%chk=000006991.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006991

0 1
 O    2.581800       1.495100     -3.0000001E-04
 O    2.738500     -0.6945000      9.9999997E-05
 N    2.056000      0.3571000     -1.9999999E-04
 C   6.6000000E-03 -0.9886000      9.9999997E-05
 C   -2.148400      0.1038000      9.9999997E-05
 C   0.6373000      0.2555000      1.9999999E-04
 C   -1.386200      -1.064400       0.000000    
 C   -1.517600       1.348000      1.9999999E-04
 C  -0.1247000       1.423800      3.0000001E-04
 C   0.7939000      -2.259000     -9.9999997E-05
 C   -3.637300      2.3200000E-02 -3.9999999E-04
 H   -1.884700      -2.031000     -2.0000001E-03
 H   -2.100400       2.265300     -1.8000000E-03
 H   0.3285000       2.411900     -1.9999999E-04
 H    1.392200      -2.371000     -0.9103000    
 H    1.392200      -2.371200      0.9102000    
 H   0.1184000      -3.124500     -9.9999997E-05
 H   -3.984200     -0.8487000      0.5647000    
 H   -4.083300      0.9067000      0.4690000    
 H   -4.009100     -5.2000001E-02  -1.027100    


%chk=000006991-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006991

0 1
O 2.589076 1.636592 -0.015099
O 2.881518 -0.615451 -0.017137
N 2.119643 0.429935 -0.011462
C 0.033175 -1.038079 0.003628
C -2.180909 0.118515 0.016059
C 0.646134 0.252838 -0.001975
C -1.385336 -1.053265 0.014256
C -1.522724 1.376537 0.015047
C -0.121442 1.443175 0.004268
C 0.769983 -2.363133 0.002634
C -3.694045 0.028932 -0.004159
H -1.885904 -2.029166 0.021979
H -2.110476 2.301017 0.023260
H 0.405509 2.400506 0.003646
H 1.425663 -2.463533 -0.879138
H 1.436534 -2.459099 0.876716
H 0.045581 -3.195158 0.009123
H -4.055908 -0.864659 0.533294
H -4.158901 0.919810 0.451773
H -4.067672 -0.040812 -1.044312


