%chk=000089175.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089175

1 1
 O    2.919500      0.4003000      1.9500000E-02
 O    2.007000      -1.716000      0.1218000    
 N   -1.849600      0.3826000      0.3323000    
 C   -2.210200      0.3837000      -1.167400    
 C   -3.043500     -0.2794000       1.050300    
 C   -3.688300      4.9199998E-02  -1.207400    
 C   -3.849600     -0.9236000     -6.0199998E-02
 C  -0.5755000     -0.4138000      0.5690000    
 C   -1.652400       1.804300      0.8357000    
 C   0.5876000      0.2416000     -0.1600000    
 C    1.894700     -0.5033000      6.6000000E-03
 C    4.228400     -0.1550000      0.1841000    
 C    5.232000      0.7295000     -0.5244000    
 H   -1.641800     -0.4104000      -1.664300    
 H   -1.970900       1.353700      -1.613100    
 H   -3.623000      0.5037000       1.551400    
 H   -2.678700     -0.9954000       1.793000    
 H   -3.988600     -0.3811000      -2.166900    
 H   -4.288600      0.9503000      -1.034500    
 H   -4.896300      -1.069400      0.2214000    
 H   -3.427300      -1.901000     -0.3222000    
 H  -0.7494000      -1.437900      0.2174000    
 H  -0.3951000     -0.4472000       1.650400    
 H   -2.619800       2.316000      0.7983000    
 H   -1.289600       1.763900       1.866700    
 H  -0.9603000       2.343400      0.1849000    
 H   0.4176000      0.3333000      -1.237000    
 H   0.7645000       1.244500      0.2415000    
 H    4.452700     -0.1937000       1.255000    
 H    4.296000      -1.167200     -0.2302000    
 H    6.248200      0.3443000     -0.4020000    
 H    5.003400      0.7911000      -1.593600    
 H    5.191700       1.750600     -0.1312000    


%chk=000089175-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089175

1 1
O 2.818421 0.412694 -0.068654
O 1.160587 -1.205838 -0.325302
N -1.853301 0.563017 0.501297
C -1.640012 0.108171 -0.979798
C -3.082668 -0.277713 1.009567
C -2.982559 -0.506158 -1.401212
C -3.418310 -1.263829 -0.124704
C -0.628737 0.258631 1.397171
C -2.201576 2.045205 0.556540
C 0.713383 0.867795 0.951723
C 1.563102 -0.098475 0.115608
C 3.803822 -0.424419 -0.860503
C 5.124416 0.330929 -0.855657
H -0.839213 -0.649265 -0.968415
H -1.319313 0.979953 -1.571213
H -3.905840 0.432326 1.188742
H -2.807486 -0.755359 1.962151
H -2.851232 -1.175928 -2.265898
H -3.722130 0.265164 -1.684127
H -4.489850 -1.519823 -0.122147
H -2.845569 -2.201716 -0.018630
H -0.539056 -0.840874 1.422753
H -0.904876 0.622065 2.401571
H -3.053976 2.234808 -0.113256
H -2.472535 2.317126 1.588783
H -1.341342 2.646977 0.228964
H 0.609029 1.817598 0.396322
H 1.299934 1.132656 1.850097
H 3.866267 -1.411266 -0.369945
H 3.384155 -0.555943 -1.873326
H 5.874614 -0.244614 -1.426947
H 5.021798 1.322539 -1.327174
H 5.504854 0.465167 0.170520


