%chk=000042394.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042394

0 1
 O    3.787700      0.2256000     -0.1169000    
 O   -4.413000      0.6405000     -0.8152000    
 O   0.2357000      -3.204700     -4.6999999E-03
 O   -1.657800      -2.100400      0.1149000    
 N   -1.766700      0.3843000      0.1713000    
 N  -0.4066000      -2.129900      4.9800001E-02
 C  -0.3566000      0.3236000      9.7199999E-02
 C   -2.485900       1.617100      0.2343000    
 C   0.3098000     -0.9003000      3.7900001E-02
 C   0.3697000       1.514400      8.4600002E-02
 C    1.702500     -0.9334000     -3.4100000E-02
 C    2.428700      0.2574000     -4.6900000E-02
 C    1.762300       1.481300      1.2700000E-02
 C   -3.976600       1.344300      0.3408000    
 C    4.466800       1.480300     -0.1257000    
 H   -2.302100       2.203100     -0.6742000    
 H   -2.181000       2.206000       1.106900    
 H   -2.274800     -0.4767000      0.3200000    
 H  -0.1042000       2.490300      0.1275000    
 H    2.254100      -1.869500     -8.1500001E-02
 H    2.264300       2.442800      6.5000001E-03
 H   -4.534800       2.283500      0.3977000    
 H   -4.218500      0.7445000       1.224500    
 H   -3.935000     -0.2049000     -0.8484000    
 H    4.302000       2.033700      0.8051000    
 H    4.209300       2.071100      -1.011300    
 H    5.539100       1.266900     -0.1849000    


%chk=000042394-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042394

0 1
O 3.829514 0.192165 -0.227576
O -4.321479 0.940913 -1.228129
O 0.364690 -3.251902 0.138710
O -1.647143 -2.217097 0.416727
N -1.801034 0.388327 0.376283
N -0.339135 -2.173920 0.241639
C -0.428480 0.362020 0.241230
C -2.615546 1.604806 0.470537
C 0.318012 -0.877030 0.164588
C 0.343592 1.565085 0.163116
C 1.725225 -0.889858 0.009179
C 2.440200 0.313072 -0.073417
C 1.735552 1.549656 0.007891
C -4.089621 1.270906 0.179992
C 4.612766 1.426885 -0.310294
H -2.278701 2.347622 -0.277406
H -2.528224 2.071008 1.476904
H -2.223428 -0.545105 0.524621
H -0.166351 2.528876 0.237573
H 2.245392 -1.848565 -0.045954
H 2.270132 2.502964 -0.043666
H -4.712662 2.159542 0.369369
H -4.435731 0.452742 0.849279
H -3.768238 0.155631 -1.473329
H 4.516293 2.030622 0.613475
H 4.318068 2.036000 -1.187397
H 5.654740 1.095533 -0.426044


