%chk=000041932.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041932

0 1
 O    4.684100      0.2370000     -0.8168000    
 O  -0.5062000       2.429300      0.1725000    
 O   -1.643100      -2.785700     -8.4500000E-02
 N    2.041900       1.986000      0.3685000    
 C   0.3375000      0.2129000      0.1717000    
 C   2.9600000E-02  -1.147400      0.1039000    
 C    1.671000      0.6218000      0.2943000    
 C   -2.137200      0.7825000     -1.4000000E-02
 C   -2.445200     -0.5780000     -8.1799999E-02
 C    2.689800     -0.3299000      0.3483000    
 C  -0.7346000       1.227600      0.1151000    
 C   -1.373000      -1.592600     -2.5400000E-02
 C    1.055100      -2.099000      0.1585000    
 C    2.382500      -1.687300      0.2806000    
 C    4.124700      6.9899999E-02  0.4788000    
 C   -3.162600       1.734100     -6.8400003E-02
 C   -3.778500     -0.9868000     -0.2039000    
 C   -4.490100       1.322300     -0.1901000    
 C   -4.797300     -3.5100002E-02 -0.2579000    
 C    6.051600      0.6184000     -0.7496000    
 H   0.8415000      -3.163300      0.1069000    
 H    3.166800      -2.439000      0.3187000    
 H    4.260900      0.9683000       1.091000    
 H    4.675100     -0.7243000       1.001700    
 H   -2.952100       2.799000     -1.7800000E-02
 H   -4.044300      -2.039100     -0.2586000    
 H    1.330700       2.703400      0.3451000    
 H    3.003500       2.276200      0.2663000    
 H   -5.285200       2.061100     -0.2322000    
 H   -5.831600     -0.3530000     -0.3527000    
 H    6.156900       1.577800     -0.2337000    
 H    6.640300     -0.1508000     -0.2406000    
 H    6.428600      0.7282000      -1.769900    


%chk=000041932-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041932

0 1
O 4.643829 0.794031 -0.606061
O -0.402923 2.463632 -0.104023
O -1.786666 -2.882317 0.185989
N 2.148550 1.829731 0.001820
C 0.339634 0.165335 0.072897
C -0.028161 -1.220962 0.145042
C 1.742441 0.523394 0.092077
C -2.125862 0.786434 -0.073320
C -2.499994 -0.585789 0.003050
C 2.735533 -0.519418 0.223880
C -0.691485 1.205609 -0.035980
C -1.462366 -1.651949 0.116312
C 0.957454 -2.220923 0.231737
C 2.326171 -1.860074 0.272329
C 4.191670 -0.166585 0.428027
C -3.131167 1.779365 -0.181815
C -3.869982 -0.947011 -0.030143
C -4.491384 1.413180 -0.215512
C -4.862908 0.045879 -0.139328
C 6.070694 1.103005 -0.476058
H 0.637483 -3.265584 0.274661
H 3.087735 -2.644364 0.359869
H 4.336343 0.307148 1.427591
H 4.816272 -1.082061 0.383244
H -2.816005 2.825704 -0.237836
H -4.123653 -2.010122 0.030496
H 1.403903 2.539805 -0.076252
H 3.136962 2.002908 -0.210529
H -5.263734 2.185308 -0.300610
H -5.920922 -0.236353 -0.165692
H 6.302259 1.548871 0.514447
H 6.687313 0.191375 -0.614828
H 6.304067 1.827299 -1.271480


