%chk=000094178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094178

0 1
 O   0.2343000       1.692100      0.9710000    
 C   0.4288000      0.3515000      0.5078000    
 C  -0.4556000      0.1357000     -0.7420000    
 C    1.883800      7.1900003E-02  0.2325000    
 C   -1.901100     -2.6900001E-02 -0.4117000    
 C    2.380100      -1.209500      0.4227000    
 C    2.704900       1.100400     -0.2063000    
 C   -2.420900      -1.297000     -0.1621000    
 C   -2.733200       1.091200     -0.3530000    
 C    3.726900      -1.468100      0.1682000    
 C    4.051700      0.8417000     -0.4610000    
 C   -3.772800      -1.448900      0.1464000    
 C   -4.084900      0.9392000     -4.4199999E-02
 C    4.562700     -0.4426000     -0.2739000    
 C   -4.604800     -0.3309000      0.2056000    
 H   0.1044000     -0.3042000       1.326700    
 H  -0.1226000     -0.7544000      -1.292900    
 H  -0.3326000      0.9763000      -1.438700    
 H    1.737000      -2.015800      0.7640000    
 H    2.325500       2.105000     -0.3694000    
 H   -1.782800      -2.175800     -0.2024000    
 H   -2.342000       2.086400     -0.5470000    
 H  -0.6613000       1.749600       1.344100    
 H    4.124800      -2.468300      0.3132000    
 H    4.702100       1.639500     -0.8077000    
 H   -4.177500      -2.437700      0.3415000    
 H   -4.732800       1.809600      1.4000000E-03
 H    5.611200     -0.6442000     -0.4730000    
 H   -5.657200     -0.4492000      0.4461000    


%chk=000094178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094178

0 1
O 0.110546 1.390244 1.113631
C 0.415616 0.056217 0.583608
C -0.429353 -0.233440 -0.705338
C 1.907880 -0.005878 0.288891
C -1.922593 -0.174837 -0.429820
C 2.551929 -1.265150 0.199304
C 2.658116 1.172177 0.057890
C -2.613712 -1.308252 0.075619
C -2.647155 1.034009 -0.610922
C 3.923789 -1.349072 -0.126609
C 4.031647 1.089154 -0.265188
C -3.988559 -1.237979 0.390833
C -4.024629 1.107607 -0.296600
C 4.668519 -0.169709 -0.362984
C -4.698870 -0.027663 0.207892
H 0.156485 -0.718106 1.339952
H -0.139031 -1.230006 -1.086500
H -0.138243 0.513077 -1.467239
H 1.983933 -2.184410 0.394619
H 2.158611 2.140061 0.157840
H -2.071262 -2.252229 0.213404
H -2.133560 1.910035 -1.025591
H -0.873290 1.465168 1.222162
H 4.411813 -2.328381 -0.189559
H 4.606284 2.006827 -0.436067
H -4.507159 -2.124025 0.774290
H -4.569429 2.046227 -0.448920
H 5.733866 -0.231844 -0.612535
H -5.766086 0.026780 0.449838


