%chk=000014717.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014717

0 1
 O   -4.454400     -0.7549000      0.1760000    
 O    5.925700      0.1106000       1.154500    
 O   -6.133300      0.7975000     -0.1535000    
 C   -1.267100      0.9900000     -0.1194000    
 C   0.2444000      0.8059000      4.7800001E-02
 C   -2.039100     -0.3411000     -9.2500001E-02
 C   0.7832000     -0.1096000      -1.092600    
 C    2.339700     -0.3475000     -0.9772000    
 C   -1.579000      -1.172600      -1.294100    
 C  -5.9000000E-02  -1.408000      -1.268000    
 C   -3.478500      0.1977000     -0.1999000    
 C   -2.020600       1.859300      0.8852000    
 C    3.062200       1.036800     -0.9110000    
 C   0.9634000       2.157900      1.2600000E-02
 C   -3.488800       1.424400      0.7318000    
 C    2.467400       1.988000      0.1502000    
 C   -1.864100      -1.163000       1.209400    
 C    2.823300      -1.129600      -2.224000    
 C    2.729900      -1.171300      0.2400000    
 C    4.566700      0.8821000     -0.6511000    
 C    3.858200      -1.025500      0.9543000    
 C    4.859700      5.4000001E-03  0.5481000    
 C    4.188000      -1.875200       2.141800    
 C   -5.755300     -0.3241000      0.1568000    
 C   -6.672700      -1.433100      0.5747000    
 H   -1.421900       1.461100      -1.104900    
 H   0.4494000      0.3413000       1.019600    
 H   0.6314000      0.4505000      -2.030000    
 H   -1.835100     -0.6583000      -2.229700    
 H   -2.101200      -2.136600      -1.320700    
 H   0.1695000      -2.128500     -0.4779000    
 H   0.2084000      -1.896900      -2.211600    
 H   -3.677200      0.5181000      -1.232500    
 H   -1.674600       1.679700       1.909200    
 H   -1.898300       2.927100      0.6765000    
 H    2.944100       1.534000      -1.884500    
 H   0.6069000       2.799900      0.8263000    
 H   0.7403000       2.682000     -0.9253000    
 H   -3.926900       1.206100       1.712300    
 H   -4.072700       2.239400      0.2898000    
 H    2.941900       2.973500      6.2799998E-02
 H    2.688600       1.632600       1.163800    
 H  -0.8215000      -1.426400       1.406700    
 H   -2.228400     -0.6285000       2.092300    
 H   -2.424000      -2.103600       1.149200    
 H    2.551500     -0.6036000      -3.146000    
 H    3.909100      -1.270400      -2.234500    
 H    2.391500      -2.135300      -2.269700    
 H    2.049300      -1.963600      0.5397000    
 H    5.015600       1.866600     -0.4721000    
 H    5.076800      0.4492000      -1.517700    
 H    5.114900      -2.431800       1.969200    
 H    3.399100      -2.603400       2.358000    
 H    4.316200      -1.252000       3.032900    
 H   -6.429900      -1.750100       1.592000    
 H   -6.582000      -2.270400     -0.1218000    
 H   -7.706100      -1.075300      0.5581000    


%chk=000014717-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014717

0 1
O -4.514337 -0.717661 0.310908
O 6.030082 0.063732 1.084060
O -6.156775 0.499699 -0.817602
C -1.257472 1.050068 -0.022455
C 0.264146 0.850605 0.101094
C -2.064170 -0.287640 0.015984
C 0.759141 -0.081960 -1.052856
C 2.316973 -0.340602 -0.988062
C -1.619282 -1.142969 -1.190775
C -0.085448 -1.387200 -1.171354
C -3.493205 0.301744 -0.074472
C -1.993131 1.968962 0.992188
C 3.081252 1.032511 -0.960720
C 1.015962 2.200038 0.040795
C -3.496058 1.536266 0.876731
C 2.539456 2.000130 0.124013
C -1.894387 -1.070370 1.344678
C 2.743490 -1.146985 -2.258958
C 2.714934 -1.157890 0.235892
C 4.598698 0.819112 -0.744013
C 3.903262 -1.050081 0.911021
C 4.919309 -0.043038 0.479598
C 4.264929 -1.915329 2.099684
C -5.821545 -0.494133 -0.134021
C -6.733125 -1.611195 0.329431
H -1.431656 1.485034 -1.035486
H 0.493547 0.370698 1.077191
H 0.595712 0.489657 -1.997086
H -1.893302 -0.615396 -2.128751
H -2.147234 -2.116586 -1.202188
H 0.154391 -2.073750 -0.336907
H 0.188438 -1.924017 -2.098149
H -3.721356 0.615498 -1.111332
H -1.609758 1.806472 2.017132
H -1.853082 3.038644 0.759016
H 2.928966 1.514154 -1.950712
H 0.680268 2.859669 0.864085
H 0.754053 2.714780 -0.908734
H -3.907482 1.242392 1.859271
H -4.139743 2.337218 0.477509
H 3.059549 2.972757 0.018924
H 2.799560 1.613969 1.129761
H -0.854262 -1.405803 1.494109
H -2.176860 -0.462492 2.222025
H -2.544974 -1.961803 1.338469
H 2.378796 -0.641245 -3.173815
H 3.840258 -1.241496 -2.328199
H 2.334594 -2.171736 -2.247731
H 2.004956 -1.930420 0.567174
H 5.120894 1.785708 -0.619377
H 5.065054 0.330208 -1.622340
H 5.200534 -2.471531 1.908487
H 3.462051 -2.635665 2.333684
H 4.458603 -1.293700 2.992745
H -6.733423 -1.668242 1.431780
H -6.369812 -2.582041 -0.049536
H -7.755377 -1.430251 -0.032409


