%chk=000017024.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017024

0 1
 O    3.444900       1.381700      0.9219000    
 O   -2.906300       2.249200      0.9680000    
 O  -0.4997000      -3.640400      0.9291000    
 N   2.4499999E-02  1.2900000E-02  0.5509000    
 C    1.099900      0.8841000       1.004800    
 C   -1.270900      0.4959000       1.033900    
 C   0.2505000      -1.363300      0.9978000    
 C    2.467000      0.4444000      0.4690000    
 C   -1.611300       1.886500      0.4868000    
 C  -0.8307000      -2.322800      0.4885000    
 C    2.515700      0.3911000      -1.063200    
 C   -1.630200       1.933900      -1.046300    
 C  -0.9425000      -2.334200      -1.041400    
 C    3.900300      2.6000001E-02  -1.584800    
 C   -2.043300       3.301400      -1.577000    
 C   -1.967700      -3.346400      -1.538100    
 H    1.142100      0.9381000       2.101500    
 H   0.9616000       1.915300      0.6629000    
 H   -1.311500      0.5135000       2.131800    
 H   -2.095200     -0.1496000      0.7166000    
 H   0.3066000      -1.427200       2.093200    
 H    1.198900      -1.764300      0.6256000    
 H    2.768100     -0.5172000      0.8958000    
 H  -0.9352000       2.651100      0.8794000    
 H   -1.801700      -2.105800      0.9430000    
 H    1.795500     -0.3396000      -1.446800    
 H    2.244800       1.369500      -1.478300    
 H  -0.6433000       1.686300      -1.451800    
 H   -2.340100       1.192700      -1.433400    
 H   -1.222400      -1.343500      -1.415100    
 H   2.7899999E-02  -2.590800      -1.483500    
 H    3.869800     -9.1899998E-02  -2.672900    
 H    4.247200     -0.9177000      -1.152200    
 H    4.635500      0.8046000      -1.360200    
 H   -2.003300       3.307300      -2.671000    
 H   -1.370600       4.082700      -1.209100    
 H   -3.065100       3.556200      -1.279300    
 H   -2.083700      -3.257800      -2.623300    
 H   -2.945900      -3.173200      -1.078600    
 H   -1.658200      -4.373900      -1.324600    
 H    4.320300      0.9697000      0.8283000    
 H   -3.550000       1.615700      0.6072000    
 H   -1.297600      -4.190600      0.8542000    


%chk=000017024-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017024

0 1
O 3.590272 0.958641 1.102516
O -2.589499 2.805033 1.076602
O -0.976542 -3.631921 1.150262
N -0.025214 -0.013466 0.928804
C 1.243973 0.648109 1.336764
C -1.225156 0.765032 1.340895
C -0.089566 -1.435495 1.361756
C 2.449305 0.274596 0.448724
C -1.505478 2.004983 0.455242
C -0.997438 -2.312995 0.475131
C 2.288579 0.710929 -1.020187
C -1.832265 1.651496 -1.007885
C -0.518242 -2.410473 -0.985863
C 3.479122 0.306513 -1.916179
C -1.957437 2.892786 -1.914649
C -1.447553 -3.255091 -1.884219
H 1.513361 0.418895 2.394278
H 1.115687 1.743371 1.271646
H -1.155670 1.111734 2.399838
H -2.107955 0.097730 1.279672
H -0.436756 -1.537177 2.417018
H 0.925599 -1.869317 1.318890
H 2.618240 -0.825309 0.479922
H -0.646920 2.699034 0.488113
H -2.038293 -1.916814 0.484571
H 1.355440 0.257797 -1.405121
H 2.152417 1.810435 -1.046767
H -1.037823 0.976510 -1.379524
H -2.777506 1.065476 -1.029010
H -0.441794 -1.380208 -1.382340
H 0.504038 -2.838486 -0.991475
H 3.296895 0.587671 -2.968938
H 3.650540 -0.786877 -1.886016
H 4.416774 0.809499 -1.608583
H -2.283109 2.616138 -2.934067
H -0.987499 3.417630 -2.000836
H -2.688691 3.608729 -1.498649
H -1.097222 -3.251471 -2.931936
H -2.481856 -2.860100 -1.875480
H -1.482913 -4.314649 -1.562928
H 4.420954 0.727842 0.616103
H -3.432569 2.286076 1.010009
H -1.565531 -4.253235 0.653195


