%chk=000066549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066549

0 1
 O    2.175100      -1.804500      0.1192000    
 O    2.046700       1.742400       1.561900    
 N    1.468200      0.7916000     -0.5146000    
 C  -0.8844000      0.2283000     -0.1688000    
 C   0.4714000     -0.1378000     -0.1843000    
 C   -1.858800     -0.7407000      0.1695000    
 C   0.8610000      -1.440400      0.1294000    
 C   -1.448900      -2.047100      0.4820000    
 C   -1.294500       1.534500     -0.4816000    
 C  -9.7400002E-02  -2.393300      0.4617000    
 C   -3.214600     -0.3749000      0.1848000    
 C   -2.645900       1.880500     -0.4611000    
 C   -3.604200      0.9276000     -0.1284000    
 C    2.166500       1.642800      0.3451000    
 C    3.161000       2.493000     -0.4050000    
 C    2.698800      -2.301900      -1.110000    
 H   -2.180800      -2.808100      0.7450000    
 H  -0.5804000       2.309600     -0.7497000    
 H   0.1987000      -3.409500      0.7081000    
 H   -3.980800      -1.103500      0.4417000    
 H    1.641100      0.8874000      -1.512900    
 H   -2.950100       2.894100     -0.7055000    
 H   -4.656100       1.197600     -0.1128000    
 H    3.847200       1.854400     -0.9686000    
 H    3.738800       3.096800      0.3002000    
 H    2.631400       3.157900      -1.093100    
 H    3.759100      -2.525800     -0.9645000    
 H    2.605800      -1.554400      -1.904000    
 H    2.183800      -3.223100      -1.400300    


%chk=000066549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066549

0 1
O 2.212598 -1.396775 -0.746158
O 2.684657 0.807817 1.158156
N 1.313225 1.193468 -0.699158
C -1.006079 0.396879 -0.288960
C 0.392143 0.120943 -0.476257
C -1.927499 -0.706115 -0.095564
C 0.860032 -1.210399 -0.459960
C -1.409060 -2.038648 -0.047621
C -1.527701 1.735093 -0.272690
C -0.047918 -2.290023 -0.212886
C -3.325482 -0.432821 0.064945
C -2.895323 1.968605 -0.110173
C -3.807470 0.877325 0.050337
C 2.435591 1.445993 0.098775
C 3.348324 2.551355 -0.432164
C 2.816022 -2.691045 -0.416132
H -2.101508 -2.871566 0.121256
H -0.835621 2.578937 -0.362598
H 0.323360 -3.318474 -0.179462
H -4.013285 -1.275475 0.205679
H 1.156447 1.798675 -1.508064
H -3.275512 2.996193 -0.094248
H -4.877397 1.076175 0.173852
H 4.229359 2.089699 -0.913761
H 3.709359 3.156262 0.414790
H 2.857876 3.212553 -1.168888
H 3.892642 -2.553853 -0.593070
H 2.432830 -3.497705 -1.071523
H 2.643091 -2.949577 0.644945


