%chk=000075986.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075986

0 1
 O    2.268700      0.3352000     -0.3113000    
 O  -0.7018000     -0.3405000       1.410100    
 N  -0.5309000     -0.2457000      5.2800000E-02
 C   0.4684000      -1.276900     -0.4272000    
 C  -1.6600000E-02   1.128800     -0.3201000    
 C   -1.860900     -0.4845000     -0.6047000    
 C    1.860200     -0.9697000      0.1031000    
 C    1.394400       1.339900      0.2062000    
 C   -2.881500      0.5134000     -0.1090000    
 H   0.4494000      -1.229500      -1.521900    
 H   0.1105000      -2.253100     -8.4600002E-02
 H  -0.6851000       1.874000      0.1181000    
 H  -4.0700000E-02   1.179800      -1.414300    
 H   -1.719100     -0.4187000      -1.688400    
 H   -2.155300      -1.505100     -0.3350000    
 H    1.905500      -1.034400       1.196200    
 H    2.579300      -1.688100     -0.3023000    
 H    1.772900       2.312400     -0.1235000    
 H    1.430400       1.323000       1.301600    
 H   -3.876700      0.2152000     -0.4571000    
 H   -2.926500      0.5804000      0.9820000    
 H   -2.704300       1.516600     -0.5077000    


%chk=000075986-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075986

0 1
O 2.358415 0.317520 -0.268518
O -0.617131 -0.267484 1.448445
N -0.514279 -0.198567 0.028476
C 0.474325 -1.274468 -0.473649
C 0.041666 1.181097 -0.397542
C -1.890796 -0.456293 -0.626064
C 1.853274 -1.006296 0.137270
C 1.433518 1.357748 0.216024
C -2.964000 0.482070 -0.071531
H 0.512102 -1.243689 -1.579336
H 0.071257 -2.239331 -0.124508
H -0.656799 1.931724 0.003041
H 0.078861 1.230953 -1.502170
H -1.777639 -0.376736 -1.725299
H -2.125195 -1.500851 -0.358794
H 1.768806 -1.065990 1.239946
H 2.590000 -1.736550 -0.234642
H 1.873579 2.319879 -0.092027
H 1.338889 1.307523 1.318591
H -3.965251 0.102374 -0.340603
H -2.864897 0.496423 1.027837
H -2.878406 1.511444 -0.461947


