%chk=000168886.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168886

0 1
 O   -3.125800      -1.558000     -8.5000001E-02
 O    2.254200     -0.2755000      -1.202400    
 O    2.420500      -1.350400      0.8069000    
 N  -0.2358000      0.7921000      0.1397000    
 C  -0.9926000     -0.5205000      0.2820000    
 C    1.170300      0.6305000      0.6991000    
 C  -0.1556000       1.174700      -1.331200    
 C  -0.9653000       1.884000      0.9089000    
 C   -2.402100     -0.3455000     -0.2480000    
 C    2.032100     -0.4314000      2.9999999E-02
 H  -0.4616000      -1.302100     -0.2735000    
 H  -0.9981000     -0.8038000       1.341500    
 H    1.675800       1.600000      0.6055000    
 H    1.062600      0.4172000       1.770200    
 H   -1.105800       1.621500      -1.640200    
 H   0.6324000       1.924000      -1.456800    
 H   3.6699999E-02  0.2871000      -1.939200    
 H  -0.3098000       2.760000      0.9539000    
 H   -1.884300       2.168500      0.3908000    
 H   -1.173100       1.523500       1.920700    
 H   -2.973800      0.4064000      0.2985000    
 H   -2.434200     -9.9900000E-02  -1.312500    
 H   -2.655600      -2.249100     -0.5819000    


%chk=000168886-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168886

0 1
O -3.164367 -1.660594 -0.098329
O 1.450065 -1.167708 -1.008608
O 3.170675 -0.672838 0.517362
N -0.257640 0.857105 0.160345
C -1.081570 -0.446480 0.243586
C 1.162713 0.554756 0.747523
C -0.091792 1.306208 -1.290009
C -0.906499 1.961542 0.975014
C -2.475224 -0.404262 -0.411712
C 2.012956 -0.553591 -0.009392
H -0.428793 -1.199124 -0.243965
H -1.190961 -0.682202 1.317134
H 1.719970 1.507699 0.730413
H 1.011148 0.240215 1.795115
H -1.069978 1.603780 -1.697775
H 0.598723 2.164702 -1.306778
H 0.351702 0.452811 -1.830679
H -0.254657 2.848968 0.950881
H -1.890513 2.216795 0.551090
H -1.024154 1.617825 2.014516
H -3.129718 0.372327 0.018403
H -2.405144 -0.250320 -1.507033
H -2.695843 -2.414314 -0.540101


