%chk=000006790.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006790

0 1
 S   -2.570700     -6.7500003E-02 -8.0100000E-02
 O   -2.827600     -0.7139000       1.396200    
 O   -3.419700       1.105300     -0.1911000    
 O   -2.630800      -1.133100      -1.063600    
 N    2.975300       2.108000      3.7099998E-02
 C   0.1909000     -0.3941000     -2.3700001E-02
 C    1.503600      0.1341000      4.1000000E-03
 C  -0.9031000      0.4863000     -4.4799998E-02
 C    1.683600       1.527000      9.7000003E-03
 C  -0.7059000       1.867600     -3.8400002E-02
 C   1.1200000E-02  -1.786900     -2.9600000E-02
 C   0.5851000       2.386900     -1.1500000E-02
 C    2.597700     -0.7460000      2.5000000E-02
 C    1.109700      -2.646600     -8.2999999E-03
 C    2.400600      -2.127200      1.9099999E-02
 H   -1.531100       2.572900     -5.0799999E-02
 H  -0.9572000      -2.270400     -5.0000002E-04
 H   0.7223000       3.465500     -6.2000002E-03
 H    3.627000     -0.4016000      4.7200002E-02
 H   0.9579000      -3.722100     -1.6000000E-03
 H    3.255000      -2.797700      3.8300000E-02
 H    3.061000       3.116500      3.9799999E-02
 H    3.816400       1.552200      5.2200001E-02
 H   -2.734600     -8.9699998E-02   2.153900    


%chk=000006790-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006790

0 1
S -2.624588 0.048802 -0.031076
O -2.694231 -0.525278 1.747701
O -3.561720 1.359358 -0.200437
O -2.931647 -1.256573 -0.945559
N 3.066344 2.125720 -0.025484
C 0.229310 -0.378979 -0.013059
C 1.581155 0.152293 -0.011087
C -0.843758 0.572459 -0.032908
C 1.787435 1.593989 -0.024765
C -0.642679 1.952620 -0.033783
C 0.041465 -1.800469 0.002989
C 0.672968 2.462348 -0.038772
C 2.676323 -0.769047 0.010552
C 1.136991 -2.665265 0.024548
C 2.466522 -2.149806 0.028559
H -1.504417 2.627575 -0.041087
H -0.973884 -2.204851 -0.016615
H 0.829033 3.546385 -0.048440
H 3.710392 -0.405550 0.014572
H 0.974145 -3.747999 0.036262
H 3.319872 -2.835579 0.045083
H 3.198040 3.133620 -0.032990
H 3.895256 1.540999 -0.018756
H -3.591728 -0.951273 1.876952


