%chk=000005484.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005484

0 1
 S   9.6600004E-02   2.237900       1.439500    
 S   -2.708400     -0.7624000      -1.337000    
 N    2.988200     -0.7155000      0.2868000    
 C   0.5441000      -2.133800     -0.5239000    
 C    1.622000      -2.777000      0.3478000    
 C   0.6245000     -0.6349000     -0.4153000    
 C    3.005100      -2.172200      7.9099998E-02
 C    2.009000     -6.2700003E-02 -0.6000000    
 C  -0.4476000      0.1275000     -0.1564000    
 C    4.322500     -0.1529000      7.9599999E-02
 C  -0.2702000       1.559200     -7.1000002E-02
 C   -1.726200     -0.5212000      2.4700001E-02
 C  -0.3625000       2.463700      -1.078100    
 C   -2.262700     -0.9787000       1.184000    
 C  -0.1221000       3.784300     -0.6003000    
 C   -3.544100      -1.559000      0.9579000    
 C   0.1404000       3.805400      0.7519000    
 C   -3.908500      -1.507800     -0.3695000    
 H  -0.4138000      -2.579300     -0.2477000    
 H   0.7188000      -2.410900      -1.571900    
 H    1.364600      -2.647700       1.407400    
 H    1.652600      -3.856000      0.1569000    
 H    3.720400      -2.636800      0.7684000    
 H    3.325300      -2.419800     -0.9416000    
 H    2.295900     -0.2158000      -1.650500    
 H    2.071300       1.014700     -0.4338000    
 H    5.042300     -0.6061000      0.7703000    
 H    4.324300      0.9228000      0.2882000    
 H    4.682700     -0.3071000     -0.9439000    
 H  -0.5874000       2.220400      -2.109000    
 H   -1.785200     -0.9151000       2.153700    
 H  -0.1406000       4.673500      -1.216900    
 H   -4.166900      -1.992300       1.729700    
 H   0.3560000       4.666400       1.368600    
 H   -4.822000      -1.872600     -0.8174000    


%chk=000005484-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000005484

0 1
S -1.164424 2.567442 1.131563
S -3.239109 -0.011620 -0.795104
N 3.039284 -0.807895 0.331872
C 0.654060 -2.148013 -0.671226
C 1.686368 -2.880594 0.223382
C 0.688090 -0.647374 -0.440017
C 3.081889 -2.257497 0.036992
C 2.092249 -0.070638 -0.551712
C -0.431171 0.122996 -0.182888
C 4.376479 -0.185747 0.321582
C -0.389101 1.601010 -0.207096
C -1.742315 -0.493150 0.128094
C 0.165023 2.463369 -1.151103
C -2.067659 -1.441442 1.094317
C 0.005176 3.862917 -0.849800
C -3.461134 -1.807619 1.127199
C -0.679797 4.094461 0.333105
C -4.226608 -1.139809 0.184019
H -0.357502 -2.560247 -0.535533
H 0.941635 -2.327329 -1.731959
H 1.393058 -2.793744 1.286238
H 1.717890 -3.955397 -0.038679
H 3.810500 -2.730508 0.721730
H 3.434183 -2.453547 -1.013163
H 2.428082 -0.122792 -1.626368
H 2.106483 0.990411 -0.254271
H 5.034487 -0.708841 1.038313
H 4.299013 0.870456 0.636074
H 4.870000 -0.211985 -0.684351
H 0.644538 2.093670 -2.061444
H -1.319582 -1.839202 1.785202
H 0.372520 4.665427 -1.494084
H -3.879863 -2.529383 1.832752
H -0.948599 5.042935 0.795193
H -5.295742 -1.212521 -0.008531


