%chk=000063139.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063139

0 1
 O    4.694200     -0.4283000     -0.1359000    
 O   -1.605800       2.775800     -0.3348000    
 N    1.934200     -0.1284000      0.2360000    
 N  -0.1956000     -0.9330000      0.2191000    
 N   0.2043000       1.398300     -5.6200001E-02
 C    2.478900      -1.414200     -0.1931000    
 C    2.867900      0.7236000      0.9683000    
 C    3.785500      -1.182800     -0.9421000    
 C    4.157300      0.8616000      0.1684000    
 C   0.6207000      0.1716000      0.1238000    
 C   -1.579200     -0.7775000      0.1219000    
 C   -2.103900      0.5067000     -7.1800001E-02
 C   -1.152400       1.648200     -0.1644000    
 C   -2.450500      -1.866300      0.2118000    
 C   -3.483400      0.7053000     -0.1752000    
 C   -3.828800      -1.671400      0.1088000    
 C   -4.343400     -0.3891000     -8.4500000E-02
 H    1.806200      -1.955700     -0.8676000    
 H    2.655700      -2.036800      0.6917000    
 H    3.078000      0.2528000       1.936100    
 H    2.452100       1.717100       1.167900    
 H    4.259900      -2.141300      -1.175000    
 H    3.617500     -0.6545000      -1.888400    
 H    3.993200       1.415000     -0.7642000    
 H    4.904900       1.406800      0.7530000    
 H   0.1557000      -1.854500      0.4477000    
 H   -2.064200      -2.871300      0.3617000    
 H   -3.903700       1.695400     -0.3255000    
 H   -4.502600      -2.520500      0.1791000    
 H   -5.416800     -0.2428000     -0.1640000    


%chk=000063139-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063139

0 1
O 4.766213 -0.339531 -0.338187
O -1.577698 2.853310 0.482312
N 1.987330 -0.182679 0.403360
N -0.237470 -1.008252 0.145221
N 0.200966 1.336669 0.437121
C 2.639539 -1.496744 0.242791
C 2.922307 0.915542 0.753720
C 3.820086 -1.377193 -0.752786
C 4.074990 0.966321 -0.258903
C 0.625786 0.076502 0.330193
C -1.628699 -0.805472 0.025600
C -2.123795 0.524157 0.127369
C -1.169217 1.659403 0.362925
C -2.510950 -1.894471 -0.185956
C -3.516356 0.748864 0.011017
C -3.892827 -1.647255 -0.297539
C -4.401403 -0.325345 -0.200822
H 1.943557 -2.259528 -0.148600
H 3.020781 -1.847932 1.223915
H 3.327788 0.730892 1.769325
H 2.339218 1.850930 0.759557
H 4.397536 -2.316199 -0.781353
H 3.424257 -1.151584 -1.767377
H 3.691687 1.246194 -1.262868
H 4.846530 1.685970 0.057385
H 0.110674 -1.966340 0.135333
H -2.122106 -2.917289 -0.263917
H -3.866819 1.782946 0.095272
H -4.578311 -2.485993 -0.461678
H -5.477693 -0.146095 -0.289830


