%chk=000092918.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092918

0 1
 O   -1.476200     -0.4949000       1.057200    
 O   -1.633000       2.293300      -1.192400    
 O   -3.724600       1.323500      0.2648000    
 O   -2.136900      -3.146600      0.4252000    
 O    1.124900       2.643600      0.6389000    
 N   0.5204000      0.4463000      0.2874000    
 N    2.808000       1.190800      0.1925000    
 N    4.550400     -0.2580000     -0.2597000    
 C   -1.611500      0.9270000     -0.8336000    
 C   -2.994500      0.3902000     -0.5311000    
 C  -0.8833000      0.6779000      0.4760000    
 C   -2.683500     -0.8227000      0.3352000    
 C   -2.425000      -2.088200     -0.4715000    
 C   0.9498000     -0.8401000       0.000000    
 C    1.472400       1.488800      0.3859000    
 C    2.232100      -1.161300     -0.1929000    
 C    3.204200     -2.7300000E-02 -7.8400001E-02
 C    2.706300      -2.542400     -0.5033000    
 H   -1.167300      0.3592000      -1.660000    
 H   -3.590200      0.1745000      -1.421900    
 H   -1.017800       1.512400       1.174500    
 H   -3.459600      -1.009800       1.086100    
 H   -1.591200      -1.985000      -1.170000    
 H   -3.318900      -2.358800      -1.043300    
 H  -0.7101000       2.585400      -1.284200    
 H   -3.263500       1.447500       1.111000    
 H   0.2070000      -1.619600     -6.8400003E-02
 H   -1.987700      -3.944000     -0.1109000    
 H    1.877100      -3.256300     -0.5535000    
 H    3.397500      -2.894700      0.2691000    
 H    3.218700      -2.564800      -1.470600    
 H    4.924300      -1.176300     -0.4721000    
 H    5.218800      0.5015000     -0.1850000    


%chk=000092918-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092918

0 1
O -1.499831 -0.678938 1.068415
O -1.838903 2.545343 -0.503681
O -3.856088 1.226397 0.586424
O -1.960893 -3.188941 -0.134141
O 0.809660 2.516209 -0.218299
N 0.562765 0.235018 0.232493
N 2.697376 1.132774 -0.424856
N 4.536461 -0.257510 -0.650430
C -1.689933 1.108581 -0.569861
C -3.079191 0.447415 -0.364500
C -0.853092 0.539310 0.620353
C -2.728329 -0.920897 0.251640
C -2.482580 -1.997006 -0.814929
C 1.077813 -1.042923 0.292939
C 1.371494 1.366044 -0.150445
C 2.407729 -1.293494 -0.007722
C 3.198049 -0.126308 -0.359505
C 2.999635 -2.684161 0.051239
H -1.237538 0.786933 -1.530230
H -3.627590 0.348482 -1.324033
H -0.823090 1.273750 1.447207
H -3.499147 -1.253548 0.964591
H -1.760423 -1.636399 -1.579694
H -3.451643 -2.208368 -1.316015
H -0.891211 2.890536 -0.400820
H -3.531738 2.167668 0.490618
H 0.367774 -1.819645 0.595299
H -2.004166 -3.962109 -0.750657
H 2.232724 -3.422026 0.340641
H 3.816973 -2.752943 0.796668
H 3.410081 -3.001532 -0.928152
H 5.010526 -1.155483 -0.625439
H 5.053426 0.588871 -0.884120


