%chk=000064789.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064789

0 1
 S   -1.509300      -1.279900       0.000000    
 O   -1.673600      -1.943200       1.274900    
 O   -1.671900      -1.944500      -1.274300    
 O   -1.872700       2.537600      3.1000001E-03
 N   -2.337600      0.2197000     -1.9000000E-03
 N    3.680400     -0.8739000      1.6000000E-03
 C   3.5399999E-02 -0.4714000      1.9999999E-04
 C  -0.1008000      0.9172000     -1.3000000E-03
 C   -1.502400       1.378600     -5.0000002E-04
 C    1.262600      -1.101000      6.9999998E-04
 C    1.018600       1.730600     -1.6000000E-03
 C    2.395800     -0.2862000      1.9999999E-04
 C    2.275500       1.116300     -8.9999998E-04
 H   -3.361800      0.2770000      8.7000001E-03
 H    1.340600      -2.182700      1.7000000E-03
 H   0.9372000       2.812100     -2.2000000E-03
 H    3.166100       1.741000     -1.1000000E-03
 H    3.775700      -1.880700      1.2000001E-03
 H    4.504700     -0.2880000       0.000000    


%chk=000064789-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064789

0 1
S -1.583380 -1.364970 0.001394
O -1.866169 -2.145164 1.393526
O -1.865388 -2.146666 -1.390004
O -1.897580 2.612833 0.000731
N -2.391235 0.319082 0.000680
N 3.745239 -0.847918 -0.000193
C 0.085691 -0.466789 0.000806
C -0.106216 0.925806 0.000361
C -1.514220 1.410534 0.000434
C 1.315936 -1.112361 0.000586
C 1.050669 1.738627 -0.000196
C 2.482266 -0.278625 -0.000022
C 2.323063 1.145455 -0.000378
H -3.410352 0.409379 0.001887
H 1.400670 -2.203711 0.000890
H 0.929841 2.826679 -0.000537
H 3.216675 1.779725 -0.000838
H 3.868046 -1.857014 -0.000007
H 4.578944 -0.266301 -0.000621


