%chk=000162275.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162275

0 1
 O    2.490400      -2.308700     -0.4747000    
 O   0.8317000      -1.823700       1.046000    
 N  -6.5200001E-02  0.7417000      0.5958000    
 C    1.284600      0.9796000      0.2856000    
 C    2.178800     -7.7900000E-02  0.1391000    
 C    1.717600       2.293700      0.1258000    
 C   -2.300900      0.3338000     -0.2464000    
 C    3.514400      0.1804000     -0.1692000    
 C    3.053200       2.551800     -0.1827000    
 C    3.951600       1.495200     -0.3301000    
 C  -0.8787000      0.5872000     -0.4128000    
 C   -3.117600      0.1792000      -1.366600    
 C   -2.848600      0.2448000       1.033500    
 C    1.750100      -1.460900      0.3015000    
 C   -4.481700     -6.4000003E-02  -1.207100    
 C   -4.212800      1.4000000E-03   1.192900    
 C   -5.029300     -0.1531000      7.2499998E-02
 C    2.162200      -3.700500     -0.4031000    
 H    1.025500       3.124000      0.2396000    
 H    4.243500     -0.6185000     -0.2766000    
 H    3.393800       3.575500     -0.3070000    
 H    4.992200       1.696800     -0.5669000    
 H  -0.4999000      0.6449000      -1.450800    
 H   -2.705600      0.2457000      -2.370300    
 H   -2.236800      0.3603000       1.924200    
 H   -5.117700     -0.1843000      -2.079300    
 H   -4.639600     -6.8099998E-02   2.189200    
 H   -6.091500     -0.3426000      0.1967000    
 H    1.130400      -3.861600     -0.7292000    
 H    2.832900      -4.243500      -1.074100    
 H    2.307800      -4.070000      0.6162000    


%chk=000162275-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162275

0 1
O 3.021230 -2.475506 0.247861
O 0.767315 -2.177072 -0.260453
N -0.114069 0.423786 0.088895
C 1.231389 0.762561 -0.134639
C 2.262761 -0.236221 -0.122471
C 1.609925 2.134083 -0.241070
C -2.504162 0.506320 -0.359271
C 3.622648 0.162580 -0.204396
C 2.964380 2.506874 -0.329836
C 3.980280 1.520636 -0.309010
C -1.095572 0.776654 -0.694863
C -3.532189 0.981982 -1.217502
C -2.853034 -0.229351 0.807723
C 1.902060 -1.677094 -0.063359
C -4.887974 0.737865 -0.911324
C -4.206266 -0.472668 1.110141
C -5.227741 0.011252 0.253828
C 2.754961 -3.929161 0.303851
H 0.824250 2.897090 -0.214322
H 4.388804 -0.617082 -0.191294
H 3.228899 3.567360 -0.410254
H 5.034163 1.809497 -0.373882
H -0.909909 1.277932 -1.668725
H -3.265085 1.542400 -2.122646
H -2.044851 -0.602918 1.444457
H -5.675922 1.108567 -1.576009
H -4.472181 -1.043062 2.007022
H -6.279942 -0.181639 0.491799
H 2.392214 -4.293594 -0.672594
H 3.722904 -4.382270 0.561491
H 1.995516 -4.151200 1.072551


