%chk=000074583.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074583

0 1
 O   -2.378100       2.046900      0.6330000    
 O    4.214600       1.143100     -0.1458000    
 O    4.264800      -1.009600      0.2812000    
 N   -1.965100     -0.1301000     -0.1794000    
 N    3.632400      4.7800001E-02  4.3200001E-02
 C  -0.5719000     -8.5800000E-02 -0.1241000    
 C   -2.617400      -1.361700     -0.7231000    
 C   9.6100003E-02   1.121100     -0.3315000    
 C   0.1533000      -1.248000      0.1386000    
 C   -2.803300      0.9827000      0.1763000    
 C   -2.983500      -2.330000      0.3827000    
 C    1.489200       1.165700     -0.2763000    
 C    1.546400      -1.203400      0.1938000    
 C    2.214300      3.4000000E-03 -1.3600000E-02
 C   -4.291800      0.8580000     -5.5000000E-02
 H   -3.507600      -1.100800      -1.300600    
 H   -1.937400      -1.838600      -1.439700    
 H  -0.4186000       2.039300     -0.5946000    
 H  -0.3041000      -2.215200      0.2952000    
 H   -2.146400      -2.624000       1.017100    
 H   -3.737100      -1.903300       1.051400    
 H   -3.408800      -3.242100     -4.8799999E-02
 H    1.977000       2.120500     -0.4549000    
 H    2.079300      -2.128800      0.3980000    
 H   -4.704100     -1.6799999E-02  0.4480000    
 H   -4.503700      0.8247000      -1.126700    
 H   -4.793400       1.739400      0.3583000    


%chk=000074583-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000074583

0 1
O -2.435929 2.166988 0.258338
O 4.309587 1.145450 0.128074
O 4.334185 -1.136009 0.038379
N -2.024673 -0.095943 -0.286275
N 3.713100 0.000161 0.052685
C -0.593988 -0.041534 -0.172958
C -2.651403 -1.416586 -0.599103
C 0.125104 1.192951 -0.090727
C 0.161207 -1.257144 -0.166591
C -2.873111 1.025391 -0.065040
C -2.944613 -2.274731 0.650883
C 1.527070 1.203653 -0.019372
C 1.562147 -1.247103 -0.094460
C 2.241343 -0.013213 -0.022744
C -4.377947 0.821682 -0.248431
H -3.584657 -1.235099 -1.152387
H -1.990174 -1.954427 -1.298908
H -0.425871 2.131029 -0.071575
H -0.331982 -2.229677 -0.204658
H -2.031226 -2.467105 1.238511
H -3.669227 -1.775511 1.318004
H -3.373349 -3.247607 0.349105
H 2.075758 2.147487 0.037148
H 2.135993 -2.177359 -0.087419
H -4.780615 -0.023278 0.335444
H -4.638796 0.662541 -1.311441
H -4.862833 1.749392 0.088219


