%chk=000004953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004953

0 1
 O   -4.306900      -2.686600       1.550700    
 O  -0.8738000       2.899000      -3.164400    
 O    6.365100     -0.4886000      0.6084000    
 O    5.472800      -2.376300     -0.2797000    
 C   -2.504200      -1.382300      0.5710000    
 C   -2.387700     -0.9246000     -0.8977000    
 C   -1.375400      -2.310000      0.9937000    
 C   -3.836300      -2.095100      0.5901000    
 C   -3.700300      -1.329300      -1.506500    
 C   -2.136400      0.5417000      -1.018300    
 C   -4.531000      -1.989700     -0.6987000    
 C  -0.8347000       2.545500      -1.780500    
 C   0.5376000       2.963200      -1.235000    
 C   -1.084700       1.068200      -1.662700    
 C   0.6958000       2.702400      0.2658000    
 C   2.9000000E-03  -1.711900       1.073900    
 C  -0.3767000       3.388700       1.117900    
 C  -0.1808000       3.188600       2.621200    
 C    1.102000      -2.120200      0.4214000    
 C    2.441300      -1.455400      0.5518000    
 C    2.986600     -0.9024000     -0.7722000    
 C   -1.275900       3.879700       3.419600    
 C    4.362600     -0.2407000     -0.6499000    
 C    5.438200      -1.163900     -0.1201000    
 H   -2.575400     -0.5290000       1.258600    
 H   -1.599200      -1.484200      -1.418100    
 H   -1.357100      -3.190200      0.3361000    
 H   -1.605200      -2.707400       1.991600    
 H   -3.943400      -1.120300      -2.541100    
 H   -2.854500       1.212100     -0.5499000    
 H   -5.505400      -2.385900     -0.9230000    
 H   -1.627700       3.127000      -1.299700    
 H   0.6932000       4.030400      -1.439800    
 H    1.334900       2.442400      -1.781500    
 H  -0.3639000      0.4069000      -2.137800    
 H   0.6855000       1.624000      0.4629000    
 H    1.685000       3.061700      0.5754000    
 H   8.9900002E-02 -0.8554000       1.740500    
 H  -0.3816000       4.462500      0.8933000    
 H   -1.367800       3.002900      0.8578000    
 H   0.7944000       3.586300       2.924400    
 H  -0.1828000       2.117800       2.855700    
 H    1.037200      -2.977000     -0.2441000    
 H    2.395300     -0.6390000       1.283600    
 H    3.133900      -2.198600      0.9626000    
 H   -1.755100       2.666500      -3.504400    
 H    2.279900     -0.1681000      -1.178600    
 H    3.046500      -1.718400      -1.504000    
 H   -1.116700       3.726400       4.491600    
 H   -1.281100       4.957300       3.227400    
 H   -2.261700       3.479400       3.162100    
 H    4.689800      0.1274000      -1.628000    
 H    4.276500      0.6202000      2.3800001E-02
 H    7.053100      -1.087500      0.9695000    


%chk=000004953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004953

0 1
O -4.424219 -2.879005 1.507679
O -0.624914 2.859045 -3.252315
O 6.562094 -0.338437 0.120347
O 5.386270 -2.295450 -0.292955
C -2.590408 -1.539536 0.467529
C -2.434818 -1.039982 -1.007747
C -1.449060 -2.465715 0.978573
C -3.962533 -2.259153 0.511740
C -3.761069 -1.432150 -1.661611
C -2.148981 0.446670 -1.135187
C -4.601956 -2.101201 -0.819956
C -0.764249 2.461667 -1.825602
C 0.573880 2.872181 -1.177515
C -1.046664 0.979697 -1.724349
C 0.658710 2.617664 0.345577
C -0.129722 -1.742744 1.138870
C -0.306202 3.475755 1.197303
C -0.115230 3.265874 2.716790
C 1.034877 -2.090252 0.530697
C 2.355480 -1.368806 0.695178
C 2.890287 -0.807210 -0.650453
C -1.075863 4.120658 3.571172
C 4.251242 -0.096135 -0.513251
C 5.399828 -1.046585 -0.227039
H -2.654833 -0.668408 1.151602
H -1.607266 -1.590174 -1.501074
H -1.332280 -3.325034 0.289833
H -1.785297 -2.878825 1.951613
H -3.970764 -1.182810 -2.707741
H -2.905305 1.117629 -0.695361
H -5.593552 -2.497574 -1.051145
H -1.601798 3.027617 -1.364475
H 0.732939 3.946711 -1.393523
H 1.379879 2.320005 -1.700567
H -0.284122 0.320387 -2.167508
H 0.472824 1.544014 0.553830
H 1.697844 2.825966 0.674366
H -0.136490 -0.870692 1.814248
H -0.155138 4.548203 0.953063
H -1.358212 3.241883 0.933198
H 0.933956 3.504386 2.987161
H -0.260378 2.192057 2.957229
H 1.044571 -2.964307 -0.141445
H 2.243373 -0.541572 1.424183
H 3.111588 -2.069329 1.103113
H -1.433485 2.555611 -3.739727
H 2.154535 -0.089415 -1.060527
H 2.983411 -1.635163 -1.378749
H -0.915341 3.952918 4.651939
H -0.930396 5.199029 3.370988
H -2.131540 3.878032 3.345350
H 4.507126 0.444501 -1.446435
H 4.230232 0.672193 0.282634
H 7.303741 -0.984491 0.277154


