%chk=000017353.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017353

0 1
 O   -1.966900      -1.567300     -0.2238000    
 O    2.470700      -1.764500      -1.946800    
 O    4.236200      -1.856800      0.9482000    
 C   -4.121300     -0.4469000     -0.2280000    
 C   -5.120200      0.2737000      0.7019000    
 C   -3.866600      0.2806000      -1.567200    
 C   -6.506300      0.4698000      7.9099998E-02
 C   -2.820500     -0.7279000      0.5419000    
 C   -7.484200       1.200600       1.003300    
 C   -3.263200       1.672900      -1.442700    
 C   -8.854400       1.421400      0.3810000    
 C  -0.6177000      -1.408300     -4.1700002E-02
 C   0.2533000      -1.667700      -1.093600    
 C  -0.1347000     -0.9877000       1.192000    
 C    2.118600      -1.082400      0.3261000    
 C    1.626400      -1.504200     -0.9090000    
 C    1.238100     -0.8243000       1.376700    
 C    3.548400     -0.9096000      0.5419000    
 C    4.243500      0.3876000      0.2898000    
 C    3.501900       1.455000     -0.1615000    
 C    5.597900      0.4646000      0.5191000    
 C    4.150900       2.667000     -0.3967000    
 C    6.246900       1.676700      0.2839000    
 C    5.523300       2.777900     -0.1739000    
 H   -4.554900      -1.421800     -0.4926000    
 H   -4.714900       1.245000       1.009700    
 H   -5.238400     -0.3137000       1.621900    
 H   -3.194000     -0.3298000      -2.182800    
 H   -4.799000      0.3472000      -2.138400    
 H   -6.923900     -0.5070000     -0.1935000    
 H   -6.422100       1.051500     -0.8451000    
 H   -2.350900      0.2309000      0.7937000    
 H   -3.055400      -1.251400       1.477000    
 H   -7.603900      0.6278000       1.930600    
 H   -7.062500       2.173500       1.282500    
 H   -2.280200       1.647900     -0.9647000    
 H   -3.130800       2.108500      -2.438800    
 H   -3.912400       2.344600     -0.8743000    
 H   -9.322800      0.4670000      0.1208000    
 H   -8.777300       2.025700     -0.5284000    
 H   -9.511400       1.944000       1.083200    
 H  -0.1331000      -1.995700      -2.054900    
 H  -0.7823000     -0.8068000       2.044400    
 H    1.610600     -0.5027000       2.346000    
 H    3.393500      -1.632800      -1.676300    
 H    2.434400       1.407500     -0.3465000    
 H    6.181800     -0.3783000      0.8751000    
 H    3.588100       3.524800     -0.7533000    
 H    7.315600       1.763400      0.4571000    
 H    6.028700       3.721600     -0.3571000    


%chk=000017353-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017353

0 1
O -1.933821 -0.742246 -0.848789
O 2.269152 -2.453858 -2.273077
O 4.392345 -1.666190 -1.186010
C -4.244522 -0.142437 -0.364809
C -5.167375 0.584894 0.652227
C -4.527106 0.220923 -1.850984
C -6.671401 0.279083 0.469302
C -2.777962 0.107861 0.022031
C -7.549977 0.909039 1.574513
C -4.417060 1.722739 -2.200102
C -9.052380 0.602080 1.394962
C -0.550990 -0.687071 -0.700058
C 0.184265 -1.541215 -1.546722
C 0.114888 0.145805 0.253455
C 2.298455 -0.691506 -0.553441
C 1.590966 -1.572785 -1.468111
C 1.512959 0.129842 0.309838
C 3.763121 -0.733103 -0.529068
C 4.598252 0.262542 0.215359
C 4.290613 1.649770 0.251167
C 5.794994 -0.197410 0.827814
C 5.154254 2.552675 0.909140
C 6.645527 0.702983 1.500215
C 6.325864 2.081469 1.545574
H -4.418945 -1.234095 -0.257641
H -5.008091 1.681455 0.592785
H -4.871788 0.285441 1.680532
H -3.820749 -0.351620 -2.480669
H -5.540222 -0.138569 -2.115316
H -6.823241 -0.820594 0.462999
H -7.016944 0.647287 -0.517420
H -2.495173 1.170859 -0.119212
H -2.602694 -0.171981 1.080817
H -7.211332 0.540015 2.564380
H -7.393594 2.007354 1.582617
H -3.407861 2.121851 -1.988680
H -4.609788 1.880465 -3.276780
H -5.148450 2.333535 -1.639443
H -9.239134 -0.488203 1.416751
H -9.422878 0.985524 0.425449
H -9.659039 1.064636 2.194985
H -0.331833 -2.198437 -2.250033
H -0.449091 0.778197 0.942939
H 2.018115 0.741952 1.062664
H 3.274885 -2.375964 -2.014694
H 3.406835 2.028094 -0.272836
H 6.042236 -1.261578 0.759071
H 4.918604 3.622537 0.916046
H 7.558702 0.335600 1.980822
H 6.991010 2.783453 2.060741


