%chk=000151979.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151979

0 1
 O   -2.292800      -2.330700     -0.7693000    
 O   -4.585100      -1.268600      -1.709700    
 O   -4.750700      9.2699997E-02   1.673400    
 N   0.4962000     -0.2142000      0.1323000    
 C   -3.373100      -2.182900      0.1598000    
 C   -2.025000      -1.547800      0.4038000    
 C   -4.512700      -1.315900     -0.2849000    
 C   -1.886000     -5.5900000E-02  0.2132000    
 C   -4.422900      0.1110000      0.2852000    
 C   -3.053000      0.7450000      0.1516000    
 C  -0.6198000      0.5424000      9.0499997E-02
 C   -2.947800       2.129200     -2.2000000E-03
 C  -0.5374000       1.933200     -7.5300001E-02
 C   -1.696500       2.719500     -0.1176000    
 C   0.7313000       2.505800     -0.1940000    
 C    1.730600      0.3267000      1.8500000E-02
 C    1.881800       1.712900     -0.1491000    
 C    2.891500     -0.4765000      6.4300001E-02
 C    3.153700       2.286800     -0.2678000    
 C    4.178000      0.1100000     -5.5799998E-02
 C    4.292400       1.491700     -0.2212000    
 C    2.822000      -1.876300      0.2301000    
 C    5.327200     -0.6966000     -8.5000005E-03
 C    3.973000      -2.665500      0.2759000    
 C    5.224800      -2.075900      0.1568000    
 H   -3.665700      -3.041100      0.7477000    
 H   -1.413500      -2.009900       1.173000    
 H   -5.442300      -1.782200      6.3500002E-02
 H   -5.164600      0.7416000     -0.2197000    
 H   -3.837300       2.752400     -3.5700001E-02
 H   -5.367500     -0.7421000      -1.946700    
 H   -1.632300       3.798100     -0.2417000    
 H   -4.064000     -0.4070000       2.146900    
 H   0.8248000       3.583800     -0.3230000    
 H    3.268900       3.360900     -0.3975000    
 H    5.267500       1.964400     -0.3158000    
 H    1.860600      -2.377800      0.3273000    
 H    6.317600     -0.2548000     -0.1000000    
 H    3.888100      -3.740600      0.4047000    
 H    6.121300      -2.687700      0.1921000    


%chk=000151979-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151979

0 1
O -2.821422 -2.090425 -1.459020
O -5.672767 -2.047232 0.162913
O -5.487569 0.834126 0.246922
N 0.567688 -0.251163 -0.066565
C -3.264128 -2.246863 -0.029146
C -1.948115 -1.577627 -0.301040
C -4.407664 -1.366403 0.423374
C -1.851393 -0.096761 -0.180574
C -4.378558 0.010323 -0.284864
C -3.018527 0.689428 -0.176685
C -0.558223 0.538764 -0.082197
C -2.934998 2.118312 -0.110126
C -0.487151 1.990462 -0.002076
C -1.699467 2.755386 -0.026172
C 0.799889 2.582475 0.092236
C 1.791179 0.335595 0.022931
C 1.959098 1.781715 0.107697
C 2.982951 -0.520358 0.036484
C 3.290731 2.343538 0.205117
C 4.283968 0.084810 0.137547
C 4.403542 1.529266 0.220769
C 2.878897 -1.937183 -0.050626
C 5.440634 -0.750433 0.152280
C 4.029345 -2.741187 -0.035100
C 5.318452 -2.145484 0.067797
H -3.289608 -3.284010 0.325167
H -1.013199 -2.128948 -0.180283
H -4.288530 -1.191952 1.521843
H -4.655594 -0.144580 -1.342062
H -3.863194 2.697594 -0.143645
H -6.391043 -1.363761 0.239098
H -1.639435 3.849341 0.017073
H -5.267576 1.098904 1.178573
H 0.890310 3.674129 0.153830
H 3.394102 3.433430 0.266221
H 5.407619 1.963275 0.295308
H 1.879899 -2.374199 -0.132945
H 6.430834 -0.285971 0.229701
H 3.937347 -3.830458 -0.103939
H 6.212974 -2.777776 0.079282


