%chk=000008776.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008776

0 1
 S   -1.448700      -1.257700     -9.9999997E-05
 O    2.543400       1.111800      1.9999999E-04
 O   -4.658500      0.9103000     -1.1000000E-03
 O   -4.362600      -1.269200     -3.0000001E-04
 N    3.402300      -1.031800     -3.9999999E-04
 N    1.125700     -0.7655000      1.0000000E-03
 N  -0.3958000       1.103300      6.0000003E-04
 N   -3.892900     -9.5600002E-02 -1.9999999E-04
 C    4.794800     -0.6481000     -1.1000000E-03
 C  -0.1370000     -0.1690000      1.0000000E-03
 C    2.355500     -0.1022000      6.0000003E-04
 C    4.948000      0.8634000     -5.0000002E-04
 C   -2.506000      9.2500001E-02  3.9999999E-04
 C   -1.768300       1.257800     -9.9999997E-05
 H    5.261200      -1.088500      0.8854000    
 H    5.260100      -1.087800     -0.8885000    
 H    3.177400      -2.021700     -3.9999999E-04
 H    1.125300      -1.781500      1.0000000E-03
 H    4.566400       1.336500     -0.9113000    
 H    4.566900       1.335800      0.9109000    
 H    6.023300       1.086300     -6.9999998E-04
 H   -2.178000       2.259700     -5.0000002E-04


%chk=000008776-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008776

0 1
S -1.621534 -1.451709 0.001865
O 2.397625 1.195945 -0.000600
O -4.758078 1.049812 -0.001606
O -4.607580 -1.246949 0.000625
N 3.420595 -0.937056 -0.000292
N 1.089934 -0.792472 0.001253
N -0.517447 1.032747 -0.000542
N -4.082608 -0.057655 -0.000042
C 4.872627 -0.609337 -0.001843
C -0.179204 -0.253372 0.000659
C 2.350190 -0.051754 0.000668
C 5.241104 0.884608 0.000342
C -2.653302 0.036455 0.000149
C -1.890095 1.200791 -0.000743
H 5.323544 -1.091662 0.888968
H 5.321231 -1.088603 -0.895478
H 3.222906 -1.940154 -0.000653
H 1.136734 -1.813959 0.002268
H 4.852680 1.408091 -0.886287
H 4.854720 1.404943 0.889738
H 6.344780 0.955738 -0.000764
H -2.316322 2.204353 -0.001785


