%chk=000005882.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005882

0 1
 O   -4.635700      -1.151800     -0.3066000    
 C   -1.682800      0.6790000     -0.3087000    
 C   -2.343200     -0.5858000      0.2792000    
 C  -0.2127000      0.7741000      9.5500000E-02
 C   0.5388000     -0.4537000     -0.5071000    
 C   -1.673900      -1.800000     -0.3552000    
 C   -2.648800       1.803500      4.6700001E-02
 C  -0.1516000      -1.789300     -0.1148000    
 C   0.4576000       2.057300     -0.3973000    
 C   -3.774100     -0.2991000     -0.1388000    
 C   -4.017500       1.193100     -0.2910000    
 C   -2.348700     -0.6948000       1.815300    
 C    2.034300     -0.3860000     -0.2112000    
 C    1.878700       2.143400      0.1520000    
 C    2.656600      0.8536000      5.4299999E-02
 C    2.843100      -1.534100     -0.2825000    
 C    4.041900      0.9057000      0.2895000    
 C    4.219500      -1.466900     -5.4800000E-02
 C    4.818500     -0.2480000      0.2356000    
 H   -1.705700      0.6100000      -1.410300    
 H  -0.1299000      0.7574000       1.189900    
 H   0.4643000     -0.3818000      -1.603400    
 H   -1.866900      -1.815200      -1.436000    
 H   -2.102200      -2.729900      3.8400002E-02
 H   -2.471100       2.711900     -0.5371000    
 H   -2.586900       2.071100       1.107000    
 H   5.6600001E-02  -2.014700      0.9384000    
 H   0.2715000      -2.618100     -0.6942000    
 H  -9.8499998E-02   2.944800     -7.5999998E-02
 H   0.4793000       2.073300      -1.494600    
 H   -4.296200       1.401400      -1.328000    
 H   -4.792100       1.536700      0.3977000    
 H   -1.343400     -0.7514000       2.241000    
 H   -2.861300      0.1470000       2.292700    
 H   -2.884900      -1.599200       2.128100    
 H    1.834600       2.428900       1.211000    
 H    2.411900       2.940000     -0.3809000    
 H    2.421100      -2.505000     -0.5240000    
 H    4.522000       1.855100      0.5158000    
 H    4.821800      -2.369200     -0.1095000    
 H    5.888100     -0.1941000      0.4151000    


%chk=000005882-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005882

0 1
O -4.694291 -1.240051 -0.369518
C -1.688073 0.704387 -0.314525
C -2.358497 -0.591902 0.235994
C -0.207641 0.801292 0.087931
C 0.538506 -0.440892 -0.499514
C -1.658613 -1.824883 -0.370103
C -2.691470 1.833580 0.043319
C -0.131439 -1.785182 -0.081753
C 0.488341 2.088232 -0.402139
C -3.829039 -0.357056 -0.157534
C -4.069880 1.169030 -0.242735
C -2.373107 -0.679245 1.797618
C 2.049446 -0.379680 -0.210999
C 1.913182 2.174211 0.179288
C 2.692196 0.863684 0.071780
C 2.850458 -1.551032 -0.275856
C 4.094320 0.892046 0.279622
C 4.245083 -1.512130 -0.066436
C 4.875919 -0.279368 0.214271
H -1.708969 0.611973 -1.426813
H -0.128323 0.777782 1.196024
H 0.418450 -0.362822 -1.606250
H -1.827339 -1.835092 -1.465948
H -2.095910 -2.760238 0.026618
H -2.538261 2.744341 -0.560593
H -2.600995 2.125027 1.106508
H 0.064510 -1.971635 0.992433
H 0.338007 -2.623257 -0.629692
H -0.088833 2.983546 -0.101607
H 0.526203 2.081849 -1.511006
H -4.429242 1.397969 -1.264844
H -4.878572 1.470059 0.447451
H -1.353118 -0.771386 2.206633
H -2.844099 0.203043 2.266963
H -2.947122 -1.572070 2.104388
H 1.845321 2.458608 1.250630
H 2.483971 2.984102 -0.314895
H 2.381700 -2.515483 -0.497122
H 4.577077 1.854690 0.493141
H 4.833514 -2.434764 -0.124909
H 5.958728 -0.232084 0.375378


