%chk=000050287.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050287

0 1
 S   0.3984000       1.405500     -0.1265000    
 S   -4.455000       1.452200      -1.002500    
 N    3.367700      0.3862000      0.2691000    
 N   -2.845200      0.5634000      0.8145000    
 N    4.584500      -1.670300     -3.0800000E-02
 N    5.503900      0.4380000     -0.7063000    
 N   -4.839600     -0.6900000      0.4867000    
 N   -5.410400      -2.968000     -8.9500003E-02
 N   -3.683700      -1.905600      -1.134300    
 N    2.649400      -2.882600      0.9936000    
 C    1.771800       2.175900      0.7846000    
 C    3.131000       1.810400      0.2013000    
 C  -0.9695000       2.146400      0.7925000    
 C   -2.291900       1.694100      0.2658000    
 C   -3.001100       2.318700     -0.7250000    
 C    4.524600     -0.2319000     -0.1799000    
 C   -3.995300      0.3380000      0.2191000    
 C    6.695000     -0.2614000      -1.161200    
 C   -4.678800      -1.802800     -0.1902000    
 C    3.544100      -2.316000      0.5192000    
 H    1.715900       1.856100       1.830900    
 H    1.649100       3.263400      0.7513000    
 H    3.909000       2.333300      0.7696000    
 H    3.200000       2.152900     -0.8383000    
 H  -0.8986000       3.237900      0.7282000    
 H  -0.8840000       1.868500       1.848700    
 H    2.617500     -0.1698000      0.6674000    
 H   -2.755400       3.209100      -1.286100    
 H    5.412100      -2.163900     -0.3463000    
 H    7.201300     -0.7735000     -0.3365000    
 H    7.400100      0.4688000      -1.570600    
 H    6.464100     -0.9725000      -1.961000    
 H   -6.180800      -3.046800      0.5654000    
 H   -5.201200      -3.776700     -0.6645000    
 H   -3.558500      -2.765300      -1.658500    
 H   -3.040300      -1.153900      -1.354100    


%chk=000050287-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000050287

0 1
S 0.291127 2.485937 -0.561016
S -4.869990 1.640016 -0.593433
N 2.671014 0.406102 -0.189855
N -2.468035 0.752084 0.191291
N 3.269446 -1.874299 -0.578263
N 4.954978 -0.131623 -0.415437
N -4.055050 -1.014326 -0.398318
N -3.606248 -3.290691 -0.517359
N -1.842729 -1.818443 0.078233
N 0.930639 -2.752551 -0.109679
C 1.764699 2.556300 0.642360
C 2.972918 1.828792 0.037501
C -1.146603 2.812274 0.674705
C -2.409730 2.149279 0.220823
C -3.569797 2.805741 -0.158191
C 3.699663 -0.488815 -0.400730
C -3.663298 0.273648 -0.219229
C 6.031740 -1.128889 -0.511943
C -3.145896 -2.013480 -0.268016
C 2.039866 -2.354742 -0.329415
H 1.451479 2.071983 1.584087
H 2.022424 3.610692 0.834860
H 3.835631 1.889010 0.725028
H 3.291728 2.317826 -0.906059
H -1.273982 3.901335 0.767159
H -0.809980 2.389341 1.637459
H 1.708097 0.187723 -0.469741
H -3.752444 3.876994 -0.207286
H 3.989039 -2.519861 -0.909449
H 5.893745 -2.018773 0.145421
H 6.978815 -0.650943 -0.211770
H 6.174362 -1.488911 -1.554650
H -4.579621 -3.384642 -0.794962
H -3.024954 -4.112393 -0.382774
H -1.101852 -2.525543 0.037130
H -1.600999 -0.818351 0.257317


