Model name: model_name=EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_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=3.614728152751923
cohesive_energy=3.524844861148951
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=[6.65502517171116e-20, 1.313270541180486e-19, 2.0094018690637798e-19, 2.71466400158424e-19, 3.3741679694376595e-19, 3.9195168521185796e-19, 4.2979189295366997e-19, 4.532749958782079e-19, 4.66800571022436e-19, 4.75833642884928e-19, 4.86529774093512e-19, 4.98799242756684e-19, 5.11180863784236e-19, 5.223240022737059e-19, 5.311551998803139e-19, 5.387431084189379e-19, 5.452287194333699e-19, 5.50663302575898e-19, 5.551157514417839e-19, 5.586725835692639e-19, 5.61367444667652e-19, 5.632371847995299e-19, 5.64337880147088e-19, 5.64698369889738e-19, 5.643090409676759e-19, 5.632451956826999e-19, 5.609861266287599e-19, 5.57506198979712e-19, 5.52577903653528e-19, 5.45922461915892e-19, 5.37203416673664e-19, 5.260058041786379e-19, 5.11824938791104e-19, 4.94064810803214e-19, 4.718970948951899e-19, 4.44373302499704e-19, 4.10258155431942e-19, 3.67976714060682e-19, 3.1566564696058198e-19, 2.50384960008252e-19, 1.68766877919024e-19, 6.62174796302298e-20, -6.3835523628462e-20, -2.3019753441985197e-19, -4.453394150100059e-19, -7.276493466273419e-19, -1.10449250618058e-18, -1.6175895732190799e-18, -2.33515642228866e-18, -3.3707713549735797e-18, -4.928711892108839e-18, -7.4034980080506e-18, -1.1641223161447919e-17, -1.9738175260226397e-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: 0.015381949280325893
Energy: 0.09977145276987154
Energy: 0.10008625100749044
Energy: 0.09980902755626632
Energy: 0.019474018350716334
Energy: 0.01668208377483134
Energy: 0.09930051589571899
Energy: 0.10155751842595641
Energy: 0.09943508693903637
Energy: 0.018651625945041883
Energy: 0.09911080972015775
Energy: 0.10391096170748995
Energy: 0.09839743000712664
Energy: 0.10424004498995341
Energy: 0.10509133626551555
Energy: 0.09791330070919493
Energy: 0.10320349563720382
Energy: 0.09823229837764803
Energy: 0.10088713249765023
Energy: 0.1049715297596681
Energy: 0.10156550427325921
Energy: 0.018870784062628293
Energy: 0.01587995585153822
Energy: 0.0986990097516295
Energy: 0.09904900129947657
Energy: 0.10079080944863468
Energy: 0.017992348774980106
Energy: 0.0158295719663883
Energy: 0.0981336550027246
Energy: 0.1003191092452059
Energy: 0.10151857202148606
Energy: 0.016820473133491505
Energy: 0.016750340419039233
Energy: 0.10321221458975181
Energy: 0.09846931576006313
Energy: 0.10564702382948755
Energy: 0.017484881502853194
Energy: 0.01614824253523607
Energy: 0.10359872181158788
Energy: 0.09786191167265335
Energy: 0.09914673917612883
Energy: 0.09925223388281539
Energy: 0.10211850789006238
Energy: 0.01722066705492661
Energy: 0.015977659998433032
Energy: 0.10280702208309592
Energy: 0.09967051666151745
Energy: 0.10126113365244589
Energy: 0.018024617028273696
Energy: 0.10151471440415531
Energy: 0.102019447619289
Energy: 0.09861683217952559
Energy: 0.0996101693964697
Energy: 0.016522805869007902
Energy: 0.019458453403080625
Energy: 0.10279785585755123
Energy: 0.09771726864249615
Energy: 0.10539976358308552
Energy: 0.0169610371215208
Energy: 0.016054368859727643
Energy: 0.016066245749201413
Energy: 0.10432121628631631
Energy: 0.09922558938649227
Energy: 0.1001549933639776
Energy: 0.10247868122671697
Energy: 0.020434395217725967
Energy: 0.10172501738275322
Energy: 0.09818121395806209
Energy: 0.10173207404681504
Energy: 0.10212517975508177

minimum gb energy = 0.015381949280325893 eV
minimum distance =  2.51675585593864 Angstroms
sigma value = 3


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

Energy: 1.1771609592425039
Energy: 0.7621954563176103
Energy: 0.8223464942101651
Energy: 0.762697272699671
Energy: 0.7859429277135982
Energy: 0.7796720120301911
Energy: 0.7635587991983691
Energy: 0.8230312473360165
Energy: 0.8237079028611864
Energy: 0.7799290733684429
Energy: 0.7495757136404076
Energy: 0.8034022619995321
Energy: 0.8277151847469252
Energy: 0.7117416150142011
Energy: 0.6106997654255155
Energy: 0.6091835241564344
Energy: 0.7516777179384103
Energy: 0.8246632949576389
Energy: 0.7272673775092662
Energy: 0.6108019547972058
Energy: 0.6893337894482935
Energy: 0.8358321499169642
Energy: 0.6875730234205539
Energy: 0.6079622566590638
Energy: 0.6095117748023109
Energy: 0.6082581284506393
Energy: 0.9182004393614137
Energy: 0.7445590314036284
Energy: 0.7757173519471784
Energy: 0.7729139589489609
Energy: 0.7039061726471905
Energy: 0.8347605414661565
Energy: 0.7789412190853874
Energy: 0.6083553973262851
Energy: 0.6109409571373982
Energy: 0.6084116777874812
Energy: 0.828083527158769
Energy: 0.7798017750297167
Energy: 0.7080883540707856
Energy: 0.7748464527548948
Energy: 0.8037218278787515
Energy: 0.7784177656962711
Energy: 0.715565791763714
Energy: 0.8063914065124639
Energy: 0.6542541443751112
Energy: 0.8319383941333937
Energy: 0.7861040891544089
Energy: 0.7965371701973329
Energy: 0.7046568085110889
Energy: 0.7567438285258183
Energy: 0.7782362872535729
Energy: 0.8346992121117515
Energy: 0.7872074969961187
Energy: 0.7421717086311179
Energy: 0.8972991791301264
Energy: 0.7783899486976806
Energy: 0.7796909216827059
Energy: 0.8097031266515189
Energy: 0.7408646405057544
Energy: 0.8047981176753011
Energy: 0.8468517952882129
Energy: 0.8314418296808987
Energy: 0.7747864151801104
Energy: 0.7488137755060631
Energy: 0.8052015919009107
Energy: 0.848222065581276
Energy: 0.9465684773976937
Energy: 0.7795859085455857
Energy: 0.6813329689630836
Energy: 0.833587509386644
Energy: 0.8473881002677146
Energy: 0.8297880605981645
Energy: 0.8023460841846145
Energy: 0.9464675837576461
Energy: 0.8324863406113199
Energy: 0.8484790153818955
Energy: 0.8125230509083943
Energy: 0.8035631603725114
Energy: 0.8047734844572059
Energy: 0.8298055664422809
Energy: 0.9426971908933379
Energy: 0.7521366736067944
Energy: 0.6114091882471956
Energy: 0.810458575853705
Energy: 0.915638600131283
Energy: 0.9429854992628225
Energy: 0.7161292208967256
Energy: 0.7337936589618254
Energy: 0.7894284927731724
Energy: 0.8045450813422295
Energy: 0.8720271146326584
Energy: 0.7122263869664984
Energy: 0.7412235294464661
Energy: 0.6826158119897419
Energy: 0.7370330518189561
Energy: 0.7621190560754955
Energy: 0.6455793499892909
Energy: 0.7585930501042211
Energy: 0.7213882007001946
Energy: 0.7371749190439211
Energy: 0.8147596969528531
Energy: 0.7441632699044435
Energy: 0.6791900551792998
Energy: 0.6555023940816309
Energy: 0.7476005847514609
Energy: 0.6491811352777204
Energy: 0.6959029489941166
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Energy: 0.714853061041681
Energy: 0.7358704012210994
Energy: 0.7869016111498216
Energy: 0.6794450571865661
Energy: 0.8478602536887067
Energy: 0.8066814716062077
Energy: 0.84509349127219
Energy: 0.686679708267198
Energy: 0.6829835576855711
Energy: 0.8373782694924369
Energy: 0.9403940087100613
Energy: 0.847915504700043
Energy: 0.8121444781731288
Energy: 0.6795939400369452
Energy: 0.7872142211864378
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Energy: 0.8293724124478381
Energy: 0.684857959324914
Energy: 0.6823690551698969
Energy: 0.7981342047289489
Energy: 0.8331501170221843
Energy: 0.8300897969299456
Energy: 0.7047019500551384
Energy: 0.6857957471241279
Energy: 0.8490646931300294
Energy: 0.8296175831536114
Energy: 0.8326548547076015
Energy: 0.6099336928012159
Energy: 0.6879999140975984
Energy: 0.851052154794524
Energy: 0.8021738525005686
Energy: 0.8234678564592376
Energy: 1.1397131397476945
Energy: 0.8090169889551357
Energy: 0.8479846168401389
Energy: 0.8089123305703929
Energy: 0.7863921727343194
Energy: 0.7795490890426839
Energy: 0.8112019761359052
Energy: 0.8472773848715126
Energy: 0.8475880227509152
Energy: 0.8220310737652448
Energy: 0.6798062761221104
Energy: 0.776875456081086
Energy: 0.8503695067637649
Energy: 0.8320328968733125
Energy: 0.6900869985705105
Energy: 0.6018027941245031
Energy: 0.874923560477448
Energy: 0.8497330869563874
Energy: 0.8485396236037319
Energy: 0.6882266545230588
Energy: 0.6967726616840438
Energy: 0.738117836271666
Energy: 0.7337129886841952
Energy: 0.7121843624365035
Energy: 0.6800823079845398
Energy: 0.6972168340229309
Energy: 0.690931813601583
Energy: 0.7393047062979691
Energy: 0.7210756518855721
Energy: 0.6781060051764284
Energy: 0.6822730956972293
Energy: 0.7393667809920206
Energy: 0.6886312171367722
Energy: 0.6939814363557126
Energy: 0.7007787525010859
Energy: 0.6827475719268624
Energy: 0.7401081333262494
Energy: 0.6885299110798755
Energy: 0.7645863164752913
Energy: 0.7009914345459761
Energy: 0.7044618834795839
Energy: 0.8498178567944294
Energy: 0.7991242711702045
Energy: 0.77232028912485
Energy: 0.6945171074874852
Energy: 0.8069303035592031
Energy: 0.8491346210717802
Energy: 0.8502287415812408
Energy: 0.741077971069127
Energy: 0.68908158017279
Energy: 0.8324602892273166
Energy: 0.8299456440269596
Energy: 0.813478528465146
Energy: 0.7410559806166255
Energy: 0.7882178178301744
Energy: 0.8309961264692641
Energy: 0.8285643020131679
Energy: 0.7437873993102695
Energy: 0.796938957796646
Energy: 0.849695398711448
Energy: 0.8473169919395549
Energy: 0.8002487653557747
Energy: 0.75198852276218
Energy: 0.6822951295683407
Energy: 0.7979143625845105
Energy: 0.8524020220200316
Energy: 0.8317560467645748
Energy: 0.6613841591942505
Energy: 0.7474061530203334
Energy: 0.7769467938021182
Energy: 0.9795740439208723
Energy: 0.8114848447124406
Energy: 0.6557225375175576
Energy: 0.6720156240758991
Energy: 0.8336833079349555
Energy: 0.848279429635468
Energy: 0.8123526461078675
Energy: 0.6728990163162953
Energy: 0.8479879495137264
Energy: 0.8308158401668589
Energy: 0.9406628007288104
Energy: 0.7521122821825474
Energy: 0.6361413947270755
Energy: 0.6842414377465275
Energy: 0.7618080327616029
Energy: 0.9408317156382725
Energy: 0.7499015648139233
Energy: 0.6409684942563351
Energy: 0.6858350369196491
Energy: 0.8069211306586624
Energy: 0.7688863613564186
Energy: 0.6121821947975952
Energy: 0.677653373314903
Energy: 0.7589582699414668
Energy: 0.7330053990848903
Energy: 0.7641042651941433
Energy: 0.6979553379497166
Energy: 0.7416459995927561
Energy: 0.7253175623510277
Energy: 0.7356356478289762
Energy: 0.7150142303600729
Energy: 0.7522393420691857
Energy: 0.6807864218633944
Energy: 0.6833702098245348
Energy: 0.7368845089711337
Energy: 0.7252018805068566
Energy: 0.7448906120864364
Energy: 0.7170434260458058
Energy: 0.6554844803307315
Energy: 0.735674177487126
Energy: 0.77529162028115
Energy: 0.7504635194037194
Energy: 0.7451996288030435
Energy: 0.7620409151907912
Energy: 0.8182735220659388
Energy: 0.609814341005896
Energy: 0.6130745930582304
Energy: 0.7483110798303829
Energy: 0.9553021440734579
Energy: 0.8244350250415666
Energy: 0.7775318686266027
Energy: 0.7972911824915259
Energy: 0.8355543318984977
Energy: 0.8288944123174534
Energy: 0.8312586399224374
Energy: 0.7986191957628943
Energy: 0.6104700354819368
Energy: 0.7154753877417005
Energy: 0.8303000222492444
Energy: 0.8330414331415665
Energy: 0.7679110058313975
Energy: 0.6928268023874425
Energy: 0.8233977735643354
Energy: 0.8212739202742576
Energy: 0.7625629320134887
Energy: 0.6133068460314767
Energy: 0.610755989928243
Energy: 0.824528407497055
Energy: 0.7638212150319127
Energy: 0.8409708369534457
Energy: 0.8774309320466815
Energy: 0.7639257425208815
Energy: 0.8246294516792156
Energy: 0.7619506287732941
Energy: 0.7847778722346626
Energy: 0.7791488276206816
Energy: 0.7639149114960062
Energy: 0.8228840092294096
Energy: 0.806488133284356
Energy: 0.7805751155633707

minimum gb energy = 0.6018027941245031 eV
minimum distance =  2.21857487618476 Angstroms
sigma value = 75


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

Energy: 1.600358603243486
Energy: 0.9076308721486572
Energy: 0.806383633999617
Energy: 0.808062910119303
Energy: 0.8963922849739093
Energy: 0.789854645701002
Energy: 0.9157730136509837
Energy: 0.8247389267922558
Energy: 0.8083167269198089
Energy: 0.8950608319060024
Energy: 0.8645290377495576
Energy: 0.7821404375048762
Energy: 0.831497693943161
Energy: 0.8075975230576777
Energy: 0.7856593849070346
Energy: 0.813830775094778
Energy: 0.7674180746660574
Energy: 0.8212341867867883
Energy: 0.820981574487876
Energy: 0.7988769218026998
Energy: 0.871651177426008
Energy: 0.9687138499380495
Energy: 0.9587851206458724
Energy: 0.811178627662457
Energy: 0.8593004988765692
Energy: 0.7895415128607298
Energy: 0.9687291011593261
Energy: 0.9605728601625215
Energy: 0.8790519624536484
Energy: 0.8399195908685501
Energy: 0.8502405509194839
Energy: 0.7998878042045733
Energy: 0.7965337746415638
Energy: 0.7898190315504132
Energy: 0.8436880634919249
Energy: 0.8490636972609406
Energy: 0.7851630842184565
Energy: 0.7733049876724467
Energy: 0.8397112793936566
Energy: 0.8518197305095732
Energy: 0.8073843503720554
Energy: 0.7967968795306006
Energy: 0.9749674180100625
Energy: 0.8577880754683116
Energy: 0.7596349377241955
Energy: 0.7974860053934615
Energy: 0.8042958667954951
Energy: 0.9419300901707722
Energy: 0.8162609124706006
Energy: 0.8258499149817484
Energy: 0.7925801233373656
Energy: 0.7990713788280622
Energy: 0.9399381246491987
Energy: 0.8273913468782701
Energy: 0.8101768236858509
Energy: 0.7836343764058704
Energy: 0.8017503876413115
Energy: 0.8206807573970116
Energy: 0.8238403749760086
Energy: 0.83321078636378
Energy: 0.8041682670083149
Energy: 0.8753531146721731
Energy: 0.8028871467809104
Energy: 0.8144027054675003
Energy: 0.8640696669004448
Energy: 0.8234825991533464
Energy: 0.8613008439117774
Energy: 0.7961465279775176
Energy: 0.8227852773244962
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Energy: 0.8419077052455257
Energy: 0.877108238976511
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Energy: 0.9616344973862233
Energy: 0.8616887376640848
Energy: 0.8425105241040036
Energy: 0.8277010463406748
Energy: 0.9633937258953675
Energy: 0.9614345094879426
Energy: 0.821386162823984
Energy: 0.8413874428990572
Energy: 0.809325752069974
Energy: 0.7838200897535518
Energy: 0.8117046551215389
Energy: 0.8935217714734339
Energy: 0.8518764614726615
Energy: 0.8501535036775799
Energy: 0.7814209120020109
Energy: 0.7944171082190679
Energy: 0.8263564513269689
Energy: 0.791963714820855
Energy: 0.8025996677551097
Energy: 0.8075738003142535
Energy: 0.9377842925110549
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Energy: 0.8006666575456967
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Energy: 0.9568194289074281
Energy: 0.8920578029864706
Energy: 0.8508667038892044
Energy: 0.8254812653421615
Energy: 0.7918357585414316
Energy: 0.8278868259389731
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Energy: 0.8494658462916409
Energy: 0.7969863482484479
Energy: 0.8087881973599511
Energy: 0.8305991656998315
Energy: 1.009980541157291
Energy: 0.8483395510505763
Energy: 0.7811946068824357
Energy: 0.8375069062223486
Energy: 0.8014217823312713
Energy: 0.8376864336420973
Energy: 0.8418225265839069
Energy: 0.7702256394308689
Energy: 0.8731163033412412
Energy: 0.8012510567658075
Energy: 0.8387336726160531
Energy: 0.8085912398850775
Energy: 0.8136275784492726
Energy: 0.8459416623527072
Energy: 0.8571604455805398
Energy: 0.835613277070441
Energy: 0.8229836310521255
Energy: 0.8467269802846015
Energy: 0.8622594618373673
Energy: 0.8445292254293636
Energy: 0.8887253787129935
Energy: 0.7812868399571888
Energy: 0.8197972964859911
Energy: 0.8352387234471228
Energy: 0.7603144829785793
Energy: 0.8009838344631299
Energy: 0.8677061986228237
Energy: 0.7971253420634498
Energy: 0.8126048168878116
Energy: 0.7967008296178809
Energy: 0.8240508844840991
Energy: 0.8549822985939526
Energy: 0.8204825960769553
Energy: 0.7950781170335144
Energy: 0.8172356891956043
Energy: 0.9250743040546935
Energy: 0.8338905410732845
Energy: 0.8093668761000851
Energy: 0.7996587613672473
Energy: 0.8003696256123135
Energy: 0.9381844891916623
Energy: 0.8869116147472489
Energy: 0.8472256232835763
Energy: 0.8001057505014827
Energy: 0.7923336344294083
Energy: 0.821835002786414
Energy: 0.8129044884076806
Energy: 0.832538542565363
Energy: 0.7946183687824595
Energy: 0.8001182085486154
Energy: 0.8338466448269549
Energy: 0.8696972025849612
Energy: 0.7629633981838172
Energy: 0.7887272584824203
Energy: 0.8777505348474837
Energy: 0.7977104032868908
Energy: 0.856412402271277
Energy: 0.8020695333586947
Energy: 0.7816265504869216
Energy: 0.792664091390568
Energy: 0.8046468248398493
Energy: 0.8641146423100643
Energy: 0.846583975421656
Energy: 0.8486885433620744
Energy: 0.8686833180719957
Energy: 0.7921384974959665
Energy: 0.8413181221061572
Energy: 0.8569925904917179
Energy: 0.8477544009647632
Energy: 0.8435499552768754
Energy: 0.8659991800297604
Energy: 0.8131338787861789
Energy: 0.8299484434213271
Energy: 0.83110186154004
Energy: 0.8414948100953938
Energy: 0.8019217502357677
Energy: 0.8222629323688273
Energy: 0.81315761515733
Energy: 0.8003501502497039
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minimum gb energy = 0.7575506564913302 eV
minimum distance =  2.30487181338629 Angstroms
sigma value = 105


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

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Energy: 0.7966674354972375
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Energy: 0.8874742878411703
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Energy: 0.785765040502453
Energy: 0.9111324076844509
Energy: 0.8246724363325338
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Energy: 0.798353663668831
Energy: 0.7852891082153615
Energy: 0.9112589408372217
Energy: 0.8251537891326673
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Energy: 0.9036100837524614
Energy: 0.8372959600013319
Energy: 0.7845905739634687
Energy: 0.7819368641389406
Energy: 0.8354400600767561
Energy: 0.8361507287558857
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Energy: 0.8313310909589485
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Energy: 0.8394954857543024
Energy: 0.7967570758314397
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Energy: 0.8297527406802171
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Energy: 0.9013440485797752
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Energy: 0.8549509059869898
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Energy: 0.8303567778464711
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Energy: 0.8623849545978168
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Energy: 0.8346909276757112
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Energy: 0.8891728108450713
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Energy: 0.8378210499348283
Energy: 0.8354504113961695
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Energy: 0.791984503322716
Energy: 0.8916349968081928
Energy: 0.8675252978627961
Energy: 0.8651874092740849
Energy: 0.901867873230651
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Energy: 0.9015509824885425
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Energy: 0.8220381188806143
Energy: 0.8372396005169651
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Energy: 0.7952833729263279
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Energy: 0.8008534361256548
Energy: 0.9070014713314977
Energy: 0.8061251015229915
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Energy: 0.9076468207286593
Energy: 0.8826181401845021
Energy: 0.9070222719938675
Energy: 0.7991061515052567
Energy: 0.9599980098314569
Energy: 0.7974441882160704
Energy: 0.8259956107185987
Energy: 0.9063509164463679
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Energy: 0.9318412504162488
Energy: 0.7975145492617125
Energy: 0.8347040877839516
Energy: 0.7973167050222507
Energy: 0.79874540632574
Energy: 0.8299207186416774
Energy: 0.7958648799436514
Energy: 0.8390758904539307
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Energy: 0.798479822603252
Energy: 0.8343653698512521
Energy: 0.8218012930912341
Energy: 0.8291755879710392
Energy: 0.7953242387278887
Energy: 0.7958856557754151
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Energy: 0.880350370785649
Energy: 0.8251191258387925
Energy: 0.7973030456373917
Energy: 0.7962265605735214
Energy: 0.7954488507329582
Energy: 0.8754033799411098
Energy: 0.8368753539619019
Energy: 0.7954588918696497
Energy: 0.795808014832698
Energy: 0.7966760522848505
Energy: 0.8422437995112617
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Energy: 0.7954634650056901
Energy: 0.7970256119289789
Energy: 0.7976631012660373
Energy: 0.8431357456932377
Energy: 0.9156235819012155
Energy: 0.8068211414334712
Energy: 0.8861887066702641
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Energy: 0.796133178650605
Energy: 0.8831999671465665
Energy: 0.9114406191690921
Energy: 0.836424329441079
Energy: 0.8725708438560018
Energy: 0.8367040023242017
Energy: 0.8353913423183681
Energy: 0.8345738036806453
Energy: 0.9028421667858793
Energy: 0.795364265977434
Energy: 0.7840841076663992
Energy: 0.8348943624929426
Energy: 0.8358662820451983
Energy: 0.9023814344782001
Energy: 0.7949617542518715
Energy: 0.7843962211992673
Energy: 0.8254322521335427
Energy: 0.83938019808738
Energy: 0.8389618519437834
Energy: 0.7960620677706356
Energy: 0.9110568842483571
Energy: 0.7924363979401025
Energy: 0.8387599890522806
Energy: 0.8394163299233525
Energy: 0.7959855862015591
Energy: 0.9091603218469854
Energy: 0.8239619140488837
Energy: 0.8271020520576866
Energy: 0.8281386335005406
Energy: 0.8293427394136121
Energy: 0.8832018666632263
Energy: 0.8249065258426994
Energy: 0.8271432552837236
Energy: 0.8300220793371801
Energy: 0.8295594079997045
Energy: 0.8842554994878229
Energy: 0.829821415791171
Energy: 0.8326083476278402
Energy: 0.8439397620891754
Energy: 0.8333390479947616
Energy: 0.8392138384049789
Energy: 0.9119520777874198
Energy: 0.8324691874669734
Energy: 0.8435634895501005
Energy: 0.8330004026670897
Energy: 0.8901320865761975
Energy: 0.8326953966207087
Energy: 0.8287519382246984
Energy: 0.830563822170071
Energy: 0.8308892800748046
Energy: 0.8636982308170793
Energy: 0.8321887563820481
Energy: 0.8280066437398802
Energy: 0.8297413003636497
Energy: 0.831721689440103
Energy: 0.7817008292765859
Energy: 0.8705124961111319
Energy: 0.7963710476496011
Energy: 0.8325844892223502
Energy: 0.8314735579950517
Energy: 0.7814258037962871
Energy: 0.8316619282844514
Energy: 0.7958331342365166
Energy: 0.8322144185453842
Energy: 0.8315132349074857
Energy: 0.78051625843366
Energy: 0.8121323584872312
Energy: 0.7920246563929302
Energy: 0.8377433441838043
Energy: 0.8316288157577322
Energy: 0.8356372904699161
Energy: 0.8132609406602769
Energy: 0.8256521836193363
Energy: 0.8378318744958323
Energy: 0.8299305710740016
Energy: 0.8341862989606516
Energy: 0.8915000923245957
Energy: 0.8263261440522041
Energy: 0.9021529066875559
Energy: 0.8652973162782099
Energy: 0.886029786642766
Energy: 0.9058411744955381
Energy: 0.836243889330308
Energy: 0.9017815166944226
Energy: 0.8647633358731455
Energy: 0.8867139596955919
Energy: 0.8411222429511078
Energy: 0.8335923512894856
Energy: 0.7972972693447073
Energy: 0.8084251639084916
Energy: 0.8379762390994595
Energy: 0.823689523262242
Energy: 0.8110030980003706
Energy: 0.7958139408832559
Energy: 0.8082292945485078
Energy: 0.8301432622610642
Energy: 0.7805295189616697
Energy: 0.7953668682759226
Energy: 0.7961861337337904
Energy: 0.794462768130869
Energy: 0.7832877572463669
Energy: 0.7793850803248537
Energy: 0.794992273333621
Energy: 0.7952902592717745
Energy: 0.7944579241544034
Energy: 0.8756854338073317

minimum gb energy = 0.7793850803248537 eV
minimum distance =  2.32099117371395 Angstroms
sigma value = 165


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

Energy: 1.1657173001420353
Energy: 0.8121610294620498
Energy: 0.822181457999712
Energy: 0.8537339279399605
Energy: 0.7822380502239796
Energy: 1.0878310325492415
Energy: 0.8132804406788452
Energy: 0.8255803223828022
Energy: 0.8591935727778
Energy: 0.817964972432322
Energy: 0.8181427187961663
Energy: 0.8716902165875701
Energy: 0.8237041249008838
Energy: 0.8503732969587501
Energy: 0.8508749524288491
Energy: 0.843846930844054
Energy: 0.813363728816019
Energy: 0.8659901031344314
Energy: 0.8688141440822081
Energy: 0.9161714198541319
Energy: 0.8172063249888709
Energy: 0.9187962108864486
Energy: 0.8257720343078747
Energy: 0.8118511752207175
Energy: 0.8645454015976575
Energy: 0.8205623332239476
Energy: 0.8167901437279428
Energy: 0.8652228397055517
Energy: 0.8204426183527243
Energy: 0.87614600221414
Energy: 0.8925791638896506
Energy: 0.8581484598204603
Energy: 0.872638656878074
Energy: 0.8482019540648041
Energy: 0.8216697784659273
Energy: 0.8724625512279708
Energy: 0.8662827144873169
Energy: 0.8301657818921252
Energy: 0.8158362517126343
Energy: 0.8662274721566916
Energy: 0.8588663407753288
Energy: 0.8892215985824653
Energy: 0.8681380170132595
Energy: 0.8650163048437258
Energy: 0.8064772900522407
Energy: 0.8550125286773198
Energy: 0.8294591160915991
Energy: 0.8291207748950028
Energy: 0.8197595063525216
Energy: 0.8697053909321331
Energy: 0.8347927099038656
Energy: 0.837532226964436
Energy: 0.8747387572645275
Energy: 0.8215182997615261
Energy: 0.8057972582613016
Energy: 0.8358902590388733
Energy: 0.8377049851557998
Energy: 0.8342825072888295
Energy: 0.8197427586166717
Energy: 0.87928470592189
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Energy: 0.892067493270505
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Energy: 0.8226596190579388
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Energy: 0.8510569263176408
Energy: 0.9011653933534411
Energy: 0.8607159239021441
Energy: 0.8202406408195614
Energy: 0.8403632442296823
Energy: 0.9103476014008689
Energy: 0.8960557317494784
Energy: 0.9170853815134222
Energy: 0.8682184906534878
Energy: 0.7810280453080681
Energy: 0.8883379450587229
Energy: 0.897997744108868
Energy: 0.8983683741000723
Energy: 0.7836441482170782
Energy: 0.78186547288381
Energy: 0.8196497508294873
Energy: 0.8603648472483215
Energy: 0.8986277419128776
Energy: 0.8909309981039
Energy: 0.7819716557136475
Energy: 0.8113897532317164
Energy: 0.8583136152189084
Energy: 0.8963888572975105
Energy: 0.8601380555419262
Energy: 0.9137096180266421
Energy: 0.8440615214975984
Energy: 0.9053116060626194
Energy: 0.9045845897739775
Energy: 0.8922213464137576
Energy: 0.8582509478091043
Energy: 0.8258595985902509
Energy: 0.8569717759653428
Energy: 0.9016461640823281
Energy: 0.8941060904133807
Energy: 0.8823415777713328
Energy: 0.8668604609278104
Energy: 0.8461571899725417
Energy: 0.8685606096132313
Energy: 0.8640280954278126
Energy: 0.8558745682986667
Energy: 0.8202180821118552
Energy: 0.8436624247216301
Energy: 0.9174811257867865
Energy: 0.8677588540219149
Energy: 0.9050468976293862
Energy: 0.9064559108592245
Energy: 0.8409259844814335
Energy: 0.8176579688027326
Energy: 0.8182180018792671
Energy: 0.9080660326279278
Energy: 0.8577779271205977
Energy: 0.8725825401766427
Energy: 0.8720844754398908
Energy: 0.8320366221613097
Energy: 0.8996449431196113
Energy: 0.8438884710306335
Energy: 0.8056887622418611
Energy: 0.811782003178763
Energy: 0.8208555192112665
Energy: 0.8418596215289099
Energy: 0.8660209150848199
Energy: 0.840219872530081
Energy: 0.8765278084725843
Energy: 0.8328484399337246
Energy: 0.8716752434547932
Energy: 0.8264278971248699
Energy: 0.8570149423312464
Energy: 0.8224056551920766
Energy: 0.8101659174299636
Energy: 0.8763058723398188
Energy: 0.8266343054082556
Energy: 0.8283024245136541
Energy: 0.8204115821933698
Energy: 0.8202976763048329
Energy: 0.8158240903510104
Energy: 0.9095003963911731
Energy: 0.8601329624223095
Energy: 0.8208528922296255
Energy: 0.8415604691795711
Energy: 0.7808851318859467
Energy: 0.8550831684085664
Energy: 0.865877738830403
Energy: 0.8303242984747765
Energy: 0.872921076392968

minimum gb energy = 0.7808851318859467 eV
minimum distance =  2.30849827953409 Angstroms
sigma value = 41


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

Energy: 0.7102549318139774
Energy: 0.6933083560273543
Energy: 0.6923703148439079
Energy: 0.6959649121921008
Energy: 0.6862282720643963
Energy: 0.7503444231708407
Energy: 0.6933139033664166
Energy: 0.6929738262876621
Energy: 0.6936209008233314
Energy: 0.7523018268177581
Energy: 0.7599434301563438
Energy: 0.7111682917605333
Energy: 0.7060780365763814
Energy: 0.7095028020388843
Energy: 0.7188146963397911
Energy: 0.7591497835593801
Energy: 0.7085991690734409
Energy: 0.7045534080816748
Energy: 0.7054261648052786
Energy: 0.7416177180135484
Energy: 0.7357298558822156
Energy: 0.7363284997252485
Energy: 0.7373482729552459
Energy: 0.7280076667076556
Energy: 0.7326039012437743
Energy: 0.7360274087945482
Energy: 0.7356559457661783
Energy: 0.7369072694377922
Energy: 0.7292870019848778
Energy: 0.7212216210574373
Energy: 0.7548014242507528
Energy: 0.7056281369721931
Energy: 0.7394923112517537
Energy: 0.7401528290118327
Energy: 0.7494573622752084
Energy: 0.7539430758961901
Energy: 0.7039100139092818
Energy: 0.7390588144887371
Energy: 0.725225595419081
Energy: 0.7503912512708334
Energy: 0.7551739628263212
Energy: 0.7274434299198195
Energy: 0.7413113372489484
Energy: 0.7537442773356516
Energy: 0.7615557532622678
Energy: 0.7560985627838462
Energy: 0.7408304206878773
Energy: 0.7495641752079326
Energy: 0.7590833972732863
Energy: 0.7596603853536787
Energy: 0.7578655726303579
Energy: 0.7365372394363873
Energy: 0.7505966121755826
Energy: 0.688418191224857
Energy: 0.7626713529959966
Energy: 0.7586844530690728
Energy: 0.7312064722744405
Energy: 0.7503213678364528
Energy: 0.6888522855179087
Energy: 0.7688267535784319
Energy: 0.7585030731395955
Energy: 0.7550866190163565
Energy: 0.7523739696280549
Energy: 0.7150114670727308
Energy: 0.7549929600756313
Energy: 0.75913530796038
Energy: 0.7566396768026762
Energy: 0.753004083585999
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Energy: 0.7096670882079648
Energy: 0.7283835108063562
Energy: 0.7369491748875399
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Energy: 0.7370620310081748
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Energy: 0.7373703533285629
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Energy: 0.7555696090083788
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Energy: 0.7310433388154733
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Energy: 0.7095647626651902
Energy: 0.7262842222137572
Energy: 0.7158619774490567
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Energy: 0.7584370775520056
Energy: 0.7059589284648681
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Energy: 0.7065244268679466
Energy: 0.7590298164935434
Energy: 0.7597284653717665
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Energy: 0.7056390275388479
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Energy: 0.7586417909128618
Energy: 0.719914318390861
Energy: 0.6948066996443955
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Energy: 0.6925733143476697
Energy: 0.8203755993092668
Energy: 0.7290220255664995
Energy: 0.7103407288744863
Energy: 0.6925966276175485
Energy: 0.6924290420770692
Energy: 0.7393334881328886
Energy: 0.7049075559053716
Energy: 0.6982109734198976
Energy: 0.7509175640803916
Energy: 0.7039620160653056
Energy: 0.761697205556958
Energy: 0.7053078875030218
Energy: 0.6933550144159282
Energy: 0.7085686908025807
Energy: 0.7042985088021286
Energy: 0.7598618836200388
Energy: 0.7044017488341264
Energy: 0.6964909561782755
Energy: 0.7066608053944542
Energy: 0.7523361978088581
Energy: 0.7354070681184776
Energy: 0.703744055981665
Energy: 0.696362292641885
Energy: 0.7080629267872381
Energy: 0.7633434185508248
Energy: 0.735488262291507
Energy: 0.6955978552852982
Energy: 0.7043196981828482
Energy: 0.693653907616839
Energy: 0.752224277634652
Energy: 0.7881834193420799
Energy: 0.6943305075682766
Energy: 0.7044661508430197
Energy: 0.6937004075557032
Energy: 0.7166517976162409
Energy: 0.7520314190039437
Energy: 0.6970205848567818
Energy: 0.7068559466235501
Energy: 0.7064314659349877
Energy: 0.7524125224188415
Energy: 0.7264594543879878
Energy: 0.695081929596968
Energy: 0.7076336319175661
Energy: 0.7040814904936327
Energy: 0.7557438289694717
Energy: 0.7267667562705646
Energy: 0.718459254584883
Energy: 0.7292683455131316
Energy: 0.7436315739934636
Energy: 0.7491920142835449
Energy: 0.7400533512478031
Energy: 0.7185923762557063
Energy: 0.7274194759419627
Energy: 0.716909637503186
Energy: 0.7494910428554511
Energy: 0.7399247240140193
Energy: 0.7412080299532359
Energy: 0.7287115950977097
Energy: 0.7465982135683512
Energy: 0.7169290571259789
Energy: 0.7364239542668178
Energy: 0.7408369773877311
Energy: 0.7274924766273867
Energy: 0.7333582267758988
Energy: 0.7448596089455739
Energy: 0.7404577964233255
Energy: 0.7416163638185486
Energy: 0.7544185204743019
Energy: 0.7276525965642737
Energy: 0.7590875028779307
Energy: 0.7046259439557933
Energy: 0.7491224442762151
Energy: 0.7561210958013003
Energy: 0.8296428806599755
Energy: 0.7608984658427184
Energy: 0.6961562573088981
Energy: 0.7595254777941144
Energy: 0.7566927846965235
Energy: 0.7617466649981919
Energy: 0.7580863010771092
Energy: 0.7201502449662385
Energy: 0.743020859709498
Energy: 0.7567794211031686
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Energy: 0.7585330624429867
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Energy: 0.7514932045898634
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Energy: 0.7466154814808798
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Energy: 0.6909057546627637
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Energy: 0.7080706672702508
Energy: 0.7555651723902124
Energy: 0.7509825942847927
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Energy: 0.7541529573589693
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Energy: 0.7404536140555962
Energy: 0.737025174622374
Energy: 0.7228268455486783
Energy: 0.753173483809107
Energy: 0.7755554843158086
Energy: 0.7494383070196042
Energy: 0.7377628175622517
Energy: 0.7192276005228078
Energy: 0.7567600337809539
Energy: 0.7633373816941434
Energy: 0.733404282209423
Energy: 0.704076289338494
Energy: 0.7189116626696627
Energy: 0.7802836633896842
Energy: 0.761239398852452
Energy: 0.7282526066192501
Energy: 0.7030210502621784
Energy: 0.7389053205735817
Energy: 0.7371122395406925
Energy: 0.7527619498480408
Energy: 0.7236838271124907
Energy: 0.6907544027970881
Energy: 0.7401297677680924
Energy: 0.7387997258674542
Energy: 0.7526990479764386
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Energy: 0.6913562372391009
Energy: 0.7388490595722282
Energy: 0.7579059301998521
Energy: 0.7043609509050779
Energy: 0.7045424839039117
Energy: 0.6946079893112338
Energy: 0.7432618931758156
Energy: 0.7670999604099439
Energy: 0.7039913530563995
Energy: 0.7041105146965344
Energy: 0.6943267656979576
Energy: 0.7239162126591389
Energy: 0.7515482994965049
Energy: 0.6929081796325723
Energy: 0.7086436731853137
Energy: 0.6958272845422371
Energy: 0.7202190837646267
Energy: 0.7591509967597533
Energy: 0.6926137127173254
Energy: 0.7076496778763792
Energy: 0.6979287083142198
Energy: 0.7532890892808928
Energy: 0.759765886626096
Energy: 0.7075906552626616
Energy: 0.6947155451171767
Energy: 0.6941324186718504
Energy: 0.7550501507755116
Energy: 0.772090976203731
Energy: 0.7054470781026506
Energy: 0.6954322890398736
Energy: 0.7057898432957961
Energy: 0.7181039761621978
Energy: 0.697166158011828
Energy: 0.7089619008132946
Energy: 0.7083145909636105
Energy: 0.7048790710062007
Energy: 0.720388288944882
Energy: 0.6981680600499075
Energy: 0.7072649278619466
Energy: 0.7043476196691939
Energy: 0.7289145417374389

minimum gb energy = 0.6862282720643963 eV
minimum distance =  2.32506859429484 Angstroms
sigma value = 185


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

Energy: 0.43613799766433836
Energy: 0.5513541593638457
Energy: 0.5503269883557067
Energy: 0.536493917350025
Energy: 0.31813127139387576
Energy: 0.3150467974816455
Energy: 0.5539497276946511
Energy: 0.546533741004601
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Energy: 0.4331935913269779
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Energy: 0.5454086375329811
Energy: 0.5527905585215523
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Energy: 0.5423931607061445
Energy: 0.5501745061382892
Energy: 0.31690395694316903
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Energy: 0.5221325617992605
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Energy: 0.3170437637533211
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Energy: 0.32498356276371054
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Energy: 0.5444594274255512
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Energy: 0.5744044038807782
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Energy: 0.5526662160371029
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Energy: 0.5597552501107553
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Energy: 0.5590428885252582
Energy: 0.5504594560840188
Energy: 0.5427247113766355
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Energy: 0.36118170988145964
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Energy: 0.3172589566361887
Energy: 0.3152799423641098
Energy: 0.56755085314918
Energy: 0.5477607201051683
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Energy: 0.3205911484672202
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Energy: 0.5642754491363954
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Energy: 0.3267147295584728
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Energy: 0.3290857063061428
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Energy: 0.5346898027505469
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Energy: 0.3285160632903201
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Energy: 0.5758710084935406
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Energy: 0.5637895471534684
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Energy: 0.5962661982991189
Energy: 0.5491239970212317
Energy: 0.5377538292555648
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Energy: 0.3595836898766227
Energy: 0.5478061007691798
Energy: 0.5464345047689223
Energy: 0.5453755006965199
Energy: 0.3153098064171209
Energy: 0.31594742906995577
Energy: 0.5451365423708345
Energy: 0.5438141943061685
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Energy: 0.5554746262724133
Energy: 0.3598673825014095
Energy: 0.5356295383799686
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Energy: 0.5646009617616722
Energy: 0.5691869400706993
Energy: 0.5628893622728992
Energy: 0.5475457980130206
Energy: 0.5690949912871691
Energy: 0.521019219803505
Energy: 0.329073410139663
Energy: 0.5410686610968738
Energy: 0.558076040119285
Energy: 0.5482421802342891
Energy: 0.550110130742983
Energy: 0.3299834357852844
Energy: 0.556755369082639
Energy: 0.6020089124753604
Energy: 0.5468983604681789
Energy: 0.33116768609075814
Energy: 0.3184671140196538
Energy: 0.5314019346579086
Energy: 0.5578239728394098
Energy: 0.5437640660130185
Energy: 0.3204087136645946
Energy: 0.318989093685975
Energy: 0.5641975377638642
Energy: 0.5408302859131937
Energy: 0.524588302376059
Energy: 0.534112686491482
Energy: 0.5452747884231146
Energy: 0.5318900215081589
Energy: 0.5468190535935599
Energy: 0.5598557425296145
Energy: 0.5427413996345726
Energy: 0.5487748361333766
Energy: 0.5368855278569054
Energy: 0.5421731030369599
Energy: 0.5299678606569657
Energy: 0.43321414877531245
Energy: 0.5455959381047302
Energy: 0.5401655446565178
Energy: 0.5539575874063144
Energy: 0.5497091426408662
Energy: 0.32123152964875284
Energy: 0.5498223246919858
Energy: 0.5370667692072356
Energy: 0.5931952038194378
Energy: 0.4332756802412033

minimum gb energy = 0.3143777407187321 eV
minimum distance =  2.41149086994385 Angstroms
sigma value = 33


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

Energy: 0.6739630230722299
Energy: 0.6539327746013885
Energy: 0.6759219371578817
Energy: 0.6725503343697055
Energy: 0.6478872388839094
Energy: 0.6458910468190332
Energy: 0.6509060094071513
Energy: 0.6807963990359952
Energy: 0.685300730739231
Energy: 0.6584713549351362
Energy: 0.6714055094907866
Energy: 0.683557494277808
Energy: 0.675812809165045
Energy: 0.6665060859959622
Energy: 0.6828459975763117
Energy: 0.650111446198016
Energy: 0.6764029410258966
Energy: 0.7013794134701908
Energy: 0.6658806484553911
Energy: 0.6807481979762364
Energy: 0.6515453163330428
Energy: 0.6700468712412865
Energy: 0.6684332262441324
Energy: 0.6791533726570819
Energy: 0.6587736514169321
Energy: 0.6524869035510866
Energy: 0.6552479688239577
Energy: 0.6719933410405233
Energy: 0.6889972234866689
Energy: 0.6566684702148975
Energy: 0.6812413426246787
Energy: 0.6880887928503217
Energy: 0.6755247906182342
Energy: 0.6609440604007142
Energy: 0.6647950161460827
Energy: 0.6581876372736358
Energy: 0.691656265891183
Energy: 0.6696331042701195
Energy: 0.6844395969794589
Energy: 0.6719548435411409
Energy: 0.677288341149433
Energy: 0.6705376109932181
Energy: 0.6923822652295972
Energy: 0.670313015956077
Energy: 0.6454491430082546
Energy: 0.6831571014033536
Energy: 0.691196541017419
Energy: 0.6911687400780344
Energy: 0.6714264356111715
Energy: 0.6675962119429265
Energy: 0.6815104634114372
Energy: 0.6773506716388398
Energy: 0.6870269035976313
Energy: 0.6722684144390059
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Energy: 0.6891829183761812
Energy: 0.6818272175724005
Energy: 0.6722839889678661
Energy: 0.6606811001337359
Energy: 0.6814634509515368
Energy: 0.669898004970697
Energy: 0.672867919443046
Energy: 0.6715032618921647
Energy: 0.6749521585905586
Energy: 0.7248423668384534
Energy: 0.6700998632107583
Energy: 0.6731232892887989
Energy: 0.6712157264883677
Energy: 0.693809353676171
Energy: 0.6720360285539272
Energy: 0.6834701663286805
Energy: 0.6698698113980638
Energy: 0.6897735018330554
Energy: 0.6704095208620142
Energy: 0.6715577821237763
Energy: 0.6842745171870656
Energy: 0.6691697731432072
Energy: 0.6850551248452814
Energy: 0.6712683456475974
Energy: 0.6710814278526563
Energy: 0.68181462764263
Energy: 0.6568471937366436
Energy: 0.6582459231353315
Energy: 0.679012634155053
Energy: 0.6703777126226971
Energy: 0.6822467301577367
Energy: 0.6568452431720917
Energy: 0.658951591727125
Energy: 0.6795026389818438
Energy: 0.697580288208318
Energy: 0.6537114287810951
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Energy: 0.6594578520489807
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Energy: 0.6675390180783908
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Energy: 0.6705878699790706
Energy: 0.6519372550844429
Energy: 0.6682187748895281
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Energy: 0.6671058401424274
Energy: 0.6785909662201037
Energy: 0.667338968838956
Energy: 0.6680872370975638
Energy: 0.6866733849494138
Energy: 0.6782784134253471
Energy: 0.6777021319764882
Energy: 0.6539879442483367
Energy: 0.6526941757966783
Energy: 0.6861690754932417
Energy: 0.662675277777619
Energy: 0.671138586957986
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Energy: 0.6726725528476797
Energy: 0.6523209290774947
Energy: 0.6623678353263628
Energy: 0.6749421751810306
Energy: 0.6642702902296962
Energy: 0.6658122292911265
Energy: 0.6677813137181465
Energy: 0.6714332986025991
Energy: 0.6688503345597722
Energy: 0.6631426759164987
Energy: 0.6680393083376822
Energy: 0.6524501596170247
Energy: 0.6523784417877063
Energy: 0.6452353841970887
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Energy: 0.6823564091131349
Energy: 0.6660188097510008
Energy: 0.6778515456014733
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Energy: 0.6471619057039145
Energy: 0.6452365226286766
Energy: 0.6519642776226284
Energy: 0.6787615424173575
Energy: 0.6688927161206317
Energy: 0.6724193572971171

minimum gb energy = 0.6452353841970887 eV
minimum distance =  2.32746248391445 Angstroms
sigma value = 219


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

Energy: 0.8719401799636728
Energy: 0.8967042020563672
Energy: 0.880893986299246
Energy: 0.875849474645693
Energy: 0.8860623922127905
Energy: 0.8718912397899975
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Energy: 0.86514377664526
Energy: 0.886685180610851
Energy: 0.8859767681344413
Energy: 0.8672358668575936
Energy: 0.8630840570396259
Energy: 0.884315500294162
Energy: 0.8745841662422511
Energy: 0.8774107242782129
Energy: 0.866235441473653
Energy: 0.8638958438117279
Energy: 0.900199934333411
Energy: 0.8711467011015771
Energy: 0.8910030451022034
Energy: 0.9043167047152192
Energy: 0.8679316472891859
Energy: 0.881248064256676
Energy: 0.8744639733635736
Energy: 0.8807710217085706
Energy: 0.896504157650827
Energy: 0.8687919933630128
Energy: 0.8777652402643158
Energy: 0.8682982067257747
Energy: 0.8751034172481513
Energy: 0.8755566353064294
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Energy: 0.8754325638902009
Energy: 0.8824308303267191
Energy: 0.8756021048246723
Energy: 0.8539991762818674
Energy: 0.8469066505751374
Energy: 0.87596714167731
Energy: 0.8771868578946824
Energy: 0.8762794553728189
Energy: 0.8781916986271839
Energy: 0.8744410711187717
Energy: 0.8898063567783384
Energy: 0.8822190772658295
Energy: 0.8759427510190602
Energy: 0.8816125058957669
Energy: 0.8740767481373277
Energy: 0.8888773835780869
Energy: 0.8750233432341128
Energy: 0.8469750849624753
Energy: 0.8715689158040671
Energy: 0.8759847695288572
Energy: 0.8757993097499638
Energy: 0.8773167216792455
Energy: 0.8476466289947113
Energy: 0.8712595677741526
Energy: 0.8758717371942489
Energy: 0.8895526060221647
Energy: 0.9035976701060964
Energy: 0.8863661718880631
Energy: 0.8722741675676958
Energy: 0.868690017949283
Energy: 0.8778772457034127
Energy: 0.8752515356973253
Energy: 0.8782104484323959
Energy: 0.8726221225887812
Energy: 0.8676313924393859
Energy: 0.88174755317109
Energy: 0.8763205996184144
Energy: 0.8708833840176201
Energy: 0.8867764736815519
Energy: 0.865447944344343
Energy: 0.8663511707537981
Energy: 0.8783778292144225
Energy: 0.8723798919263154
Energy: 0.8867746082731213
Energy: 0.8652181890533654
Energy: 0.8674498683267948
Energy: 0.8778511846895184

minimum gb energy = 0.8469066505751374 eV
minimum distance =  2.33783498137005 Angstroms
sigma value = 15


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

Energy: 0.9726006528810558
Energy: 1.0003957372323506
Energy: 1.007350381937274
Energy: 0.9826873363731655
Energy: 1.0040980408706697
Energy: 0.9714380247802834
Energy: 0.9905629072314832
Energy: 1.0042223596169477
Energy: 0.9959810552477155
Energy: 0.9944215512387478
Energy: 0.9870479976907436
Energy: 0.9921511403228809
Energy: 0.9903559963235394
Energy: 0.9915372185133753
Energy: 0.9954076547452606
Energy: 0.9914526340632343
Energy: 0.9830812590663595
Energy: 0.9928199166223577
Energy: 0.9985958991366237
Energy: 0.9975212344146072
Energy: 0.996899462555916
Energy: 0.9907879607847464
Energy: 0.9988811167365309
Energy: 0.9854464798346624
Energy: 0.9829622013887594
Energy: 1.02203707686657
Energy: 0.9797602760402669
Energy: 0.9945314497942804
Energy: 0.9806661347601922
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minimum gb energy = 0.9615721740141827 eV
minimum distance =  2.28939393196431 Angstroms
sigma value = 293


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

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Energy: 1.0142720966245309
Energy: 0.9962566933515237
Energy: 0.999212649978465
Energy: 1.0113222995185556
Energy: 0.9962242883967566
Energy: 1.0144254248310989
Energy: 1.0511271325356852
Energy: 0.9790642777866413
Energy: 1.0111708573736211
Energy: 0.9876793430098844
Energy: 1.0066388613874155
Energy: 1.050192554983943
Energy: 0.9813870852777753
Energy: 0.9990982516541217
Energy: 1.0191080325046766
Energy: 1.0195146596771196
Energy: 0.9803477047233152
Energy: 0.9780973851539996
Energy: 1.01115271622267
Energy: 0.9823610196144978
Energy: 1.0202574731420193
Energy: 0.9789501529470407
Energy: 1.0348975659878972
Energy: 1.0182093485439951
Energy: 0.9498142293505254
Energy: 1.0127555205430725
Energy: 0.9834182942695632
Energy: 0.981392292386249
Energy: 0.9902759912013541
Energy: 0.9488609862877295
Energy: 1.004222304632418
Energy: 0.9836273046178873
Energy: 0.9814393461436597
Energy: 0.9872107284175874
Energy: 1.0065286944455047
Energy: 0.9768018802575518
Energy: 0.9798886126354983
Energy: 0.975753108081839
Energy: 0.983973385596551
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Energy: 0.9770460827461288
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Energy: 0.9747816557724143
Energy: 0.984030873245155
Energy: 1.0012007377368686
Energy: 0.9822105405008854
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Energy: 1.0035069873159583
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Energy: 1.011269399351107
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Energy: 0.9558650455626836
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Energy: 1.005785569193708
Energy: 1.0148558115999784
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Energy: 1.0307106167290592
Energy: 0.9851728588926351
Energy: 0.9820034914380875
Energy: 1.0186647566812568
Energy: 0.9644455812129564
Energy: 0.9711867345013925
Energy: 0.9822584466981555
Energy: 0.9825228837709107
Energy: 0.979352060147214
Energy: 0.9863718543725627
Energy: 1.0045705078166964
Energy: 0.9851994272688301
Energy: 0.9806315428526121
Energy: 0.9808328482809175
Energy: 0.9829230631655648
Energy: 0.992533176670318
Energy: 0.9835242412155506
Energy: 0.9817251943709742
Energy: 0.9728955173529255
Energy: 0.9730679338773113
Energy: 0.9946603832021446
Energy: 0.9799125461976069
Energy: 0.9996800742899992
Energy: 0.9727194787688515
Energy: 0.9744062592556152
Energy: 0.9931485552426276
Energy: 0.979684508740563
Energy: 1.0072334677577515
Energy: 0.9745626156275434
Energy: 0.9876627309051537
Energy: 1.0133353235146034
Energy: 1.0083028449595346
Energy: 1.0079642876078614
Energy: 0.973259820833658
Energy: 1.0174012264368537
Energy: 1.006655017943845
Energy: 1.0205934395445846
Energy: 0.995647987814994
Energy: 1.0019124639763026
Energy: 0.984726885715975
Energy: 1.004078433944463
Energy: 1.0097311563298368
Energy: 1.0307890957754344
Energy: 1.0040257201534581
Energy: 1.0196318166973586
Energy: 1.0034772910960654
Energy: 1.007510431312742
Energy: 0.9886065523957932
Energy: 0.9844225729819032
Energy: 0.9673544000365354
Energy: 1.0293366246677451
Energy: 0.9836169338109768
Energy: 0.9857360617072628
Energy: 0.9871888234481689
Energy: 0.9673506302911803
Energy: 0.9798553440996778
Energy: 0.9878430251240667
Energy: 0.9854551430062615
Energy: 0.9709561907641384
Energy: 0.9864125199885329
Energy: 0.9484736388575508
Energy: 0.9490961679439475
Energy: 0.9705064258869607
Energy: 0.9787031354249597
Energy: 0.9991422743569799
Energy: 0.9480777542884333
Energy: 0.9485278523841112
Energy: 0.9863430649017568
Energy: 0.9843787404375469
Energy: 0.9823070660231747
Energy: 0.9872102518366077
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Energy: 0.9866848341049527
Energy: 0.9822317937134946
Energy: 1.0184820925752964
Energy: 0.9688383460588917
Energy: 0.977821680847206
Energy: 1.0114317364053216
Energy: 0.9710264518259778
Energy: 0.9755846133194345
Energy: 1.017162790810223
Energy: 0.9789080514870301
Energy: 1.0120772094456283
Energy: 0.9708060353640949
Energy: 0.9824098350861671
Energy: 1.0012864970735589
Energy: 0.9830674431578241
Energy: 0.9631648321730433
Energy: 0.9904988359941819
Energy: 0.9957135988707815
Energy: 0.9855926927109755
Energy: 1.0279514422231204
Energy: 0.9990298328364454
Energy: 0.9804694608366663
Energy: 1.0233596405774361
Energy: 0.9807470128755742
Energy: 0.9573649851128836
Energy: 1.0320365365323398
Energy: 0.9787271859284885
Energy: 0.9779689887570758
Energy: 1.0196290019465146
Energy: 1.0332737394210318
Energy: 1.0332965279351245
Energy: 0.9769982839044041
Energy: 0.9765674137932445
Energy: 1.0125307133790122
Energy: 0.9572156532881918
Energy: 0.9890214390119231
Energy: 0.9827727693260411
Energy: 0.9793339260539741
Energy: 1.0180337734829454
Energy: 0.9784383545815618
Energy: 0.9871847020003572
Energy: 0.9833146883006302
Energy: 0.977722787517346
Energy: 1.0010211329402676
Energy: 0.9774844436345715
Energy: 0.9978124409039999
Energy: 1.0053237364605343
Energy: 1.0000040957797502
Energy: 0.9743155240904393
Energy: 0.9728040469135616
Energy: 0.9894580594911431
Energy: 1.008137632010271
Energy: 0.9963436175286726
Energy: 0.9729108187699237
Energy: 0.9732964784541401
Energy: 0.9824547181899029
Energy: 1.020371173110924
Energy: 1.0182274311226425
Energy: 0.9809087545612235
Energy: 1.007926708603725
Energy: 0.9809153842037527
Energy: 1.00830746574304
Energy: 1.0214901809400894
Energy: 1.0093551839908643
Energy: 1.0082006983334422
Energy: 0.9836085586011659
Energy: 1.0066039616349307
Energy: 0.9724228272284359
Energy: 0.9853631204139203
Energy: 1.0088862564992434
Energy: 0.9901863974064431
Energy: 1.0099618512667814
Energy: 0.9889357883816676
Energy: 0.9841675982269993
Energy: 1.0245643021835515
Energy: 0.954062950141083
Energy: 1.0243114721499618
Energy: 0.985734554682386
Energy: 0.9722795532307316
Energy: 1.0132615926331252
Energy: 0.9987620153023151
Energy: 0.9845332845943083
Energy: 0.9816576041316274
Energy: 0.988035606829111
Energy: 1.0060889351861908

minimum gb energy = 0.9476724414371389 eV
minimum distance =  2.28751738200735 Angstroms
sigma value = 293


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

Energy: 0.9333042204454687
Energy: 0.9566555846507468
Energy: 1.021891233780386
Energy: 0.9554169514512992
Energy: 0.9428484487443978
Energy: 0.933827405744314
Energy: 0.959091443973057
Energy: 1.0217085490672524
Energy: 0.9569643058914397
Energy: 0.941300237154516
Energy: 1.0097621314038612
Energy: 0.9501169877764643
Energy: 0.9496344446300116
Energy: 0.9493516517066771
Energy: 0.9510372972356321
Energy: 1.0060498575194503
Energy: 0.9504019915392694
Energy: 0.9404193027449597
Energy: 0.9501515547734949
Energy: 0.9517036868046036
Energy: 0.9549193770864944
Energy: 0.950855987973052
Energy: 0.9513155784135264
Energy: 0.956953064110644
Energy: 1.0077753697552465
Energy: 0.9549457551824951
Energy: 0.9505499299282156
Energy: 0.9504447448522714
Energy: 1.024200166900533
Energy: 1.0081326699433213
Energy: 1.0268688781605138
Energy: 0.9360590977388111
Energy: 0.940124152559137
Energy: 0.9542974287272331
Energy: 1.0297064177637059
Energy: 1.0258614261834949
Energy: 0.9353707938531821
Energy: 0.9407502011583835
Energy: 0.9585212835536119
Energy: 0.9371651334497126
Energy: 0.9528197371093942
Energy: 0.9401004722772804
Energy: 0.9350216976605794
Energy: 0.9522950701098034
Energy: 0.9515779462610422
Energy: 0.951586907675691
Energy: 0.9427170337511886
Energy: 0.9356876011551882
Energy: 0.9508375008733894
Energy: 0.9503111210362097
Energy: 0.9503140797948358
Energy: 1.0257355647006514
Energy: 0.9603354776208769
Energy: 0.9513550960530223
Energy: 0.9414712304476097
Energy: 0.9513596051018107
Energy: 1.0227615070803648
Energy: 0.9579981136091776
Energy: 0.9537806728277372
Energy: 0.9431599795391119
Energy: 0.9619138128379306
Energy: 0.9381072449299802
Energy: 0.9510260371766386
Energy: 0.951116813758263
Energy: 0.9507644677244977
Energy: 0.9521655461466622
Energy: 0.9369281000271249
Energy: 0.9503947132751834
Energy: 0.9503658073886363
Energy: 0.95106791067253
Energy: 0.9530023307461611
Energy: 1.0034690477991604
Energy: 0.9574456258062104
Energy: 0.9345708306569689
Energy: 0.9399299735857343
Energy: 0.9580936425178299
Energy: 1.0026391706712383
Energy: 0.9549865330011231
Energy: 0.9344012251678311
Energy: 0.9400891592149878
Energy: 0.9498475638376652
Energy: 0.9403668074646061
Energy: 0.9499802935291048
Energy: 0.9385758199884529
Energy: 1.0095085887467923
Energy: 0.9498559851185263
Energy: 0.9501198042225892
Energy: 0.949932839007839
Energy: 0.9373027212740765
Energy: 1.0158132104787883
Energy: 0.9580436863925461
Energy: 0.9525464337968775
Energy: 1.0031963369282362
Energy: 1.0257588321829445
Energy: 0.9563660607556287
Energy: 0.9602635659903156
Energy: 0.9544794385533726
Energy: 1.0035452723081169
Energy: 0.9569415966707203
Energy: 0.9507606408048402
Energy: 0.9369242268513048
Energy: 0.9550773181761818
Energy: 0.9484534797436782
Energy: 0.9507808863661418
Energy: 1.011413623950906
Energy: 0.9372582550261896
Energy: 0.9521044804844979
Energy: 0.9355913467952534
Energy: 0.9522857697635179
Energy: 1.0098203205316092
Energy: 0.9335093219436175
Energy: 0.9563293352652936
Energy: 1.020914996675573
Energy: 0.9563110143386978
Energy: 0.9431825664345477
Energy: 0.9341617946883408
Energy: 0.9587222196012886
Energy: 1.0239996884105305
Energy: 0.9574692821534797
Energy: 0.9415860998858466
Energy: 1.0103482774359474
Energy: 0.9499461939727613
Energy: 0.9493394258235361
Energy: 0.9493938210710249
Energy: 0.9508051438704633
Energy: 1.0064848034382554
Energy: 0.9506509648961704
Energy: 0.9404571971471256
Energy: 0.9502013059393609
Energy: 0.9523069411137686
Energy: 0.95920165782388
Energy: 0.95224437780332
Energy: 0.9518243291092023
Energy: 1.0286172282170165
Energy: 1.007268739949705
Energy: 0.9560373773310771
Energy: 0.9507919019052797
Energy: 0.9505027530753861
Energy: 1.0228439702023546
Energy: 1.0075916433045762
Energy: 1.028291191156972
Energy: 0.9360691701421594
Energy: 0.9395460229364619
Energy: 0.9510499183188422
Energy: 1.0181444735886116
Energy: 1.0256527898197307
Energy: 0.9356679563039837
Energy: 0.940483737228929
Energy: 0.9520606317963448
Energy: 1.007555212062246
Energy: 0.9532211585245052
Energy: 0.9404679691575727
Energy: 0.9349477263222052
Energy: 0.9511362476508591
Energy: 0.9517754460723646
Energy: 0.9515420104190766
Energy: 0.940157178198085
Energy: 0.9356332605784983
Energy: 0.9504108440852523
Energy: 0.9503950887475887
Energy: 0.9502372035923017
Energy: 1.0260379975215688
Energy: 0.9612334569454841
Energy: 0.9510727138431834
Energy: 0.941656661656553
Energy: 0.9508759663685746
Energy: 1.0232672884022913
Energy: 0.958906836969966
Energy: 0.9533886952604529
Energy: 0.9422098767105106
Energy: 0.9600371477013937
Energy: 0.9382608476885588
Energy: 0.9512312733407557
Energy: 0.9511017904775836
Energy: 0.9508867198673714
Energy: 0.9537299495236606
Energy: 0.9368904378813935
Energy: 0.950893192966004
Energy: 0.9505821214974586
Energy: 0.9510399809035657
Energy: 0.9532401235429077
Energy: 1.0035021987044688
Energy: 0.9597174832700749
Energy: 0.9347298584721399
Energy: 0.9401744547293114
Energy: 0.9589115735683195
Energy: 1.0021884278153117
Energy: 0.9557104788362318
Energy: 0.9343072960591249
Energy: 0.9409972979311289
Energy: 0.9498781142661844
Energy: 0.9403014042331598
Energy: 0.9510904140336044
Energy: 0.9388069439306276
Energy: 1.0102232568436347
Energy: 0.9496404094625867
Energy: 0.9496182225032661
Energy: 0.9500277340362847
Energy: 0.9374075944193153
Energy: 0.951647925458124
Energy: 0.9583058342443058
Energy: 0.9523070370957116
Energy: 1.002516769231409
Energy: 1.0261748055391386
Energy: 0.9562867621088549
Energy: 0.9600678595906658
Energy: 0.9539196111468531
Energy: 1.0047804684531918
Energy: 0.9587048688342306
Energy: 0.9525148149259768
Energy: 0.936619057898377
Energy: 0.953579381158301
Energy: 0.9502816939941391
Energy: 0.9513825954918798
Energy: 1.0111923891827723
Energy: 0.9374505112827954
Energy: 0.9516280507386655
Energy: 0.9355396737635258
Energy: 0.9524135323691214
Energy: 1.009585401314487

minimum gb energy = 0.9333042204454687 eV
minimum distance =  2.30660988209388 Angstroms
sigma value = 15


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

Energy: 0.9277920879054803
Energy: 1.04005036912051
Energy: 1.0539371353270037
Energy: 0.9694396562818687
Energy: 1.0428377316011255
Energy: 0.9292850681831372
Energy: 1.0069271710093677
Energy: 1.020086892937286
Energy: 0.9662524098176271
Energy: 0.9677517209437339
Energy: 0.9351930551223592
Energy: 0.9847162484203441
Energy: 0.9675456004590235
Energy: 0.9681207738699961
Energy: 0.9631060393547447
Energy: 0.9188060048773997
Energy: 0.985223338422883
Energy: 0.9654253417120503
Energy: 1.000151371026419
Energy: 0.97599673312777
Energy: 1.0522795353973078
Energy: 0.9619426498984482
Energy: 0.9317943553647721
Energy: 0.995509019152988
Energy: 0.9536735447613203
Energy: 1.027492751206747
Energy: 0.9880317343990448
Energy: 0.9456224853315431
Energy: 0.9821367426550905
Energy: 1.0622983267682018
Energy: 0.9406898890524649
Energy: 0.9277932181949273
Energy: 0.9827463275439904
Energy: 1.0330710629105644
Energy: 1.075980838722407
Energy: 0.9996604002566388
Energy: 0.92672612985201
Energy: 0.9847113521816324
Energy: 1.0520434163866588
Energy: 1.0624937325615968
Energy: 1.0614199246600837
Energy: 1.021091446676999
Energy: 0.9253776114808445
Energy: 0.9316111039027548
Energy: 1.0199834350803043
Energy: 1.0268415858896194
Energy: 1.0030234242026455
Energy: 0.967268435247194
Energy: 0.9321274857885492
Energy: 0.9171738200659114
Energy: 0.9177751957150576
Energy: 0.9302924051117444
Energy: 0.9301939900147308
Energy: 1.039119688290666
Energy: 1.1448833681153068
Energy: 0.9366187032339339
Energy: 0.9306726365887374
Energy: 0.9302928290146362
Energy: 1.0446994620067143
Energy: 1.2346664947906405
Energy: 0.9355132915809765
Energy: 0.9299750602012156
Energy: 0.9319184897478701
Energy: 0.9630838351510478
Energy: 1.0548403071545958
Energy: 0.9339089403311125
Energy: 0.9305070127456246
Energy: 0.9312869299462294
Energy: 0.9464068914048239
Energy: 1.0457459182587308
Energy: 0.939815510625666
Energy: 0.9322887385032665
Energy: 0.9656073505734979
Energy: 0.9277018068286026
Energy: 1.0188986028824474
Energy: 0.9353994395488617
Energy: 0.9320955823641975
Energy: 0.9713388687107275
Energy: 0.927354056029566
Energy: 1.0327386937632594
Energy: 0.9325715549916797
Energy: 1.1396336173932384
Energy: 0.9799586118531793
Energy: 0.9877216411057262
Energy: 0.9324094059780043
Energy: 0.9317049578143931
Energy: 1.1430663573034843
Energy: 1.049905503037852
Energy: 0.9856611111211211
Energy: 0.9333327671784807
Energy: 0.996872069054605
Energy: 0.9300536042498468
Energy: 0.9398792314359878
Energy: 0.9530988328337897
Energy: 0.953165380958079
Energy: 0.9830445716745826
Energy: 0.9331795067524191
Energy: 0.9488647476833275
Energy: 0.9444814903887547
Energy: 0.9490039308127561
Energy: 1.01660202566322
Energy: 1.0123956086306134
Energy: 0.932901537664095
Energy: 0.9503544091025858
Energy: 0.9516634677470074
Energy: 0.9907813106449561
Energy: 0.9394761631293246
Energy: 0.9422364778818563
Energy: 0.9423977987602418
Energy: 0.9456468517302049
Energy: 1.087536957214784
Energy: 0.9822241377331666
Energy: 0.9430088458081736
Energy: 0.9189205934671212
Energy: 1.0346187283205956
Energy: 1.086516236381442
Energy: 0.9831103602312143
Energy: 0.9253712051998485
Energy: 0.9186124734113581
Energy: 0.9905837178507662
Energy: 1.0044973009182807
Energy: 0.9296677398621017
Energy: 0.9335313400523518
Energy: 1.0062514341566675
Energy: 0.9381058150918553
Energy: 1.007355106276343
Energy: 0.9913905869326542
Energy: 0.93175414694686
Energy: 1.036663627558972
Energy: 0.9912189186633829
Energy: 0.964635373448031
Energy: 0.990342548651735
Energy: 1.0423424826143457
Energy: 0.9939247410833053
Energy: 0.9827390246828324
Energy: 0.9646873156144301
Energy: 0.9923194125050607
Energy: 0.9140982706194892
Energy: 0.998489227841827
Energy: 0.9547111540086175
Energy: 0.9477792083963384
Energy: 0.9543715771035706
Energy: 1.0763586370524365
Energy: 0.9821445305146879
Energy: 0.9783683534464298
Energy: 0.9464762710791902
Energy: 0.9463515475460824
Energy: 1.0699626365897286
Energy: 0.9938119067048284
Energy: 0.9483932481896851
Energy: 1.0914214755150913
Energy: 1.0789057484784985
Energy: 0.9527995000167286
Energy: 0.9821928344583383
Energy: 0.9907291461338648
Energy: 1.0804804698465513
Energy: 1.0708894987120106
Energy: 0.9447936420492126
Energy: 0.9823817889915768
Energy: 0.9527009050815238
Energy: 0.9208021740246507
Energy: 0.9401836557547274
Energy: 0.9585428409056215
Energy: 1.059834785649453
Energy: 1.027044724046653
Energy: 0.9250299265209359
Energy: 0.9376724168035431
Energy: 0.9718430508254625
Energy: 1.0733352452081069
Energy: 0.9959135744254553
Energy: 1.030431029654332
Energy: 1.103794561862621
Energy: 1.109869286597325
Energy: 0.9923170476004783
Energy: 0.9357238190736177
Energy: 1.0992453232248232
Energy: 1.1044374521256226
Energy: 1.1090850823553844
Energy: 0.9738285381680674
Energy: 0.9336152710699794
Energy: 0.9326714829739534
Energy: 0.9518856763403154
Energy: 0.9588452629155881
Energy: 0.9353052308448166
Energy: 0.9394100430156617
Energy: 0.9320840402838394
Energy: 0.9180101453100475
Energy: 0.9381718353007584
Energy: 0.9346202502326988
Energy: 0.9389752918793399
Energy: 0.9208829105982315
Energy: 1.0270548459518245
Energy: 0.9943725377768347
Energy: 0.9322663108069259
Energy: 0.9344227972687437
Energy: 0.9278490142051155
Energy: 1.027231208715847
Energy: 0.99511854153221
Energy: 0.9320096705474775
Energy: 0.9354968239565097
Energy: 1.0107878979090696
Energy: 0.9265970295064015
Energy: 0.9390501083751368
Energy: 0.9284181587651605
Energy: 0.9737389535228275
Energy: 1.046217458558198
Energy: 0.9263408762529699
Energy: 0.9379966676736552
Energy: 0.9182133964778042
Energy: 0.9929554814755812
Energy: 0.9529851852699579
Energy: 0.9172479062949636
Energy: 1.0053523018546213
Energy: 1.1457824663250438
Energy: 0.9323041996580516
Energy: 0.95306346316605
Energy: 0.9519543407164858
Energy: 1.0499179423947698
Energy: 1.1501520986400702
Energy: 0.9332918876246735
Energy: 0.9622303986133625
Energy: 0.953113327502131
Energy: 0.9277075027260118
Energy: 0.9324344975371248
Energy: 0.9595283945447401
Energy: 0.9610017919046308
Energy: 0.9527876353095934
Energy: 0.9697332124947877
Energy: 0.9772300925415102
Energy: 0.9484434739034645
Energy: 0.9192578520860033
Energy: 0.9361048963014907
Energy: 1.0810204321878185
Energy: 1.080213764628598
Energy: 1.0659109710002403
Energy: 0.922595993328227
Energy: 0.9364354013648363
Energy: 1.0818174509707674
Energy: 1.0475091951395636
Energy: 1.067292169556841
Energy: 1.037697189966931
Energy: 1.0744500329909161
Energy: 0.989189713807604
Energy: 0.9945134464132164
Energy: 0.9132340056662239
Energy: 0.9302510719857376
Energy: 1.0743724645017887
Energy: 0.9903712082088157
Energy: 0.9692837337577966
Energy: 0.931490617406247
Energy: 0.9742712900428822
Energy: 0.9555148830989891
Energy: 0.9634006865554993
Energy: 0.9894925552750796
Energy: 1.0034604425715041
Energy: 0.9947103109525726
Energy: 0.9399318387669444
Energy: 0.9631674398986799
Energy: 0.9883328706619877
Energy: 1.0265049461007556
Energy: 1.0537985325356076
Energy: 0.969479626225777
Energy: 0.9708675840675365
Energy: 0.9755455250205196
Energy: 0.9872794535710967
Energy: 1.0557876330134373
Energy: 0.9669163130687392
Energy: 0.9329528615059121
Energy: 0.9789554219861597
Energy: 0.9175969658715724
Energy: 0.9547223277552541
Energy: 1.0539588936723396
Energy: 0.9815321524750805
Energy: 1.0596978099558352
Energy: 1.0793989093500804
Energy: 0.9550286945940656
Energy: 1.0640504845331917
Energy: 0.9543382334632599
Energy: 1.0854667618591
Energy: 1.0927705233224732
Energy: 1.059451481101782
Energy: 1.0211509184035215
Energy: 0.9940264995884386
Energy: 0.9334823073020854
Energy: 1.0757844142769362
Energy: 1.0717366833164192
Energy: 0.9920024942551676
Energy: 0.9950661955899404
Energy: 0.9336035574866455
Energy: 1.0389958279398492
Energy: 1.1076736012827073
Energy: 0.9314652199221675
Energy: 0.9322046245498324
Energy: 1.1081143735431565
Energy: 1.1100595463265994
Energy: 1.088000495301048
Energy: 0.932172295789138
Energy: 0.9323028840134181
Energy: 1.1075221857440853
Energy: 1.1063892936606847
Energy: 0.9347259374334843
Energy: 0.9352506028083587
Energy: 0.9324071543350541
Energy: 0.9467967333525417
Energy: 0.9757418890434035
Energy: 0.9337338698764965
Energy: 0.9353973574595998
Energy: 0.9326182780186206
Energy: 0.952717258824677
Energy: 1.0870783785674203
Energy: 0.9373013368327622
Energy: 0.9336630101059494
Energy: 0.9379458251723264
Energy: 0.9259792138247359
Energy: 1.033440947489673
Energy: 0.9354839852684639
Energy: 0.9327014584862241
Energy: 0.93865666412181
Energy: 0.9265906015854665
Energy: 1.0250379833878636
Energy: 1.0152448068867397
Energy: 0.9657862330740073
Energy: 1.0002615206679426
Energy: 0.9913785312365678
Energy: 1.0140420720027308
Energy: 0.986704452282555
Energy: 0.9640268752861016
Energy: 1.040339692094233
Energy: 0.9903107967990087
Energy: 0.924859300791579
Energy: 0.9847129183781027
Energy: 0.917308412058812
Energy: 0.9740112942222722
Energy: 0.925851214958516
Energy: 0.9478579254371625
Energy: 0.9828960084215494
Energy: 0.9171087558869035
Energy: 0.9474898339901557
Energy: 0.9205508933330616
Energy: 0.9437542805854747
Energy: 1.015161501567699
Energy: 0.9424689476060366
Energy: 0.9405927031369015
Energy: 0.9451872708122293
Energy: 0.944990323445674
Energy: 1.0034808770879742
Energy: 0.9621044084653558
Energy: 0.9483291626127092
Energy: 0.9532945383850215
Energy: 0.9525192577381698
Energy: 1.0876367312064672
Energy: 1.0467283786386192
Energy: 0.9252768814796508
Energy: 0.9255879127458941
Energy: 0.9811918328018225
Energy: 1.085226191364008
Energy: 1.0537285031415429
Energy: 0.9178182951997367
Energy: 0.9182026006925958
Energy: 0.9848594479415652
Energy: 1.0060659802050618
Energy: 0.9356611644824534
Energy: 0.9301870727775571
Energy: 0.9356113049992998
Energy: 0.9745747443492565
Energy: 1.0057887497211468
Energy: 0.9186291078220102
Energy: 0.9351657903091507
Energy: 0.9400645314382248
Energy: 0.9541992608608316
Energy: 0.9629214493172463
Energy: 1.0104152165556661
Energy: 1.0095961016137387
Energy: 0.9516745499608371
Energy: 0.948422936254888
Energy: 0.963535736441639
Energy: 1.0081564950525472
Energy: 0.9313623055126968
Energy: 0.9337392885768258
Energy: 0.9524431938154403
Energy: 0.9307542062837714
Energy: 0.9829473544838753
Energy: 1.0699727582094005
Energy: 0.99436723089229
Energy: 0.9801437272873225
Energy: 0.9481425647871979
Energy: 0.9851232971850812
Energy: 1.0618530091046208
Energy: 0.9480557323091426
Energy: 0.9862532809644294
Energy: 1.1088624390811903
Energy: 1.072596528102323
Energy: 0.9444125929207956
Energy: 1.048841363958206
Energy: 0.9688678103200918
Energy: 1.0757652353986855
Energy: 1.0769222817523203
Energy: 0.9520407441751145
Energy: 1.0419155626581937
Energy: 0.9191202295647597
Energy: 0.9336975759558245
Energy: 1.0336133499717022
Energy: 0.9825601965626212
Energy: 1.0894914030721603
Energy: 0.9906856652964658
Energy: 0.9320588290729758
Energy: 1.0123143021941625
Energy: 0.9780743278391651
Energy: 1.0759459667535978
Energy: 0.9938378465862089
Energy: 1.0716414404677743
Energy: 1.1060168553089604
Energy: 1.1055854544035084
Energy: 0.9716770571405707
Energy: 0.9332564581576831
Energy: 1.0662539606861805
Energy: 1.1062409769929775
Energy: 1.1046157977121782
Energy: 1.0001242477581762
Energy: 0.932082272684674
Energy: 0.9314716634350254
Energy: 0.9382722352441233
Energy: 0.9416101121050202
Energy: 0.9304097451231188
Energy: 0.9368278929526557
Energy: 0.9315618609756461
Energy: 0.9581003882629358
Energy: 0.9366917145023875
Energy: 0.9311732854606082
Energy: 0.9382667288586563
Energy: 0.9403901164713296
Energy: 0.9909673806817227
Energy: 1.0030313062991754
Energy: 0.9308927541834042
Energy: 0.9326975327148983
Energy: 0.9995740745484267
Energy: 1.027790736421048
Energy: 0.9850093985387686
Energy: 0.9304999932842004
Energy: 0.9330811386402591
Energy: 1.0029644884719713
Energy: 0.9263538498059248
Energy: 0.9528099345500887
Energy: 0.9914301605242833
Energy: 1.000422477535756
Energy: 0.99298358277237
Energy: 0.9261510275441408
Energy: 0.9418841556228138
Energy: 0.9911788137283384
Energy: 1.013949651484076
Energy: 0.9358627015896901
Energy: 0.933792522433176
Energy: 0.989155905561819
Energy: 1.1540731510958662
Energy: 0.9332842751623681
Energy: 0.9190214580612136
Energy: 0.9186375906380075
Energy: 0.9959555191704411
Energy: 1.1448435359056588
Energy: 0.9338775036912179
Energy: 0.9461450591651124
Energy: 0.9365026890027472
Energy: 0.9412583515967343
Energy: 0.9310235801147165
Energy: 0.922666503256998
Energy: 0.953503500198875
Energy: 0.9495705055692557
Energy: 0.9605987152893539
Energy: 0.9324044905116117
Energy: 0.9338095402723261
Energy: 0.9356126310348434
Energy: 0.9323477341155594
Energy: 1.085935214111466
Energy: 1.0794559627036477
Energy: 1.024358270250651
Energy: 0.9203825126452363
Energy: 0.972851760175811
Energy: 1.0857333210102529
Energy: 0.999682440037651
Energy: 1.0118234559547126
Energy: 0.9449065181640914
Energy: 1.0282527530315186
Energy: 0.9316232744951346
Energy: 0.9302982147495827
Energy: 0.9138599758674737
Energy: 0.9307063605138107
Energy: 1.0460313778205297
Energy: 0.9907156526154637
Energy: 0.977727107439176
Energy: 0.9188329109918273

minimum gb energy = 0.9132340056662239 eV
minimum distance =  2.27490796424816 Angstroms
sigma value = 437


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

Energy: 1.2867711719802155
Energy: 0.9061201472424044
Energy: 0.9821431783803104
Energy: 0.9552766064069352
Energy: 0.8677177747078538
Energy: 0.9388418078754845
Energy: 0.90530603993864
Energy: 0.8525340986069886
Energy: 0.9564420814742022
Energy: 0.9787569508306959
Energy: 0.8512722037992734
Energy: 0.985533833334907
Energy: 0.8498286179368558
Energy: 1.038194048332418
Energy: 0.8522999852301857
Energy: 0.8504546474345712
Energy: 0.9845781170146859
Energy: 0.8513848778202661
Energy: 0.983848068534309
Energy: 0.8532044669224816
Energy: 0.9472815599622219
Energy: 0.9614590544489845
Energy: 0.8898413938610237
Energy: 0.8881293393822788
Energy: 0.8580082892737431
Energy: 0.9468828373319017
Energy: 0.9624395148812471
Energy: 0.8908880699414483
Energy: 0.8861039096698216
Energy: 0.9531561531207776
Energy: 0.8852281972510353
Energy: 0.8885988027771222
Energy: 0.8912762430233242
Energy: 0.948875714215294
Energy: 0.8513335280534116
Energy: 0.8867273503109736
Energy: 0.8872667696052899
Energy: 0.8875016241006367
Energy: 0.9490213823277933
Energy: 0.8906335080378435
Energy: 0.866110716149031
Energy: 0.9066490572074252
Energy: 0.8633318818728897
Energy: 0.8792876228702524
Energy: 0.9291173480406945
Energy: 0.8668390102532075
Energy: 0.9067014436915105
Energy: 0.8621457824501036
Energy: 0.8751443864117229
Energy: 0.9295817005935778
Energy: 0.9080907320818413
Energy: 0.8858164871428045
Energy: 0.8499354342056867
Energy: 0.8719956501572308
Energy: 0.926237852785017
Energy: 0.9095374932806384
Energy: 0.8843700749200345
Energy: 0.8495386214139731
Energy: 0.8716124446884915
Energy: 0.9270481432612391
Energy: 0.9543646319476854
Energy: 0.9467418202942508
Energy: 0.9466291873222622
Energy: 0.8832313518012858
Energy: 0.88864406778674
Energy: 0.9532193998776646
Energy: 0.9463604330515124
Energy: 0.9465864851656721
Energy: 0.8842100862246732
Energy: 0.8889865112171157
Energy: 0.961774977027917
Energy: 0.8531973478545987
Energy: 0.8836207469702344
Energy: 0.8869357649771724
Energy: 0.9906999711534726
Energy: 0.9612719215297755
Energy: 0.8490089857411285
Energy: 0.8844978892888932
Energy: 0.8873749191471471
Energy: 0.9881635478094323
Energy: 0.8843800674859584
Energy: 0.8902021369576589
Energy: 0.9025110430313836
Energy: 0.891449631971547
Energy: 0.8856121853746797
Energy: 0.8833237915439205
Energy: 0.8895515156397596
Energy: 0.9021671787752886
Energy: 0.8526142412661304
Energy: 0.8838277486684141
Energy: 0.9074338888013269
Energy: 0.8739727035387693
Energy: 0.8537478229636298
Energy: 0.8499155345208176
Energy: 0.9142018400797133
Energy: 0.8643807358444898
Energy: 0.8778681345976564
Energy: 0.852870748378287
Energy: 1.0389483265617345
Energy: 0.9129186482497088
Energy: 0.8512800575973809
Energy: 0.8500381674283866
Energy: 0.9019060925115449
Energy: 0.926138820106717
Energy: 0.8523927581889021
Energy: 0.8504222117094096
Energy: 0.8499853116335936
Energy: 0.9050432120314752
Energy: 0.9266909470750876
Energy: 0.8893149152991042
Energy: 0.8551218724792048
Energy: 0.8561549285966041
Energy: 0.8558902373627582
Energy: 1.0159355259962157
Energy: 0.8529094482444897
Energy: 0.852502981088004
Energy: 0.8489889391268042
Energy: 0.8574770005891786
Energy: 0.9584194136308147
Energy: 0.8523152156829772
Energy: 0.850747338357907
Energy: 0.8530534135052388
Energy: 0.8905245715945451
Energy: 0.9830149275021729
Energy: 0.860074257418324
Energy: 0.8512834260978818
Energy: 0.8638261162963196
Energy: 0.8903985477967458
Energy: 0.982422704179322
Energy: 0.8513583490476337
Energy: 0.8476102443923517
Energy: 0.9111415077184071
Energy: 0.9881328073304244
Energy: 0.8511440634303798
Energy: 0.8598231707402836
Energy: 0.8530784269329074
Energy: 0.9096836857230166
Energy: 1.086188133393592
Energy: 0.8542200049734389
Energy: 0.9075013027493489

minimum gb energy = 0.8476102443923517 eV
minimum distance =  2.33898147004922 Angstroms
sigma value = 33