%chk=000147398.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147398

0 1
 O   -1.881000     -0.2429000      -1.446500    
 O    2.390300      -2.165800     -0.2155000    
 O   0.3277000      -2.277900      0.5277000    
 N   8.7600000E-02  0.4983000      0.3546000    
 N    1.554300       2.010200     -0.3065000    
 N    1.310200      -1.596100      0.1148000    
 C   -1.164400     -6.2399998E-02  0.8541000    
 C   0.3347000       1.818100      0.1448000    
 C    1.201600     -0.2043000      2.3399999E-02
 C    2.100000      0.7534000     -0.3849000    
 C   -2.135000     -0.4112000     -0.2545000    
 C  -0.6698000       2.869000      0.4066000    
 C   -3.456300     -0.9882000      0.1819000    
 H  -0.9889000     -0.8865000       1.543500    
 H   -1.641600      0.7131000       1.464600    
 H    3.113400      0.6087000     -0.7317000    
 H  -0.2990000       3.841500      6.6299997E-02
 H   -1.604800       2.669600     -0.1258000    
 H  -0.8799000       2.952300       1.477400    
 H   -4.073800      -1.201800     -0.6949000    
 H   -3.285900      -1.918600      0.7292000    
 H   -3.979200     -0.2676000      0.8153000    


%chk=000147398-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147398

0 1
O -1.993797 -0.085228 -1.452892
O 2.152943 -2.236113 -0.281275
O -0.016546 -2.250812 0.461909
N -0.020106 0.610110 0.426646
N 1.654540 1.972772 -0.298766
N 1.067518 -1.629466 0.072852
C -1.342115 0.174733 0.887160
C 0.379929 1.921477 0.191010
C 1.062406 -0.205018 0.033421
C 2.080730 0.660786 -0.398145
C -2.199613 -0.420396 -0.262821
C -0.476208 3.121647 0.438244
C -3.277680 -1.390421 0.169972
H -1.244339 -0.567200 1.693819
H -1.875969 1.056727 1.286794
H 3.065752 0.389224 -0.767411
H 0.103672 4.012610 0.155202
H -1.398936 3.100438 -0.170096
H -0.766141 3.221424 1.501156
H -3.994563 -1.561190 -0.647170
H -2.791952 -2.350190 0.431920
H -3.809327 -1.035015 1.072373


