%chk=000042810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042810

0 1
 O   -3.934000      0.9619000     -0.2921000    
 O   -3.318200      -1.037200      0.5866000    
 N  -0.6459000     -0.6445000      9.7000003E-03
 C   0.6898000     -0.2416000     -0.3748000    
 C    1.062900       1.058400      0.3419000    
 C    1.675300      -1.364100     -4.2800002E-02
 C    2.502800       1.468700      4.2700000E-02
 C    3.114900     -0.9514000     -0.3397000    
 C    3.485700      0.3479000      0.3698000    
 C   -1.610500      0.3851000     -0.3383000    
 C   -3.022900      1.7000001E-02  3.7099998E-02
 H   0.7271000     -7.3200002E-02  -1.460200    
 H   0.9378000      0.9502000       1.427400    
 H   0.4449000       1.903000      2.2100000E-02
 H    1.433500      -2.265900     -0.6190000    
 H    1.595900      -1.635900       1.018500    
 H    2.760100       2.363600      0.6206000    
 H    2.594600       1.735600      -1.017500    
 H    3.242300     -0.8253000      -1.422000    
 H    3.798800      -1.749200     -2.8700000E-02
 H    4.498700      0.6497000      8.0600001E-02
 H    3.499200      0.1801000       1.453800    
 H  -0.8920000      -1.515000     -0.4612000    
 H   -1.595900      0.5822000      -1.416300    
 H   -1.437100       1.313000      0.2133000    
 H   -4.844200      0.6985000     -3.8199998E-02


%chk=000042810-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042810

0 1
O -4.131158 0.759442 -0.264857
O -3.291341 -1.404888 -0.148484
N -0.683035 -0.416850 0.191868
C 0.685962 -0.106292 -0.268931
C 1.224334 1.185738 0.394805
C 1.611728 -1.300813 0.056735
C 2.682704 1.475402 -0.034398
C 3.072464 -1.024560 -0.370021
C 3.608872 0.275465 0.276144
C -1.735373 0.512879 -0.217880
C -3.090030 -0.171351 -0.195856
H 0.711756 0.055486 -1.381993
H 1.166527 1.053033 1.493834
H 0.578057 2.047955 0.136665
H 1.233045 -2.215725 -0.443863
H 1.565552 -1.484301 1.149052
H 3.050855 2.387247 0.474085
H 2.711302 1.684447 -1.124429
H 3.123603 -0.931770 -1.474734
H 3.712974 -1.883726 -0.092235
H 4.636841 0.482667 -0.079614
H 3.669296 0.137637 1.375530
H -0.959159 -1.394932 0.029153
H -1.600687 0.907038 -1.259949
H -1.788467 1.403229 0.437012
H -5.003023 0.279141 -0.284339


