%chk=000001178.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001178

0 1
 O    3.560300       1.058900     -3.0099999E-02
 O    3.125800      -1.180000      1.6000001E-02
 N   -1.980500      -1.102700     -1.9200001E-02
 N   -3.108600      0.8101000      3.8999999E-03
 C   -1.038600     -0.1131000      7.6000001E-03
 C   0.3197000     -0.4526000      1.6799999E-02
 C   -1.758900       1.058200      2.1000000E-02
 C   -3.207800     -0.5004000     -2.0600000E-02
 C    1.342900      0.4431000      5.7000001E-03
 C    2.745600     -2.1600001E-02 -1.1000000E-03
 H   -1.810600      -2.100100     -3.5000000E-02
 H   0.5674000      -1.512700      2.4200000E-02
 H   -1.382000       2.071000      4.3099999E-02
 H   -4.126500      -1.069100     -3.9799999E-02
 H    1.161100       1.513100     -6.3999998E-03
 H    4.507800      0.8045000     -3.5999998E-02


%chk=000001178-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001178

0 1
O 3.663308 1.098787 -0.004698
O 3.180968 -1.181169 -0.002065
N -2.049799 -1.142951 -0.012968
N -3.167265 0.822351 0.007122
C -1.058469 -0.136591 -0.002033
C 0.352065 -0.442936 -0.002879
C -1.796551 1.069533 0.010434
C -3.288616 -0.527417 -0.007439
C 1.375156 0.471954 -0.003970
C 2.770423 0.010296 -0.003388
H -1.870535 -2.147047 -0.024171
H 0.647841 -1.503225 -0.002274
H -1.412210 2.087086 0.023043
H -4.229895 -1.071438 -0.014426
H 1.206444 1.552204 -0.005860
H 4.594235 0.747163 -0.004328


