%chk=000086163.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086163

0 1
 O    1.251100     -0.1168000     -0.7441000    
 O    5.495500     -8.0499999E-02  0.1592000    
 N    3.304000      0.7636000      0.2783000    
 C    2.193500     -0.1835000      0.3190000    
 C    3.255100      -1.305500      0.2336000    
 C  -7.0299998E-02 -2.0199999E-02 -0.3914000    
 C  -0.8217000      -1.193700     -0.2122000    
 C  -0.6442000       1.250100     -0.2165000    
 C    4.290800     -0.1685000      0.2116000    
 C   -2.182600      -1.094200      0.1514000    
 C   -2.005000       1.349500      0.1477000    
 C   -2.756500      0.1761000      0.3269000    
 C  -0.2488000      -2.464300     -0.3874000    
 C   0.1062000       2.424100     -0.3961000    
 C   -2.933500      -2.267900      0.3301000    
 C   -2.578200       2.619900      0.3228000    
 C   -1.008700      -3.620200     -0.2066000    
 C  -0.4785000       3.678100     -0.2186000    
 C   -2.349300      -3.522200      0.1519000    
 C   -1.819000       3.776000      0.1404000    
 H    1.718400     -0.1478000       1.310200    
 H    3.245200      -1.902800     -0.6819000    
 H    3.320600      -1.955400       1.109400    
 H    3.359700       1.772400      0.3043000    
 H   -3.806900      0.2529000      0.6078000    
 H   0.7909000      -2.585500     -0.6788000    
 H    1.151700       2.392900     -0.6901000    
 H   -3.983600      -2.214900      0.6102000    
 H   -3.624800       2.720100      0.6031000    
 H  -0.5540000      -4.596300     -0.3481000    
 H   0.1122000       4.577900     -0.3639000    
 H   -2.941700      -4.421500      0.2923000    
 H   -2.275200       4.752000      0.2781000    


%chk=000086163-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086163

0 1
O 1.299615 -0.331768 -0.791033
O 5.237057 0.954724 0.567529
N 2.856734 0.606962 0.918072
C 2.250379 -0.594952 0.297719
C 3.658656 -0.946641 -0.274113
C -0.054178 -0.145930 -0.386728
C -0.868642 -1.288927 -0.157563
C -0.555814 1.179388 -0.275848
C 4.154400 0.358928 0.428964
C -2.254044 -1.084347 0.255673
C -1.946814 1.364859 0.128597
C -2.755287 0.232890 0.393961
C -0.383744 -2.634857 -0.329660
C 0.253785 2.338849 -0.552144
C -3.075185 -2.241896 0.508571
C -2.453241 2.708901 0.252856
C -1.212131 -3.725136 -0.081945
C -0.276175 3.619265 -0.422616
C -2.569621 -3.528048 0.351315
C -1.642092 3.807492 -0.011422
H 1.790954 -1.287657 1.025104
H 3.696946 -0.917595 -1.373210
H 4.120689 -1.868840 0.109386
H 2.461923 1.349146 1.500097
H -3.795525 0.379748 0.709696
H 0.638398 -2.781411 -0.692958
H 1.283713 2.184412 -0.887493
H -4.113775 -2.087554 0.824290
H -3.496916 2.849016 0.558418
H -0.836455 -4.743926 -0.226927
H 0.344766 4.494198 -0.643904
H -3.205337 -4.398738 0.545270
H -2.040639 4.823344 0.084649


