%chk=000002449.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002449

0 1
 O   -1.324500      0.1868000       1.803800    
 O   -1.096100      -3.772700      -1.734300    
 O    7.660900      0.9451000      0.8075000    
 O    6.707600     -0.3970000     -0.7630000    
 C   -1.019200       1.028100     -0.8033000    
 C   0.2627000       1.629500     -0.1826000    
 C    1.565900      0.8837000     -0.5074000    
 C   -1.127800     -0.4359000     -0.4702000    
 C    2.831700       1.419900      0.1687000    
 C   -2.281500       1.773500     -0.4034000    
 C   -1.096300      -1.435700      -1.366500    
 C    4.108800      0.6906000     -0.2610000    
 C   -1.262100     -0.7296000      0.9858000    
 C   -1.332500      -2.149800       1.434700    
 C   -1.163300      -2.856100     -0.9170000    
 C   -1.301200      -3.149500      0.5384000    
 C   -2.186700       3.101200     -3.5000000E-02
 C   -3.488500       1.102500     -0.4191000    
 C    5.341900       1.183000      0.4979000    
 C   -1.010800      -1.257200      -2.859100    
 C   -1.419900      -2.328300       2.927200    
 C   -1.412600      -4.613500      0.8717000    
 C   -3.345500       3.785400      0.3326000    
 C   -4.647300       1.786700     -5.1700000E-02
 C   -4.575600       3.128100      0.3241000    
 C    6.611900      0.4812000      8.1000000E-02
 H  -0.9227000       1.184000      -1.882500    
 H   0.4130000       2.641800     -0.5798000    
 H   0.1844000       1.750200      0.9038000    
 H    1.473300     -0.1699000     -0.2208000    
 H    1.710800      0.8968000      -1.595300    
 H    2.935300       2.487900     -5.8499999E-02
 H    2.713100       1.337600       1.256200    
 H    3.987600     -0.3872000     -9.4800003E-02
 H    4.260600      0.8242000      -1.339400    
 H   -1.262000       3.664000     -2.6300000E-02
 H   -3.595000      6.9799997E-02 -0.7336000    
 H    5.199600       1.016300       1.571700    
 H    5.475200       2.256300      0.3210000    
 H   1.6000001E-02  -1.426100      -3.199100    
 H   -1.664900      -1.969000      -3.375300    
 H   -1.331500     -0.2721000      -3.203200    
 H   -1.209600      -3.348000       3.257100    
 H  -0.6853000      -1.692700       3.434600    
 H   -2.418200      -2.052600       3.282000    
 H   -2.127300      -5.107500      0.2037000    
 H   -1.772700      -4.803200       1.885200    
 H  -0.4392000      -5.101400      0.7573000    
 H   -3.291300       4.831000      0.6215000    
 H   -5.606600       1.277400     -6.4999998E-02
 H   -5.478200       3.661400      0.6078000    
 H    8.499400      0.4965000      0.5666000    


%chk=000002449-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002449

0 1
O -1.248102 0.058753 2.087832
O -1.318000 -3.924555 -1.594548
O 7.939517 1.396783 0.295474
O 6.944593 -0.066147 -1.207056
C -0.889329 0.928553 -0.627678
C 0.411875 1.541831 -0.028970
C 1.700381 0.860912 -0.540618
C -1.089622 -0.542727 -0.242613
C 2.978371 1.480498 0.068055
C -2.167420 1.741349 -0.328065
C -1.073932 -1.564200 -1.171347
C 4.272414 0.822049 -0.457203
C -1.318473 -0.861205 1.206652
C -1.614645 -2.268012 1.630940
C -1.333293 -2.980412 -0.735603
C -1.619505 -3.284263 0.701258
C -2.257866 2.677678 0.730852
C -3.302704 1.550787 -1.159251
C 5.534554 1.440385 0.172951
C -0.810737 -1.366522 -2.651197
C -1.889418 -2.507396 3.096879
C -1.900447 -4.722355 1.069013
C -3.447429 3.409007 0.946556
C -4.495887 2.274984 -0.943924
C -4.571802 3.211672 0.112448
C 6.821895 0.825984 -0.339932
H -0.762669 0.951728 -1.726873
H 0.437449 2.615549 -0.304291
H 0.376141 1.486843 1.073289
H 1.674907 -0.222486 -0.304173
H 1.749762 0.939979 -1.647550
H 2.997857 2.568455 -0.152921
H 2.934558 1.387722 1.173376
H 4.252921 -0.264990 -0.248881
H 4.325945 0.920523 -1.558376
H -1.406562 2.824823 1.400660
H -3.252008 0.829448 -1.985255
H 5.524152 1.335276 1.275634
H 5.581723 2.530791 -0.019182
H 0.184181 -0.919084 -2.828632
H -0.851394 -2.339066 -3.165325
H -1.558529 -0.697147 -3.115253
H -1.187954 -3.251220 3.520339
H -1.795288 -1.567444 3.661488
H -2.909204 -2.910824 3.247805
H -1.852118 -5.361881 0.174651
H -2.901244 -4.826540 1.529644
H -1.169119 -5.094381 1.811868
H -3.498653 4.129019 1.771329
H -5.359579 2.112625 -1.598859
H -5.493795 3.778798 0.283199
H 8.767331 0.975547 -0.063918


