%chk=000127762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127762

0 1
 O    3.637700      -1.682500      0.3670000    
 O    3.276400     -0.5539000      -1.567900    
 O   -4.623500       1.117700     -0.5827000    
 N    3.782100       1.646300      0.2786000    
 N   -1.973100     -0.7547000      0.3682000    
 N   -4.283400      -1.390500      0.1919000    
 N   -3.440800      0.8655000     -0.3264000    
 C    1.406800       1.032000      0.2782000    
 C   0.3798000     -9.1100000E-02  0.4834000    
 C    2.842900      0.5621000      0.5546000    
 C   -1.046100      0.3640000      0.1900000    
 C    3.256600     -0.5887000     -0.3444000    
 C   -3.215300     -0.5262000      0.1095000    
 H    1.160300       1.874200      0.9372000    
 H    1.325100       1.398200     -0.7540000    
 H   0.6156000     -0.9433000     -0.1655000    
 H   0.4409000     -0.4598000       1.515000    
 H    2.936200      0.2610000       1.604400    
 H   -1.279100       1.185500      0.8804000    
 H   -1.058100      0.7318000     -0.8448000    
 H    4.721400       1.366700      0.5599000    
 H    3.546200       2.457400      0.8492000    
 H    3.914400      -2.420000     -0.2176000    
 H   -4.154400      -2.351700      0.4889000    
 H   -5.227500      -1.098800     -3.8500000E-02


%chk=000127762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127762

0 1
O 3.770801 -1.684455 -0.091346
O 2.677486 -0.419072 -1.707465
O -4.218504 -0.150905 -1.955520
N 3.862299 1.444436 0.625016
N -2.206082 -0.146991 0.949273
N -4.184846 -1.314337 0.361789
N -3.217429 0.233952 -1.252129
C 1.409610 1.081462 0.548332
C 0.240982 0.082314 0.689994
C 2.796991 0.417541 0.644239
C -1.128177 0.805863 0.629976
C 3.019114 -0.572641 -0.512544
C -3.171749 -0.426889 0.102330
H 1.363191 1.843353 1.348828
H 1.331329 1.610306 -0.423168
H 0.279474 -0.672617 -0.118373
H 0.311452 -0.459786 1.653006
H 2.880930 -0.141634 1.592037
H -1.139990 1.576647 1.427797
H -1.246606 1.313339 -0.346696
H 4.796066 1.093188 0.859709
H 3.858902 2.025249 -0.220790
H 3.961595 -2.270651 -0.874361
H -4.220889 -1.803554 1.250775
H -4.884851 -1.462918 -0.366110


