%chk=000005778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005778

0 1
 S    2.255600      -1.404000       0.000000    
 N   -1.052800      -1.661200       0.000000    
 N   -2.577000     -3.4800000E-02   0.000000    
 N   -1.008900       1.822900     -9.9999997E-05
 N    1.332600       1.137900      9.9999997E-05
 C  -0.3471000     -0.4918000      9.9999997E-05
 C   -1.315400      0.5033000      9.9999997E-05
 C   0.9962000     -0.1715000       0.000000    
 C   -2.383700      -1.336400       0.000000    
 C   0.3237000       2.041600       0.000000    
 C    3.776800     -0.4060000     -9.9999997E-05
 H  -0.6669000      -2.596100     -9.9999997E-05
 H   -3.155400      -2.093000     -9.9999997E-05
 H   0.6290000       3.082500     -9.9999997E-05
 H    4.641000      -1.075700     -9.9999997E-05
 H    3.823700      0.2214000      0.8942000    
 H    3.823600      0.2213000     -0.8944000    


%chk=000005778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005778

0 1
S 2.305178 -1.452233 -0.000041
N -1.083984 -1.716225 -0.000007
N -2.637704 -0.028065 0.000015
N -1.007479 1.852559 -0.000003
N 1.346012 1.144167 -0.000046
C -0.355197 -0.524608 -0.000017
C -1.340792 0.524989 -0.000010
C 1.013502 -0.171043 -0.000041
C -2.438593 -1.355869 -0.000019
C 0.331502 2.078855 -0.000031
C 3.847454 -0.378121 -0.000069
H -0.706035 -2.663320 0.000002
H -3.234534 -2.098132 -0.000015
H 0.653845 3.123964 0.000006
H 4.692727 -1.083668 -0.000075
H 3.854560 0.253583 0.898628
H 3.854538 0.253568 -0.898777


