%chk=000131129.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131129

0 1
 O  -0.3916000       1.382800     -0.8450000    
 O    2.209300      0.8978000     -1.4200000E-02
 O    3.554200     -0.5288000      -1.345800    
 O   -2.655300      0.8326000     -0.7161000    
 O    1.511900       4.324800      0.2202000    
 O  -0.8349000       4.399700       1.906000    
 O   -3.178400       3.353200      0.4590000    
 O    5.075600      -1.033000       1.101100    
 O    1.474700      -1.569100       1.379600    
 O    4.099700      -3.251900     -0.4944000    
 C   0.5990000       2.409100     -0.9254000    
 C   0.5781000       3.255900      0.3493000    
 C  -0.8170000       3.830500      0.5960000    
 C   -1.888100       2.744200      0.4983000    
 C   -1.715700       1.905700     -0.7682000    
 C    1.949500       1.729800      -1.130000    
 C    3.459800      0.2277000     -0.1358000    
 C    3.699300     -0.6593000       1.090600    
 C    2.823400      -1.919100       1.077400    
 C    2.843600      -2.610300     -0.2876000    
 C    2.627700      -1.612900      -1.421500    
 C   -2.556500      4.3000001E-03  -1.864000    
 C   -3.582800      -1.120100      -1.778300    
 C   -3.355700      -2.014600     -0.5838000    
 C   -2.534400      -3.123800     -0.7120000    
 C   -3.972000      -1.710600      0.6199000    
 C   -2.324200      -3.950300      0.3918000    
 C   -3.761600      -2.537200       1.723600    
 C   -2.937700      -3.657000       1.609500    
 H   0.4030000       3.035100      -1.806100    
 H   0.8669000       2.665200       1.228000    
 H   -1.034100       4.648800     -0.1016000    
 H   -1.859700       2.108800       1.392400    
 H   -1.934700       2.509200      -1.659700    
 H    2.749800       2.467800      -1.251400    
 H    1.894300       1.125400      -2.042300    
 H    4.253400      0.9841000     -0.1796000    
 H    3.500400     -7.6300003E-02   1.997900    
 H    3.172200      -2.623400       1.842100    
 H    2.065000      -3.380700     -0.3308000    
 H    1.603100      -1.224800      -1.414600    
 H    2.788900      -2.097300      -2.390300    
 H    2.404800       3.952200      0.3129000    
 H  -0.1356000       5.074800       1.939800    
 H   -3.834800       2.639400      0.3836000    
 H   -1.551300     -0.4264000      -1.942400    
 H   -2.751900      0.6000000      -2.763300    
 H    5.228300      -1.566300       1.899800    
 H    1.469500      -1.154000       2.258900    
 H    4.058000      -3.713400      -1.349400    
 H   -3.558600      -1.716700      -2.698500    
 H   -4.592600     -0.6943000      -1.715100    
 H   -2.049900      -3.358600      -1.655400    
 H   -4.615500     -0.8413000      0.7201000    
 H   -1.681500      -4.821300      0.3033000    
 H   -4.239000      -2.308800       2.672100    
 H   -2.773500      -4.300200       2.469000    


%chk=000131129-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131129

0 1
O -0.278258 1.439620 -0.865210
O 2.620166 1.068710 -0.209387
O 2.214347 -1.078042 -1.259036
O -2.553676 0.925764 -0.582891
O 1.720799 4.329365 0.472288
O -0.657005 4.461936 2.031648
O -3.031143 3.584469 0.549684
O 4.644455 -2.005660 0.291900
O 2.022838 -0.092843 2.222266
O 2.335265 -3.435815 0.631270
C 0.744157 2.505415 -0.934363
C 0.740297 3.232184 0.429216
C -0.631741 3.889520 0.690105
C -1.762629 2.857443 0.592489
C -1.632656 2.014665 -0.695998
C 2.067091 1.856683 -1.332006
C 3.205957 -0.237649 -0.621986
C 3.811580 -0.866131 0.659267
C 2.684143 -1.267411 1.647205
C 1.635627 -2.157449 0.928855
C 1.109682 -1.486692 -0.346318
C -2.755189 0.179389 -1.850385
C -3.613186 -1.060618 -1.543976
C -2.879922 -2.171918 -0.803571
C -2.452566 -3.336718 -1.492298
C -2.614879 -2.073521 0.587952
C -1.781887 -4.380957 -0.812391
C -1.949087 -3.115067 1.271901
C -1.530387 -4.274874 0.575658
H 0.478244 3.236336 -1.733727
H 0.937136 2.497254 1.233900
H -0.794202 4.678291 -0.078763
H -1.707755 2.173738 1.464644
H -1.858865 2.648018 -1.588893
H 2.801085 2.638535 -1.606053
H 1.888146 1.188527 -2.194237
H 3.981740 -0.088849 -1.393702
H 4.478743 -0.128516 1.136097
H 3.119741 -1.828977 2.489346
H 0.788123 -2.339640 1.615484
H 0.492640 -0.605224 -0.096182
H 0.499988 -2.181342 -0.947937
H 2.604448 3.963046 0.725802
H 0.116001 5.082628 2.088792
H -3.761811 2.920280 0.633452
H -1.769943 -0.102753 -2.265268
H -3.280799 0.844529 -2.567857
H 4.029475 -2.792028 0.190892
H 1.982233 0.596603 1.498529
H 1.740931 -4.017229 0.093608
H -3.990866 -1.445669 -2.510399
H -4.494551 -0.724146 -0.965207
H -2.658029 -3.434842 -2.565832
H -2.929796 -1.174981 1.128877
H -1.476729 -5.280125 -1.360181
H -1.767228 -3.027890 2.349335
H -1.035491 -5.092270 1.113195


