 5.63833194507378e-19, 5.65717354228962e-19, 5.66814845223252e-19, 5.67170528436e-19, 5.667892103971079e-19, 5.65561943095464e-19, 5.63342928457374e-19, 5.59960733583e-19, 5.552086776865559e-19, 5.488432299196739e-19, 5.405663854284299e-19, 5.30019256646808e-19, 5.168413538321579e-19, 5.01263390419776e-19, 4.828319504222399e-19, 4.60739536816014e-19, 4.339928000880179e-19, 4.0135806423007197e-19, 3.6133569191275195e-19, 3.12113621363004e-19, 2.5113638084959795e-19, 1.7505061467757201e-19, 8.05712198765724e-20, -3.6953723410219794e-20, -1.85552882513442e-19, -3.74619338385246e-19, -6.1928292563348395e-19, -9.397807373222098e-19, -1.367021965074552e-18, -1.94092483972662e-18, -2.72467760554674e-18, -3.8083097719526395e-18, -5.24243409881238e-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: 0.015446961884515305
Energy: 0.020447237956382043
Energy: 0.10668742969826123
Energy: 0.10622647134657026
Energy: 0.019569556975434933
Energy: 0.01673392721805087
Energy: 0.10524807019585365
Energy: 0.10744243661175747
Energy: 0.1060287423863636
Energy: 0.018722620606782668
Energy: 0.016155261555851043
Energy: 0.10458070723136244
Energy: 0.10562167600954828
Energy: 0.1069564721981048
Energy: 0.10717944792077647
Energy: 0.10521937068965131
Energy: 0.10462594491748446
Energy: 0.10537253352376649
Energy: 0.10689519462788748
Energy: 0.10664354932076166
Energy: 0.1070590126048792
Energy: 0.01891952099753838
Energy: 0.01588339523713334
Energy: 0.10507375058454639
Energy: 0.10617697709063517
Energy: 0.10700376027703985
Energy: 0.018310098187389365
Energy: 0.01586100474240242
Energy: 0.10504693015897996
Energy: 0.10702584521405467
Energy: 0.10623581995200834
Energy: 0.017176719341927653
Energy: 0.01677790986474673
Energy: 0.10461961703314708
Energy: 0.10555349540380161
Energy: 0.10638450307385089
Energy: 0.017476103499242987
Energy: 0.016052785939828833
Energy: 0.10433944522537744
Energy: 0.10524825113804703
Energy: 0.10574261596278521
Energy: 0.10579233006256032
Energy: 0.10752955585420074
Energy: 0.01711337101929211
Energy: 0.016515311208527523
Energy: 0.10519145803086744
Energy: 0.10638894151926219
Energy: 0.10718550608443311
Energy: 0.017978567274975422
Energy: 0.10457390086032964
Energy: 0.10742937387447438
Energy: 0.10546442993191735
Energy: 0.10579574160303874
Energy: 0.016603462686055222
Energy: 0.015976175096586366
Energy: 0.10445554620578447
Energy: 0.10477286068736637
Energy: 0.10646649316636206
Energy: 0.0171193385522054
Energy: 0.016133824027854717
Energy: 0.016037445136159807
Energy: 0.10771701709113622
Energy: 0.10587803086404889
Energy: 0.1067683622271772
Energy: 0.10824871477903343
Energy: 0.016124823554621522
Energy: 0.10836663504428178
Energy: 0.1055960804791828
Energy: 0.10746050560721987
Energy: 0.10770542634738181

minimum gb energy = 0.015446961884515305 eV
minimum distance =  2.52128087439249 Angstroms
sigma value = 3


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

Energy: 1.1815084026044804
Energy: 0.843996416668904
Energy: 0.8181233715418631
Energy: 0.7975999981315605
Energy: 0.8317654330547316
Energy: 0.8348823042921842
Energy: 0.796339193089487
Energy: 0.8194158599425095
Energy: 0.8196274155108642
Energy: 0.843961561702882
Energy: 0.7087645885107126
Energy: 0.903506203517235
Energy: 0.8208424554951784
Energy: 0.7233877157945604
Energy: 0.7341774902191134
Energy: 0.7303962555207895
Energy: 0.8551469188716585
Energy: 0.8193817540820894
Energy: 0.7216620037417611
Energy: 0.7357296407622268
Energy: 0.7752558547229166
Energy: 0.8890910717189324
Energy: 0.7347087998153944
Energy: 0.7304940764901844
Energy: 0.7327141358134884
Energy: 0.7342271665532177
Energy: 0.9592564455876876
Energy: 0.7359910757223357
Energy: 0.7308167571827748
Energy: 0.8126933977627832
Energy: 0.814761044621495
Energy: 0.8257976441723048
Energy: 0.8465756723538908
Energy: 0.7309840613068814
Energy: 0.762430032358429
Energy: 0.7339692143564629
Energy: 0.8213941670375969
Energy: 0.8449184343996139
Energy: 0.7755572706460683
Energy: 0.7340609025622321
Energy: 0.905001809066306
Energy: 0.8481425778672673
Energy: 0.8808049698776971
Energy: 0.7083525096005997
Energy: 0.7207454377065878
Energy: 0.8548702852401071
Energy: 0.8472474454058669
Energy: 0.8786133443816859
Energy: 0.8220263825093459
Energy: 0.7624289147185142
Energy: 0.8823755798912623
Energy: 0.8859139669797688
Energy: 0.8910839896649713
Energy: 0.7073191633971467
Energy: 0.944047019928555
Energy: 0.8438552072689909
Energy: 0.8874342971036643
Energy: 0.8248548095821407
Energy: 0.7061039824129951
Energy: 0.8799309670383242
Energy: 0.9053300844441136
Energy: 0.8366731569938234
Energy: 0.9538924960770508
Energy: 0.7122640503326129
Energy: 0.8777235752697311
Energy: 0.8697281336299806
Energy: 0.9310700090891535
Energy: 0.8250111506791771
Energy: 0.711536301080262
Energy: 0.8757202324866609
Energy: 1.0197245355618911
Energy: 0.8759801354153819
Energy: 0.8575785990354319
Energy: 0.6321159432295926
Energy: 0.8761055342564917
Energy: 0.8788590914605529
Energy: 0.8767960875961437
Energy: 0.8592387033993222
Energy: 0.8315120713898633
Energy: 0.8751056557662742
Energy: 0.9463041840140559
Energy: 0.7727370547429546
Energy: 0.7071120482198211
Energy: 0.8927583120855623
Energy: 0.8357821873739337
Energy: 0.9477607782071812
Energy: 0.8460753856151477
Energy: 0.6401511821455923
Energy: 0.8791143651280354
Energy: 0.8719784232838466
Energy: 0.9196641194461744
Energy: 0.7587254463462026
Energy: 0.7069014030003983
Energy: 0.770341012446912
Energy: 0.7334393473586582
Energy: 0.698025566940363
Energy: 0.7574524292079821
Energy: 0.7083096271568404
Energy: 0.7033779035572786
Energy: 0.7488013694041543
Energy: 0.8463078783391312
Energy: 0.7081960717056126
Energy: 0.7563638519737825
Energy: 0.761127955076956
Energy: 0.7414961018599086
Energy: 0.7347642620111833
Energy: 0.7158245202551718
Energy: 0.7576143287985786
Energy: 0.7563995000584742
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Energy: 0.8860931943735688
Energy: 0.7335991150806794
Energy: 0.7726660830937868
Energy: 0.9581972367424626
Energy: 0.8394377464952962
Energy: 0.7645724032401527
Energy: 0.7154724857357888
Energy: 0.8023087014930649
Energy: 0.9692039956118008
Energy: 0.8385998141983264
Energy: 0.9417075281505273
Energy: 0.7621847088160467
Energy: 0.9123104636049647
Energy: 0.8472793951088682
Energy: 0.8860205044081384
Energy: 0.7630280252232919
Energy: 0.7621391393345037
Energy: 0.9123113957302166
Energy: 0.84869186060168
Energy: 0.8849005365162486
Energy: 0.7536000573435913
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Energy: 0.8433452226000534
Energy: 0.8442428530825051
Energy: 0.8417037304650601
Energy: 0.7535399989324161
Energy: 0.7636989443485459
Energy: 0.8426855732074897
Energy: 0.8440082253386049
Energy: 0.8321774011224355
Energy: 1.1410162204131848
Energy: 0.8455626130192884
Energy: 0.8420831525253529
Energy: 0.8424017480280112
Energy: 0.885695012872181
Energy: 0.885265456807275
Energy: 0.8462247000472954
Energy: 0.8431765456304497
Energy: 0.8436370298310518
Energy: 0.8841518592151688
Energy: 0.7095424745485899
Energy: 0.9092865516366604
Energy: 0.8424684396716502
Energy: 0.914360658456136
Energy: 0.7641444071408517
Energy: 0.7111956447533038
Energy: 0.844629042212849
Energy: 0.8435734762944406
Energy: 0.8428719007334152
Energy: 0.7567517783950665
Energy: 0.7597131990394829
Energy: 0.7790952780807936
Energy: 0.7332099017119722
Energy: 0.7628022816646356
Energy: 0.7660744535064553
Energy: 0.7593339750466853
Energy: 0.7795849556743403
Energy: 0.7356374088916948
Energy: 0.7619325254078162
Energy: 0.7672516971633527
Energy: 0.7661510617013829
Energy: 0.7345486626304798
Energy: 0.7335536871127704
Energy: 0.757197062761698
Energy: 0.6973607675814402
Energy: 0.7661881469955779
Energy: 0.7330629344493557
Energy: 0.7346598012114074
Energy: 0.7609892338358534
Energy: 0.7227530540589215
Energy: 0.8559311115844306
Energy: 0.8433044794591148
Energy: 0.8723652824080039
Energy: 0.8257337022837448
Energy: 0.7231707534598278
Energy: 0.9067576204989583
Energy: 0.8433122685788511
Energy: 0.8746061958851405
Energy: 0.706229639564934
Energy: 0.7533802914245014
Energy: 0.881810369988447
Energy: 0.8827277716893538
Energy: 0.8161810590406413
Energy: 0.7070622521648835
Energy: 0.8760252314037236
Energy: 0.8990801813893116
Energy: 0.8872858327480805
Energy: 0.8785664413509702
Energy: 0.813296171927654
Energy: 0.8807851895334149
Energy: 0.8776213108925149
Energy: 0.8653023439191128
Energy: 0.7713021647067065
Energy: 0.7136178786883356
Energy: 0.832470337118804
Energy: 0.8930337951259172
Energy: 0.8758122362843285
Energy: 0.7130826835497627
Energy: 0.7109018513855039
Energy: 0.8770238256629892
Energy: 0.8902625493511584
Energy: 0.8754589802618468
Energy: 0.7232579278257433
Energy: 0.638226302878542
Energy: 0.8765424093342518
Energy: 0.8763982387262095
Energy: 0.87606785308928
Energy: 0.6363053406591476
Energy: 0.6320090672800688
Energy: 0.8755058465500922
Energy: 0.9440150930706687
Energy: 0.7742072714178958
Energy: 0.6354368649631853
Energy: 0.859870383251238
Energy: 0.8723428440943575
Energy: 0.9460526258710801
Energy: 0.7732224325294956
Energy: 0.6405174226895927
Energy: 0.6576148568421524
Energy: 0.8712493982124891
Energy: 0.7624183604709405
Energy: 0.7112662981782432
Energy: 0.70892791327506
Energy: 0.7533523916604589
Energy: 0.7343200258182891
Energy: 0.7496692270964462
Energy: 0.7195561939431797
Energy: 0.7087289721515557
Energy: 0.7143060990127427
Energy: 0.7360775468094874
Energy: 0.732625110348612
Energy: 0.709669999277931
Energy: 0.7635725697701882
Energy: 0.760804630493166
Energy: 0.7412815218215605
Energy: 0.7717131432413301
Energy: 0.7076017104932703
Energy: 0.7596799922220892
Energy: 0.7622441502365308
Energy: 0.7350648969687783
Energy: 0.9898330874273432
Energy: 0.6599910307994512
Energy: 0.7143471153255968
Energy: 0.8513343309323396
Energy: 0.813767120631975
Energy: 0.7352164991458114
Energy: 0.7879780448620558
Energy: 0.7138430550711297
Energy: 1.0261363933843746
Energy: 0.8167501473010952
Energy: 0.8497771998536584
Energy: 0.8132094412070381
Energy: 0.8824709237423237
Energy: 0.8883466673284701
Energy: 0.882179253362293
Energy: 0.9155405164722041
Energy: 0.7329929790817171
Energy: 0.8491712034077143
Energy: 0.8893204404744018
Energy: 0.8817134129441093
Energy: 0.8057265511894429
Energy: 0.7335029560404879
Energy: 0.819266478063319
Energy: 0.8157197750557276
Energy: 0.7745516855958036
Energy: 0.7300665434130263
Energy: 0.7339605397183746
Energy: 0.8185570329803228
Energy: 0.7988519306985215
Energy: 0.8282283709389038
Energy: 0.8571372753810487
Energy: 0.7955206280682187
Energy: 0.8191522721056569
Energy: 0.7975437072600783
Energy: 0.8315876594695839
Energy: 0.8331625637381783
Energy: 0.7960344809599152
Energy: 0.8186806179452621
Energy: 0.8191828858984418
Energy: 0.8459937719291801

minimum gb energy = 0.6320090672800688 eV
minimum distance =  2.21827535921247 Angstroms
sigma value = 75


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

Energy: 1.7817416000746333
Energy: 0.913983322480829
Energy: 0.79597648124664
Energy: 0.8030201931373769
Energy: 0.9198890240665166
Energy: 0.8181729372560537
Energy: 0.9280292353170282
Energy: 0.7986698132906861
Energy: 0.8034354732503025
Energy: 0.920343234972364
Energy: 0.777874784650846
Energy: 0.808517070570689
Energy: 0.7990259205200662
Energy: 0.8029942182747388
Energy: 0.8247617788943974
Energy: 0.8739764151149352
Energy: 0.7954576564257559
Energy: 0.8028397845738683
Energy: 0.82930556265915
Energy: 0.7824522575608968
Energy: 0.7642004268422927
Energy: 1.0183487688536743
Energy: 0.7910586819636223
Energy: 0.82518089577427
Energy: 0.7829242739026699
Energy: 0.8156945152182183
Energy: 1.0056590910511767
Energy: 0.7912576356092009
Energy: 0.8415247001177264
Energy: 0.7687720256340872
Energy: 0.8376455770026763
Energy: 0.806230680464094
Energy: 0.8362251026074132
Energy: 0.8159871944735637
Energy: 0.808089962357507
Energy: 0.877468425729314
Energy: 0.8048076815174295
Energy: 0.7929443074064593
Energy: 0.8281691332880642
Energy: 0.8065964954126255
Energy: 0.8284709712173075
Energy: 0.7882416775824649
Energy: 0.9581960669862605
Energy: 0.8323021179997787
Energy: 0.7776530707316595
Energy: 0.8127194297725457
Energy: 0.7835751540912119
Energy: 0.9302955470957673
Energy: 0.8374170498165119
Energy: 0.8166104510055728
Energy: 0.7888251914925788
Energy: 0.8114218733749206
Energy: 0.9409817023608429
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Energy: 0.8164759805937168
Energy: 0.7731698936915451
Energy: 0.7892331294502946
Energy: 0.7857987914754344
Energy: 0.8061806962930186
Energy: 0.8084560709916223
Energy: 0.8072720240111102
Energy: 0.8274277470749891
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Energy: 0.8185360922789896
Energy: 0.820184899547799
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Energy: 0.8065959620001066
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Energy: 0.9957786508938689
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Energy: 0.8166055757078918
Energy: 0.811254310737005
Energy: 0.8656892963663085
Energy: 0.9960529976077118
Energy: 0.9954621387602027
Energy: 0.8134579312379232
Energy: 0.8071208202698312
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Energy: 0.8173147190105975
Energy: 0.7986295114833003
Energy: 0.8323556684240365
Energy: 0.8360496009240118
Energy: 0.7988042483191135
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Energy: 0.7920194267448379
Energy: 0.8102771936176624
Energy: 0.8493206148579016
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Energy: 0.7974612836334414
Energy: 0.8563803020781895
Energy: 0.7870538648987789
Energy: 0.8097904207948599
Energy: 0.8172196296393422
Energy: 0.7875130981637024
Energy: 0.8133700121613453
Energy: 0.8013068899504387
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Energy: 0.8770785190956256
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Energy: 0.8536972731822702
Energy: 0.9023959611036916
Energy: 0.8676701526696662
Energy: 0.8135567647396109
Energy: 0.8784895100455884
Energy: 0.792002401414541
Energy: 0.8861624145812782
Energy: 0.7976595386080352
Energy: 0.8651273401922845
Energy: 0.8509116902303037
Energy: 0.7926279050306404
Energy: 0.8272914243915054
Energy: 0.7991599321960781
Energy: 0.8871771920004408
Energy: 0.8696682548658538
Energy: 0.7922155063444946
Energy: 0.8233535831447393
Energy: 0.8466912888333912
Energy: 0.8161210363077669
Energy: 0.8136713604251112
Energy: 0.8163129733569355
Energy: 0.953930947118253
Energy: 0.8220955782736152
Energy: 0.8124950456377806
Energy: 0.8172363035432516
Energy: 0.8269459907900596
Energy: 0.9784619344971036
Energy: 0.8324434663427752
Energy: 0.8119323378410979
Energy: 0.8006675438478638
Energy: 0.8111209601946863
Energy: 0.8056667893011119
Energy: 0.8103755628862334
Energy: 0.8310889115332301
Energy: 0.8126724540141406
Energy: 0.8167471213667759
Energy: 0.8004552199016262
Energy: 0.8748284280197309
Energy: 0.8237122790453594
Energy: 0.800060864096156
Energy: 0.8962230097189234
Energy: 0.7789431416914734
Energy: 0.8385025055967223
Energy: 0.8341536010705569
Energy: 0.792084983946094
Energy: 0.8882682714284178
Energy: 0.7912013514384254
Energy: 0.8796432378588095
Energy: 0.8861574752263333
Energy: 0.8624192333235969
Energy: 0.87074767304738
Energy: 0.8002342491283357
Energy: 0.9051923202085059
Energy: 0.8864223281366015
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Energy: 0.8775055003924026
Energy: 0.7990599200313686
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Energy: 0.8177883423021909
Energy: 0.865972042026872
Energy: 0.861397294470386
Energy: 0.8148207157862
Energy: 0.8381937445714721
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minimum gb energy = 0.7642004268422927 eV
minimum distance =  2.2848905088323 Angstroms
sigma value = 105


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

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Energy: 0.864365918126532
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Energy: 0.8487097916372622
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Energy: 0.939612537571283
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Energy: 0.8832909595559864
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Energy: 0.8918564810596223
Energy: 0.9360114571162297
Energy: 0.8913305160186623
Energy: 0.8294652863650059
Energy: 1.0065898061314045
Energy: 0.8595659892940154
Energy: 0.8903369084070346
Energy: 0.893710513938289
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Energy: 0.9376687293474159
Energy: 0.8597085038433188
Energy: 0.8433283557956169
Energy: 0.9046861324333871
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Energy: 0.8618054075197265
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Energy: 0.866677753768437
Energy: 0.8784646697078784
Energy: 0.8796125154523754
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Energy: 0.8836814622686964
Energy: 0.9695226126530179
Energy: 0.8429704140898779
Energy: 0.8582028157768822
Energy: 0.9256044634351439
Energy: 0.9016645986079006
Energy: 0.8393547068978222
Energy: 0.9052325858867166
Energy: 0.9057065580521075
Energy: 0.827160864171345
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Energy: 0.8387506729623881
Energy: 0.8705414358943769
Energy: 0.8284105996012826
Energy: 0.9069998348961726
Energy: 0.9153526523400611
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Energy: 0.8274539624566354
Energy: 0.9079775829279775
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Energy: 0.8666706654272021
Energy: 0.8864873100435582
Energy: 0.9156696637701929
Energy: 0.9084028425462691
Energy: 0.909765070246165
Energy: 0.8845580444646964
Energy: 0.9566323546148717
Energy: 0.9348842024237188
Energy: 0.9104440198026612
Energy: 0.9081821861056557
Energy: 0.8746973240700131
Energy: 0.9572602173175504
Energy: 0.9286516844595823
Energy: 0.9139699950446102
Energy: 0.8987654483233489
Energy: 0.9073535796330024
Energy: 0.9056454711934222
Energy: 0.930760440069435
Energy: 0.9146668927289248
Energy: 0.8312605339248305
Energy: 0.906196937518687
Energy: 0.9463873765561652
Energy: 0.9446425124986845
Energy: 0.9168401410539759
Energy: 0.8755548760460803
Energy: 0.9121097579166126
Energy: 0.9255141754325111
Energy: 0.9134370039451625
Energy: 0.9101024026771282
Energy: 0.8780552139666229
Energy: 0.9236784862686568
Energy: 0.8401222288296533
Energy: 0.9489128682573943
Energy: 0.8539983452841867
Energy: 0.9166670737504884
Energy: 0.9166537741126682
Energy: 0.8399028909382634
Energy: 0.9119127161227463
Energy: 0.813901079530299
Energy: 0.9139383795694538
Energy: 0.9140162218944788
Energy: 0.883448017168967
Energy: 0.8512086827060479
Energy: 0.8545078864320899
Energy: 0.9213492512494724
Energy: 0.9299350646846983
Energy: 0.8365541011787584
Energy: 0.904941273830264
Energy: 0.8509112841550578
Energy: 0.9111039206211959
Energy: 0.894700627922665
Energy: 0.8431328773656809
Energy: 0.9471769064742388
Energy: 0.9337330201331485
Energy: 0.9304479884889698
Energy: 0.9510213918903957
Energy: 0.9548278323938014
Energy: 0.8467685131739147
Energy: 0.9338166578821281
Energy: 0.9409454692292182
Energy: 0.9443235737406839
Energy: 0.9497390959223401
Energy: 0.9168598159347302
Energy: 0.8639572068128821
Energy: 0.8457804387996976
Energy: 0.835654583193299
Energy: 0.9329546540288159
Energy: 0.8186718869963187
Energy: 0.8604010290028586
Energy: 0.862323083181841
Energy: 0.8350262052886949
Energy: 0.8816425565925813
Energy: 0.828591128246652
Energy: 0.8348784748079917
Energy: 0.8514756016307774
Energy: 0.8353336241848001
Energy: 0.8377122297590129
Energy: 0.8339749831465584
Energy: 0.8355261816661127
Energy: 0.8453777434355703
Energy: 0.8353233263285226
Energy: 0.9343509006843722

minimum gb energy = 0.8047469660873023 eV
minimum distance =  2.28088238246569 Angstroms
sigma value = 165


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

Energy: 1.11557440088528
Energy: 0.8030050541247046
Energy: 0.8115648054429537
Energy: 0.8552881343941764
Energy: 0.8030629229464916
Energy: 1.1150928017371833
Energy: 0.8135258345223677
Energy: 0.8118420280420989
Energy: 0.8554018404021781
Energy: 0.8022918131440223
Energy: 0.8668594001743667
Energy: 0.8520011632213654
Energy: 0.8562880812343898
Energy: 0.8549802714690979
Energy: 0.9058096024160106
Energy: 0.8507228545311455
Energy: 0.8516972865099663
Energy: 0.8556118466663476
Energy: 0.8561046464936478
Energy: 0.8999571650849165
Energy: 0.859136194214805
Energy: 0.9077952871975938
Energy: 0.8091560039446989
Energy: 0.8630527162116003
Energy: 0.8925107236224266
Energy: 0.860071041453963
Energy: 0.8650658077211711
Energy: 0.864060988159753
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Energy: 0.8960186890101689
Energy: 0.8027783887075205
Energy: 0.8558998052400888
Energy: 0.8595661863865717
Energy: 0.8126793829809947
Energy: 0.8984431116270062
Energy: 0.861364724712571
Energy: 0.8585989879647445
Energy: 0.8596877237393401
Energy: 0.8133856266021743
Energy: 0.895888567878146
Energy: 0.851187818882193
Energy: 0.874250969639972
Energy: 0.8545009914215957
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Energy: 0.8598445373792818
Energy: 0.8068745798413255
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Energy: 0.8497259756604063
Energy: 0.8536988861264806
Energy: 0.9258863348419534
Energy: 0.8587287060238004
Energy: 0.8117654499355478
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Energy: 0.8563993917223881
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Energy: 0.8037311785131405
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Energy: 0.8499959761183736
Energy: 0.8511402207832807
Energy: 0.8020454774253237
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Energy: 0.8517152170245332
Energy: 0.8107078743342925
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Energy: 0.853178494851252
Energy: 0.8047737629071815
Energy: 0.8517186633013735
Energy: 0.8114740520643484
Energy: 0.8507183001581232
Energy: 0.8895110731343704
Energy: 0.9007975503902189
Energy: 0.854167514437615
Energy: 0.8597369836808496
Energy: 0.8585474959378945
Energy: 0.8505480197683708
Energy: 0.9003210426263784
Energy: 0.8544865631754434
Energy: 0.858055550151803
Energy: 0.8593039185339792
Energy: 0.8518341275350151
Energy: 0.8885723674628223
Energy: 0.8589821120169681
Energy: 0.8609981115862018
Energy: 0.8586649723463948
Energy: 0.891944481400527
Energy: 0.861338927075434
Energy: 0.8589577003825719
Energy: 0.8612228270951515
Energy: 0.8588922504257742
Energy: 0.8978255524327321
Energy: 0.8617105016351423
Energy: 0.8542256538494838
Energy: 0.8617280989785674
Energy: 0.8588768230368095
Energy: 0.8603443918430174
Energy: 0.8612986952756017
Energy: 0.8513780156210077
Energy: 0.8608856030245113
Energy: 0.8573746201837157
Energy: 0.8615556822101373
Energy: 0.8590884881655346
Energy: 0.8068618157051234
Energy: 0.8804175909833749
Energy: 0.8504703571952504
Energy: 0.8109503294397082
Energy: 0.8094279809897271
Energy: 0.8537751740916592
Energy: 0.8521208282925908
Energy: 0.8508511362017657
Energy: 0.811065556380962
Energy: 0.8585829403288735
Energy: 0.8525521416337408
Energy: 0.8492404993067786
Energy: 0.8027041387924805
Energy: 0.8512681009249456
Energy: 0.9060565194742709
Energy: 0.8517233346735756
Energy: 0.8128961740929662
Energy: 0.8026686986239017
Energy: 0.8509421721929362
Energy: 0.8018308671860312
Energy: 0.8516687495397297
Energy: 0.857198760319632
Energy: 0.8123420081001587
Energy: 0.851428597047887
Energy: 0.8584678680676091
Energy: 0.8574277607311472
Energy: 0.8563625027987998
Energy: 0.8120133833687605
Energy: 0.851163493974073

minimum gb energy = 0.8018308671860312 eV
minimum distance =  2.29268594024106 Angstroms
sigma value = 41


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

Energy: 1.0815675710093116
Energy: 0.7456985146256475
Energy: 0.7526490331925032
Energy: 0.7464150554362086
Energy: 0.7335978405656531
Energy: 0.7926703830270504
Energy: 0.7482239459236629
Energy: 0.753585470098094
Energy: 0.7520611126488564
Energy: 0.8019142463879293
Energy: 0.8094272132256082
Energy: 0.7623713165922816
Energy: 0.7560346722966614
Energy: 0.7617018127350366
Energy: 0.8005605602922796
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Energy: 0.7463374592773995
Energy: 0.759649178224354
Energy: 0.7594920376611758
Energy: 0.7772683738732772
Energy: 0.7759522563525069
Energy: 0.7983441898919874
Energy: 0.8050912869349114
Energy: 0.7786644190807966
Energy: 0.7698969220092658
Energy: 0.7872943504972073
Energy: 0.8059507553485264
Energy: 0.8073331801381853
Energy: 0.7867157272836731
Energy: 0.7548411238805499
Energy: 0.8195556624393114
Energy: 0.7564419485622473
Energy: 0.798213364213864
Energy: 0.8018761603375502
Energy: 0.8127069279628093
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Energy: 0.7595925899411907
Energy: 0.778410577764229
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Energy: 0.8018974096593516
Energy: 0.8147208801279074
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Energy: 0.7989309673304301
Energy: 0.8103435202620295
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Energy: 0.7757782783107764
Energy: 0.7798562461041522
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Energy: 0.8144221749545197
Energy: 0.8334801005293836
Energy: 0.7608431775103491
Energy: 0.795352907890444
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Energy: 0.8179157331766117
Energy: 0.8193750009787206
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Energy: 0.7528059145410546
Energy: 0.7976205313198815
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Energy: 0.797482875833579
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Energy: 0.810228596388036
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Energy: 0.7524115929420562
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Energy: 0.8148432842303467
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Energy: 0.7813959964354038
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Energy: 0.7526340333010479
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Energy: 0.751335723966577
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Energy: 0.7667102772587489
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Energy: 0.7694765648873374
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Energy: 0.7656338813162568
Energy: 0.80447692799617
Energy: 0.776935795391285
Energy: 0.7666908711312951
Energy: 0.7699756550835333
Energy: 0.7777771073547702
Energy: 0.8160678845905599
Energy: 0.7893511471051786
Energy: 0.7783535494369119
Energy: 0.7707442294914922
Energy: 0.7630850747529505
Energy: 0.8278405546125349
Energy: 0.794763559542838
Energy: 0.7661587909203681
Energy: 0.7727415379685608
Energy: 0.7636216710954304
Energy: 0.812249787629882
Energy: 0.7840659575595358
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Energy: 0.8099364171569507
Energy: 0.7678796631741986
Energy: 0.7993543881606926
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Energy: 0.808919312915719
Energy: 0.7680256310957985
Energy: 0.8001567573525747
Energy: 0.8097158908005283
Energy: 0.7999666763112299
Energy: 0.7942158403942389
Energy: 0.7789901858408104
Energy: 0.7671414591443642
Energy: 0.796281567765485
Energy: 0.7992386397736495
Energy: 0.7943901956718674
Energy: 0.7738755613771349
Energy: 0.7677475576805591
Energy: 0.7667358473463411
Energy: 0.7963053806349629
Energy: 0.8121963987298539
Energy: 0.8199195082282266
Energy: 0.8180150082511057
Energy: 0.7637021551173476
Energy: 0.7967508626823945
Energy: 0.8007150853527751
Energy: 0.8147063991781035
Energy: 0.8173911446248247
Energy: 0.8225211241954485
Energy: 0.8146323391865681
Energy: 0.8005289368828089
Energy: 0.830075894592233
Energy: 0.8149407992794666
Energy: 0.7980524664816194
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Energy: 0.8178921841571308
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Energy: 0.8159298264401674
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Energy: 0.7567209933365051
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Energy: 0.8110943202674336
Energy: 0.7889575101035883
Energy: 0.7732632774047515
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Energy: 0.7933506351229973
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Energy: 0.7823839700411728
Energy: 0.7472925043952976
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Energy: 0.7964730947964479
Energy: 0.809415337161587
Energy: 0.7829613751133272
Energy: 0.7678754649996722
Energy: 0.7918687568064086
Energy: 0.8138056116995566
Energy: 0.7415045127552399
Energy: 0.742619418960473
Energy: 0.7630976603055335
Energy: 0.7792160445662463
Energy: 0.831637876219458
Energy: 0.7639158239699625
Energy: 0.762899455261825
Energy: 0.7451755777509752
Energy: 0.7511168076247782
Energy: 0.7591229802047054
Energy: 0.7503372734128926
Energy: 0.7485032872197758
Energy: 0.7539089873994801
Energy: 0.7512859408889488
Energy: 0.7850085645158824
Energy: 0.7523868229306498
Energy: 0.7671534436806965
Energy: 0.7615540457085188
Energy: 0.7542387850806022
Energy: 0.816320067335797
Energy: 0.757118949046129
Energy: 0.7523775382617414
Energy: 0.752249041371233
Energy: 0.76882120327796
Energy: 0.8022907593529942
Energy: 0.760664452347081
Energy: 0.7595821707748409
Energy: 0.7462381273471489
Energy: 0.7537146195881761
Energy: 0.766779801357361
Energy: 0.7608603018662559
Energy: 0.7625221894863977
Energy: 0.7590274560795104
Energy: 0.7690490571766111
Energy: 0.7457816762041387
Energy: 0.7557563165053321
Energy: 0.7527549073776194
Energy: 0.8016130967430006

minimum gb energy = 0.7335978405656531 eV
minimum distance =  2.34528662193743 Angstroms
sigma value = 185


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

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Energy: 0.5651561557219834
Energy: 0.5656286170821038
Energy: 0.6167293365716249
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Energy: 0.5193118386200558
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Energy: 0.5970340795590141
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Energy: 0.5196075580017794
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Energy: 0.3970286354587848
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Energy: 0.6005670861203845
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Energy: 0.5965117278959728
Energy: 0.5771203608989433
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Energy: 0.5458396966195368
Energy: 0.6458919428892762
Energy: 0.5966176211716389
Energy: 0.5167526755879026
Energy: 0.5185365095230827
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Energy: 0.6360645188721806
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Energy: 0.5713684356515958
Energy: 0.5679837247121863
Energy: 0.6411867624098717
Energy: 0.5906696818752856
Energy: 0.5042844197549985
Energy: 0.516832405266611
Energy: 0.6526971644853177
Energy: 0.5933956287766285
Energy: 0.4518969447522028
Energy: 0.47248406699348483
Energy: 0.5878807053711508
Energy: 0.6304924339837191
Energy: 0.56767995623462
Energy: 0.5016934422592345
Energy: 0.5089607301705235
Energy: 0.588730895458727
Energy: 0.6685899102281021
Energy: 0.6349517641738346
Energy: 0.5675892704778649
Energy: 0.588857692854128
Energy: 0.6342972294634481
Energy: 0.6706827664511904
Energy: 0.5992156200842434
Energy: 0.5241390391336694
Energy: 0.5875852854373704
Energy: 0.5786041196800571
Energy: 0.6695874015843543
Energy: 0.6107706637277727
Energy: 0.5964830987464388
Energy: 0.5882299017931456
Energy: 0.6254524478989157
Energy: 0.5923025658400578
Energy: 0.5223849320283042
Energy: 0.5020809216820372
Energy: 0.5901143183706957
Energy: 0.5959117130280189
Energy: 0.5840487920122798
Energy: 0.5255803581772969

minimum gb energy = 0.35494074739361087 eV
minimum distance =  2.31297098034757 Angstroms
sigma value = 33


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

Energy: 0.7446629093249674
Energy: 0.707093742386557
Energy: 0.7228122551174322
Energy: 0.7257424995650842
Energy: 0.6945435426349233
Energy: 0.6926808023797667
Energy: 0.701106690318588
Energy: 0.7297735829297809
Energy: 0.7165557969573999
Energy: 0.7033042010925079
Energy: 0.7044192600987201
Energy: 0.7200926503936506
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Energy: 0.7120012101066421
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Energy: 0.7248413997876063
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Energy: 0.727607272981858
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Energy: 0.7021337133093902
Energy: 0.7075643347748339
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Energy: 0.735576862960314
Energy: 0.6999938598648344
Energy: 0.7283317456070217
Energy: 0.736338949927777
Energy: 0.724074993565887
Energy: 0.707411654485562
Energy: 0.7152915718204705
Energy: 0.7000593190847869
Energy: 0.7305693384750346
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Energy: 0.7240347718924102
Energy: 0.7206989840838315
Energy: 0.7176333686138321
Energy: 0.7213784768099871
Energy: 0.7312520611510481
Energy: 0.7118791928892642
Energy: 0.6956397032106351
Energy: 0.7223291685428392
Energy: 0.7333960686168184
Energy: 0.7299276597884925
Energy: 0.7127829488104472
Energy: 0.7099781436031728
Energy: 0.7239460391234886
Energy: 0.7177061038255207
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Energy: 0.7134457219357
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Energy: 0.7153647554967524
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Energy: 0.7121953609576518
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Energy: 0.7804252816503794
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Energy: 0.7130868240762291
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Energy: 0.726242692417519
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Energy: 0.7096507365599695
Energy: 0.7292719958974011
Energy: 0.7122992055688481
Energy: 0.7121460152283501
Energy: 0.7286580103015436
Energy: 0.7018519557081858
Energy: 0.7039621044551367
Energy: 0.723255134353915
Energy: 0.7114508204586614
Energy: 0.7276935871916244
Energy: 0.7183266892773582
Energy: 0.7033765821794732
Energy: 0.7240761223868251
Energy: 0.7444124248730604
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Energy: 0.7022086609245792
Energy: 0.7267008327383164
Energy: 0.7354482562245642
Energy: 0.7103726822613634

minimum gb energy = 0.692447886998617 eV
minimum distance =  2.33032863816449 Angstroms
sigma value = 219


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

Energy: 0.8929981020164548
Energy: 0.9031821977006937
Energy: 0.9220933977967521
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Energy: 0.9046378314471475
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Energy: 0.9409614605605919
Energy: 0.9196462110875844
Energy: 0.9024132656712718
Energy: 0.9060858276422656
Energy: 0.9102089540579
Energy: 0.907733008217839
Energy: 0.9207625861122233
Energy: 0.9038391564306898
Energy: 0.9025555928227089
Energy: 0.90969545621273
Energy: 0.9093354255339742
Energy: 0.9036878332835024
Energy: 0.9203864307906219
Energy: 0.898458895286691
Energy: 0.8996513431691859
Energy: 0.9075802431459052
Energy: 0.905115429868136
Energy: 0.9204773561745275
Energy: 0.8974814423584204
Energy: 0.901231144289704
Energy: 0.9070785214553769

minimum gb energy = 0.8844468837376398 eV
minimum distance =  2.33280587152694 Angstroms
sigma value = 15


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

Energy: 1.5243821618230278
Energy: 1.015536042790693
Energy: 1.0513520015388347
Energy: 1.0048289350159958
Energy: 1.0297667696676014
Energy: 0.9800725987287624
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Energy: 1.021363049895897
Energy: 1.001426591540691
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Energy: 1.0053822042773752
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Energy: 1.0017710111005942
Energy: 1.0015002009396012
Energy: 1.0075789477512909
Energy: 1.008820336545074
Energy: 1.026344685478675
Energy: 1.0039822284695534
Energy: 1.0106742778541586
Energy: 1.0030482816599062
Energy: 1.0151048308274615
Energy: 1.0289867447664
Energy: 1.004147437123958
Energy: 1.0012792213125108
Energy: 1.0036904424969948
Energy: 1.015485731915305
Energy: 1.0031680045613511
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minimum gb energy = 0.9738269032736084 eV
minimum distance =  2.31997210606693 Angstroms
sigma value = 293


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

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Energy: 1.044901901019354
Energy: 1.0718286360392941
Energy: 0.9754132712328659
Energy: 1.0427510049370758
Energy: 1.0203301881210582
Energy: 1.0461707687349022
Energy: 1.0304985221674061
Energy: 0.9761380240972608
Energy: 1.0185953186193988
Energy: 1.0126088980502357
Energy: 1.055110959549795
Energy: 0.9765801361400506
Energy: 0.9767957955637729
Energy: 1.0435569774689577
Energy: 1.007978547768288
Energy: 1.0570623044593592
Energy: 0.9769519550894866
Energy: 0.9749588523203642
Energy: 1.0427762892948111
Energy: 0.9517551197943536
Energy: 1.0262260629372613
Energy: 0.9778742999034993
Energy: 0.9747075799113237
Energy: 1.025424689960834
Energy: 0.955403240543499
Energy: 1.0269318598522328
Energy: 0.9784639908958782
Energy: 0.9749073154302772
Energy: 1.0184657240983226
Energy: 1.0187218686637967
Energy: 0.991498575414742
Energy: 0.9745141402823851
Energy: 0.9778994043362551
Energy: 1.0063197686488599
Energy: 1.0185728948781057
Energy: 0.9915977741666311
Energy: 0.9759039143021601
Energy: 0.9767825721173364
Energy: 1.007059813812269
Energy: 1.0272266370386476
Energy: 0.9919493098374829
Energy: 0.9868447937117483
Energy: 1.0520649205288686
Energy: 1.0172960166518867
Energy: 1.0280303824581032
Energy: 0.9913154675962536
Energy: 0.9875057979735435
Energy: 1.0534273720135001
Energy: 0.9822300259887624
Energy: 1.0731825906137618
Energy: 0.9779813229414692
Energy: 0.9792799362837877
Energy: 0.996533636887451
Energy: 1.022817274133236
Energy: 1.0743527152726817
Energy: 0.9781516849663708
Energy: 0.9794499642254874
Energy: 0.9971709902846562
Energy: 1.0214342725660015
Energy: 1.0310650697293342
Energy: 0.9797744655841484
Energy: 1.0531947394654233
Energy: 1.0087358143664495
Energy: 1.0054760237920077
Energy: 1.0300768530999995
Energy: 0.9796069431926372
Energy: 1.0141782393271521
Energy: 1.0081195242500685
Energy: 1.0053962877806424
Energy: 1.0046224794645988
Energy: 0.986930745035401
Energy: 1.0221739745534903
Energy: 1.007973479894072
Energy: 1.0036590286369642
Energy: 1.0049397480090123
Energy: 0.9872190769348897
Energy: 1.0067564952810786
Energy: 1.0086775745210854
Energy: 1.0049220486744306
Energy: 0.9948482413446929
Energy: 0.9932087256942319
Energy: 1.016491222119896
Energy: 1.0029093149155772
Energy: 1.018055794357207
Energy: 0.9941220826206134
Energy: 0.9940295819368788
Energy: 1.016432610590248
Energy: 1.0026486358831128
Energy: 1.017759299473491
Energy: 0.9842573753375669
Energy: 0.9956053300580885
Energy: 1.0270908814419157
Energy: 1.0139773468025333
Energy: 1.0033639429092887
Energy: 0.9840399808186728
Energy: 1.0418231854203555
Energy: 1.028489672602532
Energy: 1.0128152554032095
Energy: 1.009292093923625
Energy: 1.0265767993802803
Energy: 0.9772107412838814
Energy: 1.0296386439047884
Energy: 1.0438216041919492
Energy: 1.038340315738245
Energy: 1.0234664988079496
Energy: 1.0440611760826735
Energy: 1.0294798629621478
Energy: 1.0422933019588512
Energy: 1.0351254542997261
Energy: 0.976370962261516
Energy: 0.9736169662184203
Energy: 1.0544971193303447
Energy: 1.0086298854898794
Energy: 0.9744196594933457
Energy: 1.015106391686935
Energy: 0.9737156148484873
Energy: 1.004777176075597
Energy: 1.0115186508632767
Energy: 0.9743162728264332
Energy: 1.0028854797361084
Energy: 0.9768612226171499
Energy: 0.9513801723717472
Energy: 0.9518300387119716
Energy: 0.9774942540788385
Energy: 1.0026633266555922
Energy: 0.9878428676645371
Energy: 0.9513908654382982
Energy: 0.9514721334705486
Energy: 0.9777113033138182
Energy: 0.9758035757056133
Energy: 0.9762216994047461
Energy: 1.0073856762628501
Energy: 0.9913305672782261
Energy: 0.9738215304547939
Energy: 0.9761849202485734
Energy: 0.9752928803342713
Energy: 1.0056816098314916
Energy: 0.9895439523145416
Energy: 0.9735608734550558
Energy: 0.9852955378722807
Energy: 0.9789755299182603
Energy: 0.9803400844794025
Energy: 1.0118112583288523
Energy: 0.9747426391147311
Energy: 0.9855707667722061
Energy: 0.9788242093789076
Energy: 0.9782750249403159
Energy: 1.0109251700936845
Energy: 0.9751087078847388
Energy: 0.9693074919696393
Energy: 1.0049495271087927
Energy: 1.0162406264681563
Energy: 1.0005427956806658
Energy: 0.9698906993534426
Energy: 1.002021884167365
Energy: 1.002254810431355
Energy: 1.0470925789977474
Energy: 1.0091117989714364
Energy: 0.9655641509427786
Energy: 1.0608538448602312
Energy: 0.9970970721084186
Energy: 0.9960275898120154
Energy: 1.0484829524151866
Energy: 0.9691158482125646
Energy: 1.0577984663679185
Energy: 0.9971317075592353
Energy: 0.9955781309456208
Energy: 1.0020544485033798
Energy: 0.970129552428979
Energy: 0.9993904546041679
Energy: 1.0030666235694543
Energy: 0.9978244116053104
Energy: 1.051210650482295
Energy: 0.9739033124658881
Energy: 0.9974862095348237
Energy: 1.0027898296884414
Energy: 0.9974556622846887
Energy: 1.0010336529949782
Energy: 0.9741193870027915
Energy: 1.0035492625350144
Energy: 1.0256849019905958
Energy: 1.028680271162187
Energy: 0.9938967015396477
Energy: 0.994267633634743
Energy: 1.0012993337959843
Energy: 1.0274791527008038
Energy: 1.0287846061682382
Energy: 0.9932339565351677
Energy: 0.9947586550493648
Energy: 1.0014768266332312
Energy: 1.0127020641606996
Energy: 1.0016125635091353
Energy: 0.9870713868772523
Energy: 1.0426954205361274
Energy: 1.0031715277456528
Energy: 1.0133600844321662
Energy: 1.0411194180944243
Energy: 0.9860544165673705
Energy: 1.0337842423613608
Energy: 1.0021732834470667
Energy: 1.0357481487827418
Energy: 0.9979927857970826
Energy: 0.9963276159937133
Energy: 1.0473517583944083
Energy: 0.999482521748926
Energy: 1.0361004863007157
Energy: 1.0885903377443706
Energy: 0.9973124601421475
Energy: 1.0778778682174803
Energy: 0.9631496996760707
Energy: 1.0008631824443917
Energy: 0.9953939188005317
Energy: 0.9976917414649135
Energy: 1.052018529574394
Energy: 1.0227714718003291
Energy: 1.001437358823437
Energy: 0.9950363882117453
Energy: 0.9981690064404177
Energy: 1.026482346445023

minimum gb energy = 0.950930602145772 eV
minimum distance =  2.28326289696219 Angstroms
sigma value = 293


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

Energy: 0.9341680697560446
Energy: 0.9414223244469553
Energy: 1.0230867722245514
Energy: 0.9521855428896268
Energy: 0.9401646693072028
Energy: 0.9342641362753968
Energy: 0.9539773856027915
Energy: 1.0227610205372153
Energy: 0.9525401302349068
Energy: 0.9387087422731829
Energy: 0.935291305271417
Energy: 0.947054759024117
Energy: 0.9461139098184197
Energy: 0.9456699209334221
Energy: 0.9476639104104342
Energy: 1.0117452325763947
Energy: 0.9470658171720091
Energy: 0.9384553383438349
Energy: 0.9457243815903519
Energy: 0.9480839935132477
Energy: 0.9487280619071129
Energy: 0.9471099154283655
Energy: 0.9481013301036543
Energy: 0.9520478868472976
Energy: 1.0127666010470893
Energy: 0.9471514289370333
Energy: 0.9463356388370979
Energy: 0.9472553308743688
Energy: 1.0245954643363246
Energy: 1.0131657071783473
Energy: 1.0269140261924328
Energy: 0.9351939746957609
Energy: 0.9367379510753253
Energy: 0.9471635901435687
Energy: 1.0190385264911659
Energy: 1.0254224947494226
Energy: 0.9349287097716953
Energy: 0.9381058666153508
Energy: 0.9474797369327392
Energy: 0.9342161140874492
Energy: 0.9477630754797259
Energy: 0.94047466016255
Energy: 0.9345133464555069
Energy: 0.9485166222830657
Energy: 0.9478640850113542
Energy: 0.9470686185644995
Energy: 0.9385010864045188
Energy: 0.9346640176279422
Energy: 0.946660786161339
Energy: 0.9470719509325803
Energy: 0.9471817133569623
Energy: 1.026161808063035
Energy: 0.9549178189379423
Energy: 0.947239609065005
Energy: 0.9407138876566297
Energy: 0.9476591088004602
Energy: 1.0239393635480816
Energy: 0.9532141541887896
Energy: 0.9480132970226307
Energy: 0.9408065722928936
Energy: 1.0264808560368803
Energy: 0.9347999196222541
Energy: 0.9470013861779225
Energy: 0.9476331661197774
Energy: 0.946866090203605
Energy: 1.0276875860702743
Energy: 0.9338143603669039
Energy: 0.9469299387716479
Energy: 0.947378579246169
Energy: 0.9465153775054168
Energy: 0.9482052279064281
Energy: 1.0090737219951769
Energy: 0.9527432888614193
Energy: 0.9344862424933901
Energy: 0.9422237838889579
Energy: 0.9505233067370994
Energy: 1.0083960414545914
Energy: 0.9511595308778308
Energy: 0.9345487649237878
Energy: 0.9385223970115822
Energy: 0.946875175427399
Energy: 0.9373280100707828
Energy: 0.9455585448012919
Energy: 0.9358141075783247
Energy: 1.0122161824987386
Energy: 0.9463499991638096
Energy: 0.94658436186631
Energy: 0.9460635307633121
Energy: 0.9352073675853498
Energy: 1.0164569939798607
Energy: 0.9486778890158934
Energy: 0.948795044487455
Energy: 1.0089823422618363
Energy: 1.02630797586077
Energy: 0.9513803592587279
Energy: 0.9554835820958846
Energy: 0.9502724096590837
Energy: 1.0096110370818623
Energy: 0.9513388156864628
Energy: 0.9470905298327718
Energy: 0.9357236054061386
Energy: 0.9489999094957801
Energy: 0.9457527651454498
Energy: 0.9490650430729778
Energy: 1.0149095467253741
Energy: 0.9360537644610293
Energy: 0.9479634662927724
Energy: 0.9331876830720081
Energy: 0.9518927192213091
Energy: 1.0141856021688647
Energy: 0.9341251806544809
Energy: 0.9524064011280479
Energy: 1.0219726483425975
Energy: 0.9518982570112453
Energy: 0.9398419487997005
Energy: 0.9346062890958615
Energy: 0.9537749572881516
Energy: 1.0247063928551787
Energy: 0.9525595869169956
Energy: 0.9390880359099352
Energy: 1.013365001976029
Energy: 0.9468874102750522
Energy: 0.9461164357780801
Energy: 0.9458069291891408
Energy: 0.9475903085119843
Energy: 1.0122613579673567
Energy: 0.9472244520505712
Energy: 0.9381282581470337
Energy: 0.9458616753345352
Energy: 0.948158800854132
Energy: 0.9493316376451282
Energy: 0.9473406855330665
Energy: 0.9481607484857414
Energy: 1.0266998034649573
Energy: 1.0125342952478507
Energy: 0.9472033445246447
Energy: 0.9467061795742396
Energy: 0.9473104465361778
Energy: 1.0235084692831993
Energy: 1.0129794025170666
Energy: 1.0296813370896847
Energy: 0.9350616106148646
Energy: 0.9366055439122083
Energy: 0.9471863613985629
Energy: 1.014884562858139
Energy: 1.026551847992018
Energy: 0.9348486227313177
Energy: 0.9378330912299078
Energy: 0.9473408628245034
Energy: 1.0128689973361145
Energy: 0.9475185264083348
Energy: 0.9408778337004055
Energy: 0.9345664061374581
Energy: 0.9472486184289098
Energy: 0.9479369178577175
Energy: 0.9466172560920025
Energy: 0.9383108388392467
Energy: 0.9346533725767274
Energy: 0.9469683502488168
Energy: 0.9472031568613775
Energy: 0.947213923805847
Energy: 1.026232812312193
Energy: 0.9554075022673402
Energy: 0.9470305586125941
Energy: 0.9388237192096119
Energy: 0.947529816343926
Energy: 1.024388005307415
Energy: 0.9533407265293119
Energy: 0.9475498500825515
Energy: 0.9403641593550173
Energy: 1.0261073760276862
Energy: 0.9347051841947904
Energy: 0.9471356895957066
Energy: 0.9478051243283473
Energy: 0.947459566307894
Energy: 0.9561677823323969
Energy: 0.9337875784463181
Energy: 0.9469891473446839
Energy: 0.9474479814309237
Energy: 0.9467705112737272
Energy: 0.9481274197046659
Energy: 1.0083902356163985
Energy: 0.9553955135862443
Energy: 0.9345136889814757
Energy: 0.9419251852419569
Energy: 0.9502436556929653
Energy: 1.0082224753419105
Energy: 0.9515827018498302
Energy: 0.9344364774855477
Energy: 0.9388756466306428
Energy: 0.946834969887451
Energy: 0.9383704994648469
Energy: 0.9460275170714393
Energy: 0.9359764036382117
Energy: 1.0133643963033965
Energy: 0.9464841561154247
Energy: 0.9462795936952673
Energy: 0.9463775856190376
Energy: 0.9353552532615511
Energy: 0.9478119321065898
Energy: 0.9478734865561111
Energy: 0.9484855596080086
Energy: 1.008614464348592
Energy: 1.0262013688931395
Energy: 0.9508642331581645
Energy: 0.9522606163986732
Energy: 0.9500445790219118
Energy: 1.010942730332638
Energy: 0.9510032685235336
Energy: 0.9472342765392809
Energy: 0.9354595807225619
Energy: 0.9486084036369995
Energy: 0.946148134499994
Energy: 0.9503247817577872
Energy: 1.0147655493700514
Energy: 0.9356640291187414
Energy: 0.947809781095101
Energy: 0.9331717994941711
Energy: 0.9520466210762071
Energy: 1.013540695878377

minimum gb energy = 0.9331717994941711 eV
minimum distance =  2.30779367708599 Angstroms
sigma value = 15


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

Energy: 0.9381051931376417
Energy: 0.9421037910502279
Energy: 1.0415679519936316
Energy: 0.9842634354211305
Energy: 0.943247177849258
Energy: 0.9374502905658233
Energy: 0.9962818853603983
Energy: 1.0423662485462595
Energy: 0.941785917947089
Energy: 0.9475998552104234
Energy: 0.9232150941396056
Energy: 1.003755199736925
Energy: 0.9920654785941415
Energy: 0.9909333317266051
Energy: 1.0145475451844594
Energy: 0.9308198687451612
Energy: 1.0048779901610523
Energy: 0.9907790715329856
Energy: 1.0387210847767736
Energy: 0.9843517305515198
Energy: 1.0611472570615674
Energy: 0.9563933349376398
Energy: 0.971946427342109
Energy: 0.9979666148317171
Energy: 0.9532365784585695
Energy: 1.0580553951825717
Energy: 0.9862316608285512
Energy: 0.9860273376217635
Energy: 0.9912900192217834
Energy: 1.073120016144747
Energy: 0.9460012539813858
Energy: 0.9375956489149333
Energy: 1.005918147357454
Energy: 1.059920067349674
Energy: 1.0795292816590525
Energy: 0.9556415300960651
Energy: 0.9822787453753719
Energy: 1.0065099680997955
Energy: 1.060833605576258
Energy: 1.0739933886729753
Energy: 1.064022751256465
Energy: 1.0252804846370365
Energy: 0.934327105739109
Energy: 0.9394079513455379
Energy: 1.0502539147366654
Energy: 1.0432787397074639
Energy: 1.024377983772936
Energy: 0.9250044414723947
Energy: 0.9397909270604198
Energy: 0.9243499347284705
Energy: 0.9254478822027604
Energy: 0.9385956777886983
Energy: 0.9384975519684131
Energy: 1.0419608704333394
Energy: 1.1252692460367804
Energy: 0.9433876843562499
Energy: 0.9386315218433912
Energy: 0.9390269361409068
Energy: 1.0551137301781537
Energy: 1.1196908971186141
Energy: 0.9416663576408706
Energy: 0.9386251354773023
Energy: 0.9404458224307286
Energy: 0.9325573648282105
Energy: 1.0081530686369242
Energy: 0.9415281780908533
Energy: 0.9385870187605853
Energy: 0.9404413278664477
Energy: 0.9531649221372742
Energy: 1.1207678528383158
Energy: 0.9440503709000087
Energy: 0.9410695294214428
Energy: 0.9832990277592426
Energy: 0.9685727868581017
Energy: 1.0251021084642509
Energy: 0.9424460692106778
Energy: 0.940500832640039
Energy: 0.9397987520061024
Energy: 1.0048863249968756
Energy: 0.9775002737873397
Energy: 0.9411864748660135
Energy: 1.1359995330650143
Energy: 0.995720290188837
Energy: 1.0586988551656153
Energy: 0.9390654018490139
Energy: 0.940397720874824
Energy: 1.1358839936792997
Energy: 0.9750385527836267
Energy: 1.0325300812433011
Energy: 0.9409277890245029
Energy: 1.0034457730026076
Energy: 0.9486585292005024
Energy: 0.9328124210558851
Energy: 0.9280539820658633
Energy: 0.9624217722683155
Energy: 0.9564712223242242
Energy: 0.9538310772274519
Energy: 0.9326727358643762
Energy: 0.9291678145695651
Energy: 0.9644584491689162
Energy: 1.0394856219008677
Energy: 0.9339194471615279
Energy: 0.9559495507057854
Energy: 0.9597793696993608
Energy: 0.9282293998218646
Energy: 1.0200098571181961
Energy: 0.9477472771207696
Energy: 0.9569993233732537
Energy: 0.960181778693841
Energy: 0.928318040981898
Energy: 1.118425861726004
Energy: 1.014385112238428
Energy: 0.954098993003294
Energy: 0.9273467806648368
Energy: 1.0619357116053922
Energy: 1.115228724001532
Energy: 1.0067528750298496
Energy: 0.9281531860105126
Energy: 0.929581199947635
Energy: 0.9974624082266293
Energy: 1.0248492129267368
Energy: 0.9291420365748112
Energy: 0.9431160112092396
Energy: 1.0534229234020795
Energy: 0.990932472477112
Energy: 1.0396868608040934
Energy: 0.928809529467012
Energy: 0.9416083318319955
Energy: 1.0661960250100837
Energy: 0.9624945620158398
Energy: 0.992654661188348
Energy: 1.0097027703937447
Energy: 1.0741727810219155
Energy: 1.004015882074496
Energy: 1.0114727076493715
Energy: 0.9918315740799132
Energy: 1.0115129202489928
Energy: 0.9203627564950254
Energy: 1.0032699655156183
Energy: 1.0109393175908856
Energy: 0.9569647638250776
Energy: 0.9481837601270785
Energy: 1.0922953699918836
Energy: 1.0311664033460874
Energy: 1.004295743298068
Energy: 0.9784048275703197
Energy: 0.9666894999610803
Energy: 1.0921664038555954
Energy: 0.9775059672925872
Energy: 1.0063269789640474
Energy: 1.0790785153166471
Energy: 1.094631434537458
Energy: 0.9654712444072644
Energy: 0.9914940523883813
Energy: 1.0329078854892306
Energy: 1.1026136720364206
Energy: 1.0949563581360082
Energy: 0.9652070240945038
Energy: 0.990529041051604
Energy: 0.9890835172106044
Energy: 0.9269992497288989
Energy: 0.945356240920387
Energy: 0.9969435225957395
Energy: 1.0887193783133429
Energy: 1.021077019738425
Energy: 0.9300580521753677
Energy: 0.9501672266153762
Energy: 1.0798487435765916
Energy: 1.0865396132231193
Energy: 1.0257058325362682
Energy: 1.0530554803909515
Energy: 1.1370748618120317
Energy: 1.1233441086525622
Energy: 0.9463714002497494
Energy: 0.9436990323669768
Energy: 1.0934138137879668
Energy: 1.1375509629555478
Energy: 1.1228557514385442
Energy: 0.9452178241798028
Energy: 0.942258257497117
Energy: 0.9428253018212943
Energy: 0.9907291531914839
Energy: 0.9577272960872469
Energy: 0.9425106651856616
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Energy: 0.9425379635871622
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Energy: 0.9535779529384733
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Energy: 1.055678568173099
Energy: 1.1354457383664056
Energy: 0.9414214488533985
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Energy: 0.9716749386378007
Energy: 1.0284794045359094
Energy: 1.1363275370816124
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Energy: 0.9270394791927102
Energy: 1.0173685074883456
Energy: 0.9514717020122567
Energy: 0.9763989165857462
Energy: 0.9408357376152292
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Energy: 0.9443489956542805
Energy: 1.1068478267285125
Energy: 1.1066926078394075
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Energy: 0.9449160740654947
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Energy: 1.0436414336554898
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Energy: 0.9424655458369942
Energy: 1.0298509340018578
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Energy: 0.9582148320314432
Energy: 0.9858210513903585
Energy: 0.9437260603007154
Energy: 0.938667833599268
Energy: 0.9651643011121044
Energy: 0.9574458932343016
Energy: 0.9862039341974683
Energy: 0.9645202903919513
Energy: 1.077217327235383
Energy: 0.9728301897239746
Energy: 0.9828906306255764
Energy: 0.9543935513400594
Energy: 0.9439943550297505
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Energy: 0.9800786939397638
Energy: 0.9430795541514849
Energy: 0.9879389000664536
Energy: 0.972493571378895
Energy: 0.941406568372231
Energy: 1.0730197846305167
Energy: 1.031300215083485
Energy: 1.0773884491749846
Energy: 1.1036111519512801
Energy: 0.9417976432514249
Energy: 1.0914497100606235
Energy: 0.9692658078117176
Energy: 1.080397840389935
Energy: 1.108939296256338
Energy: 1.0988349036937284
Energy: 1.026331536813294
Energy: 1.004681408783098
Energy: 0.9419492194436987
Energy: 1.030581625109168
Energy: 1.0976013999155816
Energy: 1.002797272252548
Energy: 1.0029255156350227
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Energy: 0.9870619213848174
Energy: 1.1204160187367866
Energy: 0.9411613629826521
Energy: 0.9416293938337109
Energy: 1.088970405288255
Energy: 1.1384027476579401
Energy: 1.1049827439105444
Energy: 0.9410031116372145
Energy: 0.9417739959784359
Energy: 1.0928172408610017
Energy: 1.1285261046948836
Energy: 0.943160102076915
Energy: 0.9451638655737501
Energy: 0.9422763701616846
Energy: 0.9627932431344982
Energy: 1.0132565899844754
Energy: 0.9421775903415767
Energy: 0.9447504642498706
Energy: 0.9416265463437872
Energy: 0.9602195459034101
Energy: 1.124237325382922
Energy: 0.9453805499765466
Energy: 0.9429358155182442
Energy: 0.9478561674994943
Energy: 0.9350649209782286
Energy: 1.0367675314133233
Energy: 0.944386307297141
Energy: 0.9423879138369824
Energy: 0.947789790434143
Energy: 0.9544797864756276
Energy: 0.9619045892331745
Energy: 1.020919206814118
Energy: 1.0032372422069065
Energy: 1.0003046489509038
Energy: 1.0216345977140155
Energy: 1.0046425946090407
Energy: 0.9854876713685715
Energy: 0.9619611695449333
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Energy: 1.0139953177598433
Energy: 0.9463183298474376
Energy: 0.9796477437632461
Energy: 0.9236531765541096
Energy: 0.9839153975298616
Energy: 0.9286413134942936
Energy: 0.9674110609125246
Energy: 0.9561006476709486
Energy: 0.9231531347069752
Energy: 0.9835936046721826
Energy: 0.929666608658666
Energy: 0.96928162880815
Energy: 1.023178316854215
Energy: 0.9343174295711393
Energy: 0.9620614125370555
Energy: 0.9649267681422539
Energy: 0.9641167398233225
Energy: 1.0043746176839805
Energy: 0.963383263613766
Energy: 0.9619466885519586
Energy: 0.9661479411019653
Energy: 0.9649561739422626
Energy: 1.118379216157256
Energy: 1.0070168237791732
Energy: 0.9285988396136049
Energy: 0.927602349958575
Energy: 1.012375160265924
Energy: 1.1099508170075107
Energy: 1.017696313086409
Energy: 0.9274562960265222
Energy: 0.9274750399910486
Energy: 1.0118507894257063
Energy: 1.0315155001021008
Energy: 0.9276246444702002
Energy: 0.9398796254025928
Energy: 0.9457462607061229
Energy: 1.0106468261015138
Energy: 1.0344418051559214
Energy: 0.9276512472624241
Energy: 0.9389966420746934
Energy: 0.9473603461488963
Energy: 0.9910603657559828
Energy: 0.9893488342107178
Energy: 1.0177259016263274
Energy: 1.0506300993653561
Energy: 0.9571505739017642
Energy: 0.9607603982258494
Energy: 0.9887943822771392
Energy: 1.0203518280504578
Energy: 0.9470252461476452
Energy: 0.9566079518782398
Energy: 0.9585594617483333
Energy: 0.9777874587892795
Energy: 0.9931789605795235
Energy: 1.0896777309108658
Energy: 0.9738403197566409
Energy: 0.9858134324105301
Energy: 0.9780542504865049
Energy: 0.9813272068979977
Energy: 1.0896203559932893
Energy: 0.9661503853010653
Energy: 1.0150394849096422
Energy: 1.1085595763944889
Energy: 1.0902254132756042
Energy: 1.099176365621416
Energy: 1.065265622807251
Energy: 0.9782232000442912
Energy: 1.0639980875856851
Energy: 1.0900843050464446
Energy: 1.0990175835387839
Energy: 1.0634165938002522
Energy: 0.925235953218416
Energy: 0.9314738247989179
Energy: 0.9843317267416901
Energy: 0.9900172569497833
Energy: 1.0851979955726936
Energy: 1.0207658350195046
Energy: 0.9334710654054276
Energy: 0.9675987681467637
Energy: 0.9900561669368857
Energy: 1.0706411063910342
Energy: 1.0046778356045136
Energy: 1.0853048379100867
Energy: 1.1189641751161121
Energy: 1.1393322178814327
Energy: 0.9511117139659973
Energy: 0.9403809805518084
Energy: 1.0794540656838212
Energy: 1.1197120427801375
Energy: 1.1383585048776823
Energy: 0.9310194380067783
Energy: 0.9392951630645086
Energy: 0.940006101511699
Energy: 0.9619433192846735
Energy: 0.9462105291210754
Energy: 0.9394325843031812
Energy: 0.944315086808656
Energy: 0.9413597462791156
Energy: 0.9879760146059055
Energy: 0.9454341292012028
Energy: 0.939658423524752
Energy: 0.9543866638170163
Energy: 0.9435821818521831
Energy: 1.0213035488741982
Energy: 0.9970483796767511
Energy: 0.9385179179131707
Energy: 0.9398540077133737
Energy: 0.9983105927633031
Energy: 1.0218094161155131
Energy: 0.9843257383933002
Energy: 0.9380629430990354
Energy: 0.9404851461513767
Energy: 1.052202005656431
Energy: 0.9354047860881143
Energy: 0.9521972382339065
Energy: 0.9942835418051449
Energy: 1.011454396690518
Energy: 1.0294039677146143
Energy: 0.9351906760936529
Energy: 0.9482370553116666
Energy: 0.9924890332107756
Energy: 1.0078679074396897
Energy: 0.9415420543832248
Energy: 0.9399311414109193
Energy: 1.0327030884386168
Energy: 1.147681013230037
Energy: 0.941006604200771
Energy: 0.9314352789607987
Energy: 0.9307229354017651
Energy: 0.9779475224518696
Energy: 1.1411439414252849
Energy: 0.9419923391125462
Energy: 0.9508269574452007
Energy: 0.9423249273593444
Energy: 0.9467256126943896
Energy: 0.9406246839057928
Energy: 0.9318695545194455
Energy: 0.9516863207668627
Energy: 0.9499699690094144
Energy: 0.9482722745242242
Energy: 0.9393583832966507
Energy: 0.9398940651256319
Energy: 0.9409912019815743
Energy: 0.9467072890020809
Energy: 1.1071136230377148
Energy: 1.1049364665795827
Energy: 1.0648640886265106
Energy: 0.9332539706148055
Energy: 1.0249264743295114
Energy: 1.1118877326575416
Energy: 1.0401676355630578
Energy: 1.0639000550439228
Energy: 1.0040248058434995
Energy: 1.005299795206115
Energy: 0.9722991927692587
Energy: 0.9399717349225586
Energy: 0.9242084765840022
Energy: 0.9607340183702873
Energy: 1.0185857427796527
Energy: 1.0339681129232308
Energy: 0.9865694227526796
Energy: 0.9254345813782959

minimum gb energy = 0.9182858839823381 eV
minimum distance =  2.28101248228108 Angstroms
sigma value = 437


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

Energy: 1.3049450427598968
Energy: 0.860342825726411
Energy: 0.8904633371883172
Energy: 0.9226453680401528
Energy: 0.8614004886021813
Energy: 0.9572195547327462
Energy: 0.9203359582050668
Energy: 0.8904376395256025
Energy: 0.8606060431326958
Energy: 1.0442090234417207
Energy: 0.855341490701894
Energy: 1.0021474270869277
Energy: 0.8603425939452023
Energy: 1.0472933624814535
Energy: 0.8904897155222558
Energy: 0.8598394864883688
Energy: 1.0012753760371864
Energy: 0.8605778095681387
Energy: 1.0015522532014403
Energy: 0.8892669085531529
Energy: 0.9557650546117485
Energy: 0.9767109977809887
Energy: 0.9999240727984569
Energy: 0.8935369998709113
Energy: 0.8653875229593148
Energy: 0.9551179790217958
Energy: 0.9732442512322129
Energy: 0.9997463146294244
Energy: 0.8923091291970241
Energy: 0.9597219679866628
Energy: 0.8905462020606202
Energy: 0.8948440177674338
Energy: 0.9062243864812094
Energy: 0.9542517904883848
Energy: 0.9567451144592466
Energy: 0.8916696769006852
Energy: 0.8932483457519322
Energy: 0.9989833630040618
Energy: 0.9546485545472846
Energy: 0.8627160436769532
Energy: 0.8763819230012917
Energy: 0.9208690395746646
Energy: 0.8727665149430183
Energy: 0.8895398897952085
Energy: 0.9566383644821387
Energy: 0.8744427992443083
Energy: 1.0002082757582453
Energy: 0.8944372727047664
Energy: 0.8905046884027723
Energy: 0.8583515688731407
Energy: 0.9117610307699863
Energy: 0.8901157823093849
Energy: 0.9083844166812663
Energy: 0.8776670477018822
Energy: 0.9525509968248453
Energy: 0.912040529680484
Energy: 0.8899121177564779
Energy: 0.8585192534756311
Energy: 0.875085323504934
Energy: 1.3043953934899386
Energy: 0.9574111869659466
Energy: 0.9556456068552087
Energy: 0.9552675952756945
Energy: 0.8896358360784108
Energy: 0.907346072600644
Energy: 0.9565397031804561
Energy: 0.9552982141819808
Energy: 0.955152568857855
Energy: 0.8898090573671387
Energy: 0.9078277870804862
Energy: 0.9642600725497611
Energy: 0.8623720537063819
Energy: 0.8902532350828666
Energy: 0.8901669713847953
Energy: 1.0016361048003037
Energy: 0.9664115062617125
Energy: 0.8582043869636954
Energy: 0.8902404554376606
Energy: 0.8902484395523567
Energy: 1.0012167769845597
Energy: 0.8902817500322163
Energy: 0.9077888429289729
Energy: 0.9214165230031657
Energy: 0.9101415630862724
Energy: 0.8908102189121828
Energy: 0.8893898103311527
Energy: 0.9973110859810717
Energy: 0.9208256527642578
Energy: 0.8595266887021868
Energy: 0.8897440370046158
Energy: 0.8616587456614211
Energy: 0.8882915325922778
Energy: 0.8620838798642072
Energy: 0.859599480213759
Energy: 0.9231078454072167
Energy: 0.8738421827014625
Energy: 0.8872681224721034
Energy: 0.8623355080407201
Energy: 0.8588962247753341
Energy: 0.9205831972112222
Energy: 0.8607251584598719
Energy: 0.8595055508937677
Energy: 0.8609297090549147
Energy: 0.9528759758674158
Energy: 0.8657184538666226
Energy: 0.859681669309768
Energy: 0.8592471851617267
Energy: 0.92097257536029
Energy: 0.9531651336412637
Energy: 0.8907160241742361
Energy: 0.8635475523179112
Energy: 0.8643656769244099
Energy: 0.8596061155389113
Energy: 0.9861110527883309
Energy: 0.8622544448102702
Energy: 0.8620499906785666
Energy: 0.8599471082214752
Energy: 0.8596578521499334
Energy: 0.9864756398755319
Energy: 0.8613862355333859
Energy: 0.8602847956683515
Energy: 0.8898020610761022
Energy: 0.9988542981180341
Energy: 0.9997395442670856
Energy: 0.8603326257254731
Energy: 0.8610079377441484
Energy: 0.8898308609057749
Energy: 0.9999076846289768
Energy: 0.9986365780876634
Energy: 0.8608600302136368
Energy: 0.8590878020783592
Energy: 0.8675873951175427
Energy: 0.9895517496891912
Energy: 0.860512201741193
Energy: 0.8695718353488928
Energy: 1.0433929294912936
Energy: 0.8613413653864826
Energy: 0.9829118688668965
Energy: 0.8642972217414305
Energy: 0.910020864918313

minimum gb energy = 0.855341490701894 eV
minimum distance =  2.34244204107994 Angstroms
sigma value = 33