%chk=000174534.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174534

0 1
 O   0.4790000       2.553100     -6.3999998E-03
 O   -2.489300      -2.678300     -6.9999998E-04
 O   -4.244100       1.572400      3.0000001E-04
 N   0.3943000       1.170000      7.9999998E-04
 N  -6.0999999E-03  -1.609700     -9.9999997E-05
 N   -1.974100       1.401100      1.4000000E-03
 N   -3.395000     -0.5326000      3.0000001E-04
 C    1.516300      0.3206000      6.9999998E-04
 C    1.293500      -1.068300       0.000000    
 C    2.829300      0.8101000      9.9999997E-05
 C  -0.8930000      0.6807000      6.0000003E-04
 C   -1.035100     -0.8200000     -3.9999999E-04
 C    2.387000      -1.942400     -3.0000001E-04
 C    3.910800     -7.1099997E-02 -3.0000001E-04
 C    3.690100      -1.445800     -3.0000001E-04
 C    3.159400       2.268600      3.4000000E-03
 C   -2.382400      -1.464000     -3.0000001E-04
 C   -3.240700      0.8556000      1.2000001E-03
 H    2.228100      -3.018100     -6.0000003E-04
 H    4.934900      0.2930000      1.9999999E-04
 H    4.532200      -2.131800     -5.0000002E-04
 H    4.242200       2.441000     -5.4000001E-03
 H    2.765700       2.760000     -0.8920000    
 H    2.780700       2.752100      0.9094000    
 H   -4.347400     -0.8867000      9.9999997E-05
 H   0.3576000       2.767600      0.9347000    


%chk=000174534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174534

0 1
O 0.381620 2.468069 0.112531
O -2.723067 -2.645347 -0.035067
O -4.137733 1.807287 0.122960
N 0.421920 1.057144 0.066259
N 0.089443 -1.730374 -0.023722
N -1.810191 1.452184 0.095789
N -3.342226 -0.389645 0.045116
C 1.584881 0.295447 0.033176
C 1.353025 -1.147220 -0.012519
C 2.909313 0.840527 0.042440
C -0.852645 0.508298 0.057861
C -0.976449 -0.921835 0.010628
C 2.478435 -2.022101 -0.047710
C 3.969257 -0.086470 0.006316
C 3.771180 -1.497254 -0.038094
C 3.206085 2.328396 0.087694
C -2.386131 -1.436030 0.002914
C -3.148144 1.037432 0.090730
H 2.274597 -3.095487 -0.081227
H 4.992833 0.304557 0.012963
H 4.638913 -2.163019 -0.064354
H 4.296235 2.492014 0.092790
H 2.776738 2.858063 -0.779565
H 2.775709 2.805274 0.984336
H -4.324751 -0.686272 0.042122
H -0.724949 2.543463 0.121533


