%chk=000080451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080451

0 1
 O   -3.965300      0.3039000     -1.1600000E-02
 O   0.7428000       2.035500      2.2600001E-02
 O   -2.707600      -1.629600      2.6600000E-02
 C  -0.2801000     -0.1504000      4.5800000E-02
 C   -1.635700      0.5567000      3.3500001E-02
 C   0.8970000      0.8164000      2.2900000E-02
 C    2.281700      0.2588000      4.4000000E-03
 C   -2.800500     -0.4099000      1.4000000E-02
 C    2.441500      -1.107900      8.8999998E-03
 C    3.343900       1.133200     -1.6799999E-02
 C   -5.165400     -0.4758000     -2.4300000E-02
 C    3.735300      -1.629100     -8.6000003E-03
 C    4.637600      0.6118000     -3.4499999E-02
 C    4.833200     -0.7693000     -3.0400001E-02
 C   -6.358400      0.4556000     -5.2400000E-02
 H  -0.2188000     -0.7983000     -0.8364000    
 H  -0.2131000     -0.7664000      0.9502000    
 H   -1.708600       1.195400     -0.8546000    
 H   -1.729200       1.188500      0.9245000    
 H    1.619200      -1.813500      2.6900001E-02
 H    3.213900       2.210900     -2.0500001E-02
 H   -5.175100      -1.116500     -0.9131000    
 H   -5.204500      -1.100400      0.8751000    
 H    3.888400      -2.704400     -5.1000002E-03
 H    5.492900       1.281000     -5.1399998E-02
 H    5.840500      -1.175100     -4.4000000E-02
 H   -7.295000     -0.1087000     -6.2700003E-02
 H   -6.352700       1.115500      0.8214000    
 H   -6.323700       1.099600     -0.9373000    


%chk=000080451-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080451

0 1
O -4.022335 0.334409 -0.010607
O 0.724339 2.067071 -0.018379
O -2.750616 -1.617865 -0.005782
C -0.297598 -0.143685 -0.002733
C -1.640931 0.598099 -0.007071
C 0.897167 0.811124 -0.008703
C 2.283107 0.228780 -0.003037
C -2.814939 -0.364694 -0.007502
C 2.522983 -1.172348 0.006718
C 3.390323 1.120947 -0.007677
C -5.266664 -0.497317 -0.011413
C 3.844107 -1.668780 0.011776
C 4.708207 0.624709 -0.002609
C 4.938698 -0.772874 0.007162
C -6.443162 0.472808 -0.012037
H -0.232963 -0.820212 -0.877244
H -0.232650 -0.809784 0.879684
H -1.721190 1.266647 -0.883487
H -1.725120 1.269999 0.866438
H 1.686340 -1.878707 0.010283
H 3.183863 2.196443 -0.015230
H -5.249500 -1.145969 -0.906011
H -5.250565 -1.146260 0.882986
H 4.021478 -2.749685 0.019273
H 5.555389 1.319172 -0.006224
H 5.963730 -1.160237 0.011121
H -7.393810 -0.091096 -0.012766
H -6.422334 1.118251 0.882586
H -6.421154 1.118552 -0.906414


