%chk=000007591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007591

0 1
 O    2.575200     -0.4539000      3.0000001E-04
 O    1.352000       1.478400       0.000000    
 N   0.3293000     -0.6322000      1.9999999E-04
 C   -1.036200     -0.3457000      3.0000001E-04
 C   -1.966700      -1.384700       0.000000    
 C   -1.470800      0.9798000      9.9999997E-05
 C    3.779200      0.3221000     -3.0000001E-04
 C   -3.331900      -1.098300     -3.0000001E-04
 C   -2.836000       1.266300       0.000000    
 C   -3.766500      0.2272000     -1.9999999E-04
 C    1.403300      0.2546000      3.0000001E-04
 C    4.969000     -0.6137000     -3.0000001E-04
 H   -1.642300      -2.422300       0.000000    
 H  -0.8101000       1.835800      9.9999997E-05
 H   0.5752000      -1.619200      1.9999999E-04
 H    3.805200      0.9540000     -0.8951000    
 H    3.805700      0.9548000      0.8938000    
 H   -4.056600      -1.907200     -6.0000003E-04
 H   -3.175700       2.298100     -9.9999997E-05
 H   -4.829400      0.4501000     -1.9999999E-04
 H    5.907800     -5.2700002E-02 -7.9999998E-04
 H    4.946800      -1.265200      0.8795000    
 H    4.946300      -1.266000     -0.8795000    


%chk=000007591-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007591

0 1
O 2.596383 -0.468888 -0.000868
O 1.383476 1.551923 -0.000808
N 0.341660 -0.585836 -0.001141
C -1.045918 -0.272900 -0.000554
C -1.957361 -1.364477 -0.000167
C -1.540434 1.058994 -0.000333
C 3.856111 0.319570 -0.000251
C -3.346759 -1.128529 0.000412
C -2.935482 1.275490 0.000243
C -3.847630 0.194945 0.000624
C 1.412135 0.294867 -0.001451
C 5.005034 -0.684678 0.000440
H -1.576989 -2.394579 -0.000330
H -0.835587 1.893368 -0.000626
H 0.602157 -1.574493 -0.001226
H 3.866145 0.970250 -0.894677
H 3.865204 0.970396 0.894084
H -4.036570 -1.980275 0.000705
H -3.309415 2.305988 0.000407
H -4.927304 0.378576 0.001065
H 5.969323 -0.143726 0.000899
H 4.966838 -1.327863 0.896665
H 4.967784 -1.328021 -0.895712


