%chk=000081876.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081876

0 1
 O    4.806300     -0.7511000      0.5668000    
 O   0.8836000       1.669200       1.773300    
 O   -2.890200       2.204600     -0.1584000    
 O  -0.4832000       2.075200      -1.280800    
 O   -4.905500      -2.045400      0.6012000    
 C    1.005100      0.5373000     -0.3371000    
 C   -1.559100      0.2184000     -0.3502000    
 C  -0.3729000      0.9942000     -0.6854000    
 C    1.555800      0.9002000      0.8710000    
 C    1.675700     -0.2397000      -1.255800    
 C   -2.777900      0.8479000     -9.7300000E-02
 C   -1.464800      -1.171600     -0.2831000    
 C    2.844600      0.4636000       1.177600    
 C    3.548900     -0.3246000      0.2675000    
 C    2.964500     -0.6762000     -0.9492000    
 C   -3.902500      8.7200001E-02  0.2225000    
 C   -2.589300      -1.932300      3.6800001E-02
 C   -3.808100      -1.302900      0.2895000    
 C    5.469100      -1.554000     -0.4088000    
 H    1.226600     -0.5135000      -2.205900    
 H  -0.5383000      -1.701100     -0.4796000    
 H    3.307400      0.7330000       2.123900    
 H    3.454800      -1.284600      -1.701500    
 H   -4.849800      0.5836000      0.4183000    
 H   -2.510500      -3.015000      8.6099997E-02
 H    1.446000       1.807600       2.554700    
 H   -2.021600       2.615400     -0.2924000    
 H    4.943600      -2.500400     -0.5754000    
 H    6.456100      -1.803300     -5.7999999E-03
 H    5.634400      -1.001300      -1.339900    
 H   -5.659900      -1.448300      0.7442000    


%chk=000081876-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081876

0 1
O 4.968668 -0.915141 0.474269
O 0.559614 0.281559 2.004038
O -2.931353 1.889088 -1.408171
O -0.450179 1.713385 -1.625099
O -5.261479 -1.447893 1.228195
C 0.978193 0.261255 -0.384757
C -1.627596 0.168455 -0.230581
C -0.388163 0.747079 -0.748017
C 1.448171 0.041432 0.945065
C 1.919704 0.124885 -1.436551
C -2.886401 0.793421 -0.585191
C -1.671799 -1.012950 0.570465
C 2.780194 -0.347536 1.189970
C 3.678998 -0.518286 0.111163
C 3.250951 -0.275094 -1.219565
C -4.107085 0.277054 -0.090918
C -2.875351 -1.541582 1.039575
C -4.092675 -0.876635 0.714984
C 5.958049 -1.083225 -0.596628
H 1.576486 0.346473 -2.451983
H -0.734440 -1.518220 0.815112
H 3.150745 -0.508900 2.208929
H 3.930112 -0.385826 -2.068333
H -5.037014 0.784988 -0.369758
H -2.912921 -2.448585 1.647638
H 1.014017 0.181043 2.877193
H -1.942224 2.066076 -1.706334
H 5.646913 -1.871648 -1.308055
H 6.882492 -1.387321 -0.085095
H 6.124934 -0.133365 -1.139075
H -6.060662 -0.931887 0.954315


