%chk=000108131.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108131

0 1
 O  -0.3809000       3.793900      -1.003300    
 O   -3.529600       3.192100      0.5775000    
 O    2.349400       2.274800      -1.413600    
 O   -4.985700      -2.036600      0.1134000    
 O    6.333100     -0.3395000      0.3344000    
 O    4.553300      -1.625100      0.9139000    
 C  -0.3384000       1.634100      0.1695000    
 C   -1.868600       1.474500      0.1301000    
 C  -0.1667000       3.154200      0.2492000    
 C   -2.373500       2.554400       1.106200    
 C   -1.238800       3.581200       1.251300    
 C   0.3679000       1.003100      -1.024600    
 C   -2.339400      0.1085000      0.5045000    
 C    1.858200       1.245400     -0.9508000    
 C   -3.084000     -0.6695000     -0.2946000    
 C   -3.557200      -2.044000      8.7200001E-02
 C    2.690300      0.1735000     -0.2610000    
 C   -3.121000      -3.124500     -0.9116000    
 C    4.184100      0.4877000     -0.2430000    
 C   -1.604100      -3.181500      -1.115400    
 C  -0.8344000      -3.558400      0.1546000    
 C   0.6838000      -3.547300     -2.7200000E-02
 C    5.003200     -0.6127000      0.3957000    
 C    1.398800      -3.938200       1.257600    
 H   5.3399999E-02   1.192800       1.097700    
 H   -2.226500       1.712300     -0.8822000    
 H   0.8256000       3.445000      0.6100000    
 H   -2.641600       2.150100       2.088700    
 H  -0.8273000       3.503700       2.264900    
 H   -1.575800       4.609900       1.088100    
 H  -3.0000001E-04   1.393900      -1.979900    
 H   0.1920000     -7.8000002E-02  -1.053100    
 H   -2.049500     -0.2650000       1.484100    
 H   0.3944000       3.616700      -1.562000    
 H   -3.285900       3.607300     -0.2674000    
 H   -3.378900     -0.3007000      -1.274300    
 H   -3.233100      -2.308900       1.098600    
 H    2.524800     -0.7695000     -0.7933000    
 H    2.319700      5.6800000E-02  0.7635000    
 H   -3.602500      -2.949200      -1.883000    
 H   -3.492600      -4.100600     -0.5744000    
 H   -1.233400      -2.228300      -1.508900    
 H   -1.390000      -3.930900      -1.887900    
 H    4.543300      0.6264000      -1.269400    
 H    4.361700       1.414200      0.3149000    
 H   -1.155900      -4.554000      0.4847000    
 H   -1.080500      -2.862800      0.9639000    
 H   -5.306100      -1.817300     -0.7785000    
 H   0.9668000      -4.243400     -0.8250000    
 H    1.010800      -2.549100     -0.3351000    
 H    2.482500      -3.928700       1.105000    
 H    1.163800      -3.238000       2.065600    
 H    1.109300      -4.944100       1.577900    
 H    6.870900      -1.047100      0.7496000    


%chk=000108131-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108131

0 1
O 0.045008 3.969255 0.065946
O -2.666163 3.811005 -0.490954
O 2.423710 2.664643 -0.607272
O -5.186070 -2.166870 0.129873
O 6.361281 -0.583957 -0.158033
O 4.424520 -1.711633 0.441959
C -0.423678 1.490788 0.141779
C -1.970070 1.421100 -0.188265
C -0.215036 2.814919 0.952895
C -2.580939 2.713313 0.477937
C -1.585823 3.053951 1.611604
C 0.439780 1.371521 -1.151104
C -2.563104 0.126662 0.315644
C 1.930075 1.524633 -0.876196
C -3.186167 -0.811449 -0.444474
C -3.698453 -2.131601 0.089993
C 2.789152 0.270895 -0.887092
C -3.165010 -3.343753 -0.715105
C 4.276603 0.528076 -0.604342
C -1.624525 -3.392516 -0.868703
C -0.837864 -3.478039 0.459868
C 0.692956 -3.480367 0.242757
C 4.971504 -0.703765 -0.061022
C 1.502452 -3.517171 1.556761
H -0.162158 0.647099 0.813425
H -2.144428 1.505557 -1.276680
H 0.610911 2.722533 1.684604
H -3.614691 2.544857 0.820011
H -1.714163 2.364315 2.467677
H -1.695936 4.089834 1.971400
H 0.127351 2.172472 -1.846371
H 0.231056 0.394436 -1.622685
H -2.447592 -0.072665 1.395092
H 0.972807 3.858941 -0.299822
H -1.738282 4.177100 -0.588309
H -3.324330 -0.633104 -1.524206
H -3.427871 -2.229853 1.155113
H 2.645936 -0.243870 -1.858237
H 2.376734 -0.437155 -0.136594
H -3.623516 -3.314392 -1.727727
H -3.533865 -4.265825 -0.225315
H -1.286882 -2.492138 -1.422823
H -1.359360 -4.264793 -1.500522
H 4.815732 0.884589 -1.498292
H 4.380294 1.342293 0.140181
H -1.137355 -4.390926 1.015513
H -1.100525 -2.616682 1.107189
H -5.524143 -2.094993 -0.800453
H 0.974471 -4.344950 -0.392535
H 0.972119 -2.573614 -0.335576
H 2.585829 -3.429186 1.362112
H 1.213535 -2.680126 2.221828
H 1.319745 -4.458021 2.109317
H 6.793341 -1.387774 0.241031


