%chk=000170466.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170466

0 1
 O    1.071100     -0.9729000     -0.9436000    
 O   -1.836700      -1.646900     -0.6929000    
 O   0.1781000       1.273100     -0.7691000    
 O    1.076200      -3.470200      0.1031000    
 O   -1.682800       2.749300      7.2999999E-02
 O   -1.524800      -3.891400      -1.070300    
 O    2.254500      -2.583100       1.881500    
 O    6.304800       2.217900      0.4305000    
 N   -3.367500       1.219500     -0.4176000    
 C   -1.116000     -0.6079000      2.0999999E-03
 C   0.2728000      -1.182600      0.2230000    
 C   -1.092700      0.6426000     -0.8685000    
 C   -4.490300       2.009200      3.6899999E-02
 C  -2.6000001E-02  -2.655500      0.3972000    
 C   -5.742600       1.716800     -0.7964000    
 C   -4.752300       1.786300       1.530200    
 C   -6.332100      0.3374000     -0.5020000    
 C   -5.343300      0.4067000       1.820800    
 C   -6.594400      0.1435000      0.9884000    
 C   -2.057000       1.662100     -0.3588000    
 C    1.212200      0.4168000      -1.272700    
 C   -1.188500      -2.844500     -0.5405000    
 C    2.571900      0.8981000     -0.8181000    
 C    3.685000      0.7260000      -1.641600    
 C    2.714300       1.514000      0.4258000    
 C    2.171800      -3.343200      0.9261000    
 C    4.939100       1.169200      -1.221600    
 C    3.968500       1.957200      0.8456000    
 C    5.080900       1.784900      2.2100000E-02
 C    3.266800      -4.270900      0.4944000    
 C    6.379200       2.838800       1.713000    
 H   -1.626200     -0.4527000      0.9611000    
 H   0.7743000     -0.7368000       1.087300    
 H   -1.325100      0.4369000      -1.921300    
 H   -4.222700       3.063500     -0.1072000    
 H  -0.4035000      -2.872400       1.405300    
 H   -5.514400       1.793400      -1.866300    
 H   -6.502100       2.478300     -0.5778000    
 H   -5.454200       2.551300       1.886100    
 H   -3.827900       1.912900       2.106500    
 H   -7.270200      0.2170000      -1.055900    
 H   -5.654700     -0.4465000     -0.8604000    
 H   -5.588500      0.3303000       2.886200    
 H   -4.594900     -0.3675000       1.611900    
 H   -7.394000      0.8230000       1.308600    
 H   -6.951000     -0.8764000       1.170700    
 H    1.170600      0.4869000      -2.366800    
 H   -3.549200      0.2775000     -0.7514000    
 H    3.587800      0.2456000      -2.611500    
 H    1.863100       1.651400       1.087200    
 H    5.802100       1.031600      -1.867300    
 H    4.008100       2.425000       1.823400    
 H    4.125200      -4.155300       1.162200    
 H    2.918200      -5.305000      0.5494000    
 H    3.580100      -4.023200     -0.5228000    
 H    7.424700       3.120600       1.875500    
 H    5.790100       3.761500       1.748100    
 H    6.107600       2.142300       2.513600    


%chk=000170466-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170466

0 1
O 1.038860 -0.854012 -1.035879
O -1.986705 -1.450465 -0.057801
O 0.266616 1.419312 -0.624313
O 0.899506 -3.511223 -0.434564
O -1.972841 2.985215 -0.314349
O -2.013717 -3.734921 -0.501620
O 2.459881 -3.444884 1.295216
O 6.411951 2.068274 1.069885
N -3.404728 1.143243 -0.439947
C -0.972162 -0.414750 0.323476
C 0.422567 -1.117341 0.266705
C -1.021728 0.730189 -0.718859
C -4.650360 1.917991 -0.222021
C 0.061856 -2.615515 0.359242
C -5.833929 1.233060 -0.947996
C -4.952090 2.090555 1.292807
C -6.259272 -0.096935 -0.274404
C -5.366590 0.758736 1.962151
C -6.566325 0.110524 1.228786
C -2.163139 1.745178 -0.463510
C 1.340661 0.600405 -1.196967
C -1.388849 -2.736939 -0.138046
C 2.646761 1.007399 -0.542656
C 3.800340 0.200945 -0.730015
C 2.754583 2.202892 0.203000
C 2.131681 -3.857069 0.163057
C 5.034694 0.578364 -0.176931
C 3.991400 2.596013 0.761706
C 5.134794 1.781251 0.569280
C 2.919511 -4.749711 -0.761069
C 6.575833 3.300581 1.846244
H -1.219994 -0.061360 1.338938
H 1.088333 -0.788387 1.083238
H -1.150947 0.270923 -1.721903
H -4.465199 2.917143 -0.657852
H 0.106654 -2.919593 1.424756
H -5.577296 1.070513 -2.012347
H -6.692362 1.933384 -0.925401
H -5.777695 2.824330 1.394346
H -4.067138 2.530078 1.788850
H -7.144870 -0.508357 -0.794948
H -5.459931 -0.860526 -0.381766
H -5.616995 0.935410 3.025718
H -4.509001 0.054064 1.952202
H -7.453745 0.769488 1.330806
H -6.827831 -0.855836 1.700908
H 1.354117 0.705877 -2.300650
H -3.463423 0.122542 -0.524214
H 3.720894 -0.731957 -1.299110
H 1.865192 2.823848 0.342770
H 5.931070 -0.035678 -0.304184
H 4.048661 3.526416 1.334004
H 3.832256 -5.096065 -0.256351
H 2.306656 -5.611641 -1.074086
H 3.188524 -4.191775 -1.675271
H 7.638072 3.320975 2.130193
H 6.334416 4.193926 1.238239
H 5.946027 3.289402 2.756909


