%chk=000177727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177727

0 1
 O  -0.9837000     -0.7085000       1.203300    
 O   -2.766900      -1.929400      0.4695000    
 N   -2.160800      9.3599997E-02 -0.5258000    
 C   -1.177500       1.122200     -0.2922000    
 C  -0.2996000      0.4975000      0.7957000    
 C    1.102100      0.1743000      0.3287000    
 C   -1.805700       2.430600      0.1801000    
 C   -2.054400     -0.9390000      0.3786000    
 C   -3.137000      0.1800000      -1.593700    
 C    1.385800      -1.076400     -0.2241000    
 C    2.117600       1.125400      0.4490000    
 C    2.678700      -1.374700     -0.6546000    
 C    3.410500      0.8273000      1.8500000E-02
 C    3.691000     -0.4229000     -0.5331000    
 H  -0.6257000       1.302200      -1.222500    
 H  -0.2343000       1.131700       1.688400    
 H   -1.031600       3.165900      0.4226000    
 H   -2.444400       2.861400     -0.5979000    
 H   -2.427300       2.278800       1.069500    
 H   -2.612500      0.3259000      -2.541600    
 H   -3.803300       1.025000      -1.403600    
 H   -3.728200     -0.7382000      -1.641800    
 H   0.6179000      -1.835500     -0.3417000    
 H    1.910600       2.103400      0.8753000    
 H    2.896900      -2.347000      -1.086500    
 H    4.198700       1.568600      0.1122000    
 H    4.697500     -0.6547000     -0.8690000    


%chk=000177727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177727

0 1
O -1.029421 -0.759435 1.229802
O -2.875897 -1.965419 0.414551
N -2.196046 0.102932 -0.532533
C -1.180986 1.144040 -0.291892
C -0.291925 0.470871 0.828955
C 1.118687 0.134109 0.373506
C -1.783725 2.490518 0.155655
C -2.129848 -0.968528 0.346437
C -3.194958 0.173498 -1.595348
C 1.425781 -1.117800 -0.212149
C 2.137137 1.112243 0.496853
C 2.732051 -1.380197 -0.681470
C 3.442095 0.851140 0.022963
C 3.742032 -0.396319 -0.571836
H -0.575636 1.295076 -1.207126
H -0.262027 1.123594 1.719644
H -0.977506 3.221476 0.350958
H -2.439769 2.917555 -0.623771
H -2.375246 2.364894 1.080141
H -2.711880 0.289181 -2.584361
H -3.899758 1.012938 -1.443784
H -3.766529 -0.769284 -1.583248
H 0.651502 -1.889803 -0.266806
H 1.914477 2.076055 0.972974
H 2.963438 -2.354626 -1.125913
H 4.223606 1.612237 0.126151
H 4.754752 -0.603443 -0.935053


