%chk=000005590.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005590

0 1
 O    3.393500     -0.5682000     -0.1020000    
 O    4.938100       1.598000     -0.9211000    
 C   -2.216800      -1.144300      5.6899998E-02
 C   -2.768900       1.549200      4.0600002E-02
 C   -2.948100      0.1171000      0.6440000    
 C  -0.6835000     -0.9866000      1.3800000E-02
 C   -2.512700      -2.328600       1.022600    
 C   -2.839300      -1.548300      -1.296300    
 C   -3.562400       2.526200      0.9434000    
 C   -3.376900       1.657300      -1.371400    
 C   -1.313800       2.031100      7.9999998E-04
 C  -2.7600000E-02 -0.7141000       1.185500    
 C  -5.3300001E-02  -1.127600      -1.194600    
 C    1.359500     -0.5720000       1.146000    
 C    1.333800     -0.9857000      -1.234200    
 C    2.040200     -0.7077000     -6.3900001E-02
 C    3.983100      0.3094000      0.8560000    
 C    5.255300      0.8947000      0.2739000    
 H   -4.026100     -0.1047000      0.6572000    
 H   -2.674700      0.1935000       1.707000    
 H   -2.215300      -2.121200       2.056300    
 H   -3.585800      -2.554900       1.044200    
 H   -1.990700      -3.240500      0.7073000    
 H   -3.930500      -1.624800      -1.213500    
 H   -2.482500      -2.532700      -1.625200    
 H   -2.632500     -0.8446000      -2.103300    
 H   -3.173100       2.520800       1.967900    
 H   -4.623000       2.252800      0.9864000    
 H   -3.500900       3.556200      0.5736000    
 H   -4.360000       1.177300      -1.423600    
 H   -3.507500       2.706300      -1.663900    
 H   -2.727000       1.212000      -2.128400    
 H   -1.271600       3.098000     -0.2529000    
 H  -0.8271000       1.924200      0.9748000    
 H  -0.7246000       1.525800     -0.7658000    
 H  -0.5348000     -0.6025000       2.137300    
 H  -0.5489000      -1.344300      -2.131600    
 H    1.873300     -0.3810000       2.083500    
 H    1.859700      -1.092100      -2.179100    
 H    3.311300       1.146600       1.086200    
 H    4.212500     -0.2481000       1.770400    
 H    5.970800      0.1073000      1.7300000E-02
 H    5.726600       1.589300      0.9747000    
 H    4.510100      0.9681000      -1.526000    


%chk=000005590-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005590

0 1
O 3.585755 -0.243218 -0.174144
O 5.901799 1.421989 -0.391922
C -2.176302 -1.059523 -0.005747
C -3.162312 1.526035 -0.040609
C -2.955830 0.135109 0.661311
C -0.647165 -0.808247 -0.051942
C -2.415289 -2.304217 0.913598
C -2.750218 -1.415019 -1.401244
C -3.575773 2.523354 1.082434
C -4.323569 1.488808 -1.075157
C -1.878167 2.067831 -0.721410
C 0.060651 -0.458905 1.127218
C 0.120920 -0.965720 -1.236720
C 1.458638 -0.259042 1.139077
C 1.516248 -0.772468 -1.250750
C 2.191409 -0.413950 -0.062178
C 4.336391 0.145600 1.034916
C 5.780900 0.325929 0.571174
H -3.967727 -0.247581 0.915026
H -2.463454 0.334464 1.635007
H -2.098739 -2.106231 1.953867
H -3.488736 -2.573012 0.929202
H -1.843142 -3.175500 0.545611
H -3.846049 -1.539471 -1.335492
H -2.327866 -2.368493 -1.770708
H -2.543290 -0.636722 -2.155630
H -2.754116 2.665733 1.809789
H -4.461927 2.155870 1.635127
H -3.828067 3.512278 0.655291
H -5.260758 1.135225 -0.603321
H -4.509716 2.505041 -1.472782
H -4.106705 0.831301 -1.932916
H -2.056279 3.093972 -1.097356
H -1.030368 2.103239 -0.013753
H -1.565989 1.445516 -1.578214
H -0.481718 -0.336592 2.071934
H -0.369118 -1.241960 -2.174992
H 1.955398 0.010188 2.076285
H 2.095898 -0.896076 -2.171195
H 3.935905 1.099327 1.433392
H 4.256538 -0.645900 1.808610
H 6.152662 -0.627981 0.142141
H 6.418816 0.607413 1.425907
H 5.248360 1.248308 -1.117937


