%chk=000095072.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095072

0 1
 S    1.510400      -2.226000       0.000000    
 O   -4.657400      0.2512000      2.0999999E-03
 O   -3.449900       2.084500       0.000000    
 N   -3.546100      0.8335000      3.0000001E-04
 C   8.5500002E-02 -7.8500003E-02 -1.1000000E-03
 C    1.471900      0.3509000     -6.9999998E-04
 C  -2.9100001E-02  -1.469600     -3.9999999E-04
 C    2.352800     -0.7319000      1.9999999E-04
 C   -1.112900      0.6824000     -1.2000001E-03
 C    2.030300       1.655900     -3.0000001E-04
 C   -1.284600      -2.110000      1.9999999E-04
 C   -2.360000      5.2299999E-02 -8.9999998E-04
 C    3.750600     -0.5505000      1.0000000E-03
 C   -2.442600      -1.331400     -9.9999997E-05
 C    3.415300       1.840900      1.9999999E-04
 C    4.265700      0.7463000      8.9999998E-04
 H   -1.030000       1.766700     -1.3000000E-03
 H   -1.357800      -3.194100      7.9999998E-04
 H    1.381400       2.528500     -6.9999998E-04
 H    4.424100      -1.403100      1.5000000E-03
 H   -3.397700      -1.851400      5.0000002E-04
 H    3.824700       2.847200      9.9999997E-05
 H    5.341700      0.8969000      1.4000000E-03


%chk=000095072-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095072

0 1
S 1.557398 -2.368301 0.000660
O -4.697767 0.277309 0.000255
O -3.419261 2.166711 -0.000102
N -3.554476 0.880546 -0.000566
C 0.089080 -0.096821 0.000050
C 1.484895 0.342691 0.000107
C -0.043910 -1.523216 0.000305
C 2.403517 -0.749148 0.000420
C -1.078222 0.695916 -0.000235
C 1.998083 1.664055 -0.000100
C -1.304139 -2.157790 0.000294
C -2.329820 0.050380 -0.000270
C 3.797751 -0.557055 0.000525
C -2.463297 -1.362115 0.000012
C 3.391114 1.871390 0.000019
C 4.285901 0.768597 0.000328
H -1.040633 1.788532 -0.000447
H -1.385904 -3.248500 0.000507
H 1.314082 2.519775 -0.000329
H 4.489427 -1.405033 0.000776
H -3.462909 -1.803001 -0.000001
H 3.788648 2.891401 -0.000127
H 5.366744 0.944376 0.000420


