%chk=000032873.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032873

0 1
 O  -0.1281000      0.6365000     -5.5999998E-03
 O  -0.3684000      -1.054000      -1.549400    
 N    1.266300       3.151700      0.2011000    
 C    1.260800      0.7394000     -0.3160000    
 C    1.904900       1.869500      0.4964000    
 C    1.911100     -0.5946000     -2.1700000E-02
 C    2.994400      -1.000800     -0.7818000    
 C    1.409300      -1.380300       1.001700    
 C    1.424800       3.487700      -1.213300    
 C    1.826600       4.207800       1.043400    
 C  -0.8225000     -0.3038000     -0.6994000    
 C    3.594200      -2.230600     -0.5104000    
 C    2.009200      -2.610100       1.273000    
 C    3.101700      -3.035200      0.5169000    
 C   -2.248700     -0.3089000     -0.2867000    
 C   -2.958200      -1.490500     -0.3544000    
 C   -2.820300      0.8678000      0.1521000    
 C   -4.298100      -1.495500      3.3500001E-02
 C   -4.160100      0.8627000      0.5400000    
 C   -4.899000     -0.3190000      0.4807000    
 H    1.358400      0.9217000      -1.393100    
 H    2.986200       1.909900      0.3079000    
 H    1.770000       1.652000       1.564600    
 H    3.386300     -0.3800000      -1.582300    
 H   0.5800000      -1.064100       1.627400    
 H   0.7929000       2.866900      -1.855400    
 H    2.465700       3.414200      -1.548800    
 H    1.088900       4.515100      -1.400500    
 H    1.313100       5.158700      0.8625000    
 H    2.898100       4.354700      0.8652000    
 H    1.682000       3.973300       2.104000    
 H    4.445400      -2.561200      -1.098500    
 H    1.630200      -3.233700       2.077300    
 H    3.569800      -3.991900      0.7293000    
 H   -2.500200      -2.413600     -0.6971000    
 H   -2.271200       1.803700      0.1948000    
 H   -4.873300      -2.415700     -1.1900000E-02
 H   -4.629300       1.779400      0.8854000    
 H   -5.942400     -0.3228000      0.7823000    


%chk=000032873-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000032873

0 1
O -0.056256 0.013995 0.054866
O -0.797278 0.453974 -2.120683
N 1.016050 2.735029 -0.351142
C 1.354636 0.230190 -0.369685
C 1.801505 1.610082 0.181037
C 2.213254 -0.892486 0.187018
C 3.358945 -1.312354 -0.532991
C 1.930764 -1.486648 1.441997
C 1.294827 3.037139 -1.769702
C 1.083231 3.931855 0.510549
C -1.046936 0.239760 -0.907565
C 4.214297 -2.306270 -0.006650
C 2.780678 -2.485995 1.965679
C 3.927471 -2.895989 1.245972
C -2.418670 0.152728 -0.325401
C -3.524200 0.291885 -1.204138
C -2.639624 -0.061101 1.059566
C -4.839434 0.217280 -0.701866
C -3.957344 -0.135511 1.558236
C -5.058737 0.002836 0.680146
H 1.376974 0.227815 -1.474620
H 2.898935 1.709232 -0.029779
H 1.684802 1.584825 1.280606
H 3.577684 -0.868188 -1.512193
H 1.034067 -1.178871 1.989515
H 1.027251 2.174735 -2.402972
H 2.365285 3.308954 -1.955818
H 0.663961 3.884335 -2.091176
H 0.393758 4.703060 0.123065
H 2.105612 4.384623 0.569856
H 0.763096 3.673513 1.535653
H 5.095525 -2.625076 -0.574576
H 2.548758 -2.946373 2.932823
H 4.585906 -3.671326 1.653500
H -3.328383 0.457661 -2.268632
H -1.779640 -0.162650 1.726781
H -5.691226 0.324968 -1.382106
H -4.127790 -0.300095 2.627820
H -6.081253 -0.055141 1.070211


