%chk=000031642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031642

0 1
 O   8.2999999E-03 -6.0000003E-04   1.893900    
 N   0.3645000      -1.439400      0.1405000    
 C  -0.2558000      0.8478000     -0.3244000    
 C   0.7163000      -2.699600      0.7635000    
 C   0.4244000      -1.943400      -1.216500    
 C    1.144900      -3.164900     -0.6332000    
 C   4.7100000E-02 -0.2266000      0.6854000    
 C   0.7519000       1.996200     -0.1586000    
 C   -1.692000       1.353700     -0.1177000    
 C    2.201300       1.538100     -0.3520000    
 C   -2.737300      0.2547000     -0.3357000    
 C    3.177500       2.687800     -0.1562000    
 C   -4.151000      0.7963000     -0.1890000    
 H  -0.1764000      0.4776000      -1.350700    
 H  -0.1492000      -3.216100       1.187100    
 H    1.520900      -2.625600       1.498600    
 H    1.032400      -1.349800      -1.902800    
 H  -0.5644000      -2.139000      -1.640200    
 H    2.229600      -3.157300     -0.7895000    
 H   0.7470000      -4.134700     -0.9451000    
 H   0.5232000       2.786500     -0.8848000    
 H   0.6484000       2.445100      0.8380000    
 H   -1.808600       1.764900      0.8935000    
 H   -1.886100       2.177100     -0.8167000    
 H    2.459600      0.7471000      0.3602000    
 H    2.327100       1.123500      -1.358900    
 H   -2.620500     -0.1753000      -1.337200    
 H   -2.599100     -0.5577000      0.3860000    
 H    4.205300       2.341900     -0.3045000    
 H    2.983700       3.492900     -0.8722000    
 H    3.100400       3.100300      0.8549000    
 H   -4.346300       1.586700     -0.9207000    
 H   -4.881400     -2.9000000E-03 -0.3495000    
 H   -4.311200       1.207400      0.8128000    


%chk=000031642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031642

0 1
O -0.011912 -0.121010 1.944427
N 0.400108 -1.486252 0.135573
C -0.257791 0.871091 -0.300310
C 0.769629 -2.751248 0.827322
C 0.609329 -2.027214 -1.240867
C 1.010040 -3.399005 -0.585541
C 0.051317 -0.275094 0.679704
C 0.758144 2.026244 -0.079509
C -1.717244 1.356886 -0.082256
C 2.218835 1.652877 -0.419934
C -2.788450 0.292673 -0.411437
C 3.192902 2.833798 -0.220157
C -4.226393 0.822644 -0.224623
H -0.158661 0.506100 -1.344337
H -0.054306 -3.181215 1.423178
H 1.660026 -2.651665 1.472711
H 1.414700 -1.520607 -1.803721
H -0.307073 -2.050015 -1.858471
H 2.049157 -3.706218 -0.775739
H 0.332099 -4.231308 -0.826669
H 0.448379 2.892950 -0.699082
H 0.696032 2.343098 0.980100
H -1.822568 1.670709 0.974807
H -1.887626 2.255756 -0.709990
H 2.537933 0.803214 0.216117
H 2.272822 1.301221 -1.471993
H -2.654126 -0.053803 -1.457949
H -2.636206 -0.591936 0.238151
H 4.232972 2.548450 -0.463821
H 2.917092 3.690710 -0.863764
H 3.175100 3.183403 0.829039
H -4.418941 1.692095 -0.881590
H -4.978664 0.047373 -0.460494
H -4.392155 1.148000 0.819427


