%chk=000051749.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051749

0 1
 S   -1.385600      -2.164600       1.213300    
 S   0.3478000       1.899600       1.131500    
 N    2.925800       2.269600       1.435300    
 N    2.001100       3.146500     -0.5533000    
 C  -7.1900003E-02  0.7396000     -0.2296000    
 C   0.9636000     -0.3561000     -0.3990000    
 C   -1.549000      0.3586000     -0.2147000    
 C    1.138800      -1.394800      0.5316000    
 C   0.2308000      -1.539300       1.714700    
 C   -2.149500     -0.7797000      0.3634000    
 C    1.816700     -0.3095000      -1.520300    
 C   -2.404500       1.302700     -0.8464000    
 C    2.148100      -2.353200      0.3237000    
 C   -3.554300     -0.9327000      0.2669000    
 C    2.814600      -1.264500      -1.714400    
 C    2.981600      -2.286800     -0.7901000    
 C   -3.785500       1.134500     -0.9228000    
 C   -4.362600      1.0100000E-02 -0.3645000    
 C    1.894200       2.519900      0.5747000    
 H   3.4400001E-02   1.359600      -1.130500    
 H   0.6512000      -2.267500       2.418400    
 H   0.1330000     -0.6179000       2.291500    
 H    1.713600      0.4827000      -2.258800    
 H   -1.985400       2.203300      -1.294400    
 H    2.285100      -3.167800       1.031200    
 H   -4.049400      -1.805200      0.6935000    
 H    3.459900      -1.206500      -2.585900    
 H    3.755500      -3.034200     -0.9365000    
 H   -4.400200       1.880800      -1.416300    
 H   -5.436700     -0.1390000     -0.4162000    
 H    3.871600       2.572500       1.229900    
 H    2.776100       1.766400       2.303100    
 H    2.980600       3.419700     -0.6881000    


%chk=000051749-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000051749

0 1
S -1.501880 -2.284343 1.260323
S 0.829961 1.384175 1.504564
N 2.289173 3.636493 1.639745
N 1.476245 3.062962 -0.580694
C 0.242337 0.452408 -0.116623
C 1.127752 -0.745450 -0.398228
C -1.274213 0.312762 -0.113539
C 1.178642 -1.899501 0.436605
C 0.324109 -1.968314 1.671824
C -2.065329 -0.754898 0.404656
C 1.945443 -0.700496 -1.555726
C -1.964441 1.398222 -0.733107
C 2.032612 -2.973898 0.092216
C -3.481162 -0.720037 0.267035
C 2.794437 -1.777511 -1.894083
C 2.838876 -2.921324 -1.066323
C -3.363586 1.434910 -0.863568
C -4.130291 0.356334 -0.363136
C 1.617082 2.863864 0.700873
H 0.501879 1.247576 -0.842958
H 0.585875 -2.829076 2.308624
H 0.373308 -1.053168 2.283728
H 1.915847 0.192847 -2.189833
H -1.360883 2.230720 -1.114695
H 2.062540 -3.860563 0.736967
H -4.073878 -1.548200 0.673034
H 3.416018 -1.722561 -2.794625
H 3.495221 -3.761789 -1.317883
H -3.849604 2.286875 -1.350515
H -5.222122 0.355278 -0.453068
H 2.704436 4.526973 1.372447
H 2.370634 3.331688 2.608408
H 1.954460 3.893843 -0.971543


