%chk=000090389.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090389

0 1
 O   -3.316700      2.5699999E-02   1.463800    
 C    1.404700       1.144800     -0.2755000    
 C   0.5007000     -0.1002000     -0.5860000    
 C    2.019200      0.9926000       1.136100    
 C    2.816300     -0.3036000       1.307400    
 C    1.196600      -1.416300     -0.2632000    
 C    2.529100       1.253300      -1.335200    
 C   0.6075000       2.466000     -0.3362000    
 C    2.231500      -1.485200      0.5934000    
 C  -0.8296000     -5.5599999E-02  0.1201000    
 C   0.6812000      -2.643500     -0.9631000    
 C   -2.003400     -7.1000000E-03 -0.5233000    
 C   -3.283700      3.7400000E-02  0.2353000    
 C   -4.553300      9.1700003E-02 -0.5735000    
 H   0.3196000     -8.8200003E-02  -1.671300    
 H    1.222400       1.016200       1.891200    
 H    2.671600       1.844900       1.365900    
 H    2.900100     -0.5317000       2.376300    
 H    3.838700     -0.1547000      0.9394000    
 H    3.203300       2.086800      -1.106700    
 H    3.140000      0.3481000      -1.401400    
 H    2.108500       1.432900      -2.331500    
 H    1.271000       3.330100     -0.2130000    
 H   9.6900001E-02   2.574500      -1.299700    
 H  -0.1455000       2.529000      0.4565000    
 H    2.707500      -2.443400      0.7859000    
 H  -0.8094000     -6.7800000E-02   1.207500    
 H  -0.3595000      -2.839100     -0.6867000    
 H    1.263000      -3.536500     -0.7108000    
 H   0.7348000      -2.511100      -2.048600    
 H   -2.053300      2.9000000E-03  -1.606200    
 H   -5.164000      0.9292000     -0.2251000    
 H   -5.098700     -0.8473000     -0.4492000    
 H   -4.346300      0.2412000      -1.636600    


%chk=000090389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090389

0 1
O -3.310785 0.182332 1.542232
C 1.479418 1.181913 -0.301272
C 0.521666 -0.025384 -0.631825
C 2.032499 1.007990 1.142638
C 2.821493 -0.308281 1.329356
C 1.153758 -1.386061 -0.271177
C 2.640657 1.194239 -1.330883
C 0.712260 2.523919 -0.405396
C 2.169686 -1.484691 0.630803
C -0.811861 0.067545 0.081926
C 0.568710 -2.598287 -0.969518
C -2.039251 -0.017856 -0.508668
C -3.304157 0.047899 0.281064
C -4.603358 -0.051678 -0.513073
H 0.328683 -0.015353 -1.726473
H 1.187705 1.032336 1.858487
H 2.678744 1.872796 1.391135
H 2.935401 -0.529235 2.409580
H 3.856418 -0.193331 0.941082
H 3.383775 1.969806 -1.065070
H 3.160075 0.221235 -1.379520
H 2.260295 1.426195 -2.343867
H 1.404946 3.374599 -0.261090
H 0.238431 2.635954 -1.399300
H -0.085022 2.602291 0.356224
H 2.586007 -2.479528 0.848266
H -0.791333 0.169605 1.177903
H -0.524887 -2.664368 -0.809929
H 1.024720 -3.535784 -0.606559
H 0.729196 -2.542524 -2.065189
H -2.129582 -0.129967 -1.598481
H -5.467836 0.009152 0.165400
H -4.642169 -1.005426 -1.073669
H -4.663504 0.763948 -1.259137


