%chk=000073119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073119

0 1
 S    3.214500     -4.2900000E-02  1.0000000E-03
 O   -2.585600       1.352100     -4.8000002E-03
 O  -0.2812000      -2.725000     -4.1999999E-03
 N  -0.2661000       1.423300     -9.9999997E-05
 N   -1.449900     -0.6851000      3.0000000E-03
 N    2.153900       1.250200      1.4000000E-03
 N    2.128000      -1.314700     -8.9999998E-04
 C   0.9328000      0.7000000      7.9999998E-04
 C   0.9278000     -0.7272000     -3.0000001E-04
 C   -1.506300      0.7477000     -1.5000000E-03
 C  -0.2917000      -1.497500     -8.9999998E-04
 C  -0.2339000       2.884400      5.0000002E-04
 C   -2.742100      -1.365200      6.0000001E-03
 H   -1.240300       3.310800      8.9999998E-04
 H   0.2916000       3.230000     -0.8951000    
 H   0.2917000       3.229300      0.8964000    
 H   -3.297500      -1.068000     -0.8894000    
 H   -3.308400      -1.042600      0.8856000    
 H   -2.642200      -2.453000      2.2299999E-02


%chk=000073119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073119

0 1
S 3.367202 0.006989 -0.000187
O -2.590219 1.358441 0.001095
O -0.383447 -2.780410 0.000565
N -0.251033 1.407838 0.000755
N -1.461623 -0.689812 0.002411
N 2.149210 1.330050 -0.000103
N 2.178425 -1.328351 0.000442
C 0.947644 0.710301 0.000465
C 0.962828 -0.750991 0.000662
C -1.496901 0.733291 0.001664
C -0.301264 -1.526958 0.000900
C -0.228498 2.887858 -0.000200
C -2.791335 -1.353259 0.003375
H -1.269759 3.238428 0.000610
H 0.300294 3.252526 -0.896467
H 0.302137 3.253556 0.894542
H -3.356259 -1.063045 -0.896760
H -3.364527 -1.041572 0.890776
H -2.617774 -2.438281 0.016156


