%chk=000007188.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007188

0 1
 S    1.082700      -2.078800      0.3676000    
 S  -0.1866000     -0.8841000       1.467400    
 S   0.6803000     -0.8430000      -2.357400    
 S   -2.429900      -2.757100      0.7095000    
 N    2.640200     -0.2624000     -0.6579000    
 N   -2.333300     -0.1521000      0.1891000    
 C    4.391000       1.556600      0.7186000    
 C   -4.313800       1.882600     -0.2658000    
 C    3.192300       2.063600     -8.4100001E-02
 C    4.137100      0.1452000       1.249400    
 C   -3.418500       1.909900      0.9735000    
 C   -4.519100      0.4505000     -0.7614000    
 C    2.813800       1.083900      -1.190800    
 C    3.744100     -0.8070000      0.1237000    
 C   -2.099500       1.185900      0.7195000    
 C   -3.184100     -0.2517000     -0.9910000    
 C    1.535300     -0.9985000     -0.9348000    
 C   -1.732000      -1.243300      0.7250000    
 H    5.284000       1.554100      8.1600003E-02
 H    4.592500       2.236300       1.553800    
 H   -5.283100       2.337400     -3.3599999E-02
 H   -3.857000       2.484000      -1.061200    
 H    2.338700       2.194900      0.5930000    
 H    3.419200       3.045100     -0.5145000    
 H    5.034800     -0.2266000       1.755500    
 H    3.334100      0.1803000       1.995900    
 H   -3.225400       2.946500       1.271000    
 H   -3.945700       1.425800       1.805300    
 H   -5.101600     -0.1072000     -1.7700000E-02
 H   -5.100700      0.4588000      -1.689800    
 H    1.911200       1.464000      -1.676600    
 H    3.607400       1.038700      -1.946400    
 H    4.588500     -0.8983000     -0.5730000    
 H    3.587000      -1.815800      0.5097000    
 H   -1.500000       1.733500     -1.7800000E-02
 H   -1.560600       1.197200       1.669400    
 H   -3.349700      -1.276300      -1.330900    
 H   -2.647000      0.2529000      -1.804200    


%chk=000007188-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007188

0 1
S 1.018385 -1.334792 -2.298788
S -0.165257 -2.570327 -0.395655
S 2.778468 0.541581 -3.555969
S -2.099093 -3.027415 1.668262
N 2.872824 0.238931 -0.814547
N -2.482268 -0.941850 -0.098365
C 3.051014 1.849937 1.630564
C -3.355819 1.859015 -0.180848
C 3.458624 2.415261 0.249379
C 2.005411 0.722110 1.470104
C -2.079642 1.380167 -0.911505
C -3.664625 0.942756 1.026329
C 3.924427 1.290345 -0.701829
C 2.508222 -0.365373 0.493344
C -2.185467 -0.112819 -1.295560
C -3.737136 -0.540235 0.600269
C 2.332850 -0.094370 -2.011081
C -1.733481 -1.981991 0.340264
H 3.948954 1.445110 2.141381
H 2.653793 2.656757 2.274036
H -3.241979 2.907740 0.150573
H -4.211207 1.836096 -0.887278
H 2.601307 2.941982 -0.212566
H 4.277957 3.151306 0.354432
H 1.783820 0.246696 2.443617
H 1.053550 1.138223 1.084129
H -1.905892 1.968875 -1.831340
H -1.193846 1.521044 -0.260703
H -2.878196 1.055369 1.797510
H -4.626981 1.222937 1.494663
H 4.140809 1.674941 -1.711303
H 4.842116 0.808636 -0.307689
H 3.418359 -0.848951 0.903699
H 1.747482 -1.145300 0.343605
H -3.015022 -0.258882 -2.017557
H -1.256116 -0.463103 -1.768068
H -3.879138 -1.206289 1.466334
H -4.580606 -0.698614 -0.102244


