%chk=000019307.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019307

0 1
 O    2.323700      -2.339200      0.6462000    
 O   -2.085700      -2.763800     -0.5265000    
 N   0.5972000     -0.7525000      0.3956000    
 N  -0.7545000     -0.8532000      1.1900000E-02
 N   0.1429000      -2.921000      8.2999997E-02
 C    1.360000      0.4359000      9.8499998E-02
 C    2.459100      0.6493000       1.142600    
 C    1.941600      0.3605000      -1.315300    
 C    3.313400       1.871800      0.8173000    
 C    2.798000       1.582500      -1.637200    
 C    3.890500       1.795500     -0.5932000    
 C    1.156200      -2.042600      0.4287000    
 C   -1.030700      -2.231400     -0.2069000    
 C   -1.725900      0.1809000      6.0800001E-02
 C   -2.906400      7.5199999E-02 -0.6823000    
 C   -1.511100       1.313800      0.8527000    
 C   -3.861200       1.091000     -0.6342000    
 C   -2.466000       2.329500      0.9010000    
 C   -3.641100       2.218000      0.1574000    
 H   0.7392000       1.328600      0.1048000    
 H    3.130600     -0.2120000       1.210200    
 H    2.010900      0.7715000       2.136300    
 H    1.133400      0.2804000      -2.052800    
 H    2.557400     -0.5400000      -1.433600    
 H    4.128100       1.957600       1.545200    
 H    2.703800       2.778800      0.9135000    
 H    2.159600       2.473400      -1.684400    
 H    3.252600       1.463600      -2.627200    
 H    4.440200       2.716600     -0.8172000    
 H    4.612200      0.9711000     -0.6477000    
 H   0.2498000      -3.926600      1.6500000E-02
 H   -3.101700     -0.7672000      -1.337600    
 H  -0.6644000       1.401900       1.526500    
 H   -4.773100       1.007900      -1.218200    
 H   -2.305700       3.196700       1.534800    
 H   -4.386100       3.007200      0.1978000    


%chk=000019307-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019307

0 1
O 2.293574 -2.366864 0.801942
O -2.198298 -2.738846 -0.641225
N 0.566314 -0.751532 0.405861
N -0.769141 -0.870319 -0.141836
N 0.067899 -2.921032 0.116646
C 1.400340 0.426383 -0.011168
C 2.385457 0.817658 1.114248
C 2.127672 0.179733 -1.355798
C 3.194883 2.069980 0.697782
C 2.937406 1.435090 -1.763004
C 3.927012 1.851360 -0.648304
C 1.116731 -2.052078 0.494140
C -1.103808 -2.245356 -0.281687
C -1.729028 0.178536 0.042582
C -2.826891 0.264165 -0.849225
C -1.591735 1.105986 1.106813
C -3.785875 1.282605 -0.667158
C -2.549894 2.129970 1.263024
C -3.649747 2.224440 0.379476
H 0.683992 1.259231 -0.147893
H 3.066430 -0.030646 1.309374
H 1.824246 1.008807 2.049213
H 1.388168 -0.074561 -2.139893
H 2.812070 -0.683230 -1.242521
H 3.921927 2.318564 1.493905
H 2.511827 2.940409 0.604904
H 2.240302 2.274503 -1.967389
H 3.480803 1.235855 -2.706126
H 4.465062 2.772974 -0.942362
H 4.691429 1.057542 -0.523295
H 0.154609 -3.935440 0.115155
H -2.930514 -0.466806 -1.654766
H -0.761554 1.006192 1.813424
H -4.638722 1.343129 -1.351670
H -2.442773 2.845276 2.085830
H -4.393374 3.018023 0.508000


