%chk=000107457.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107457

0 1
 S    1.124600     -0.1597000       1.414700    
 S    3.726000      -1.143200       2.561300    
 O    2.362400      8.8399999E-02  -2.186300    
 O   -2.753900       2.515700      0.7170000    
 N    3.193700     -0.5319000     -7.6600000E-02
 N   -1.348600      0.8851000     -0.2910000    
 C    4.546500     -0.8706000     -0.5107000    
 C   0.9634000      0.1774000     -0.2592000    
 C    2.231000     -8.2400002E-02 -0.9815000    
 C  -0.1446000      0.6177000     -0.8574000    
 C    2.811200     -0.6437000       1.255000    
 C   -2.374700     -0.1565000     -0.1842000    
 C    5.466700      0.3308000     -0.4471000    
 C   -1.685300       2.189200      0.1908000    
 C   -2.387400      -1.123900      -1.141200    
 C   -3.238900     -8.0100000E-02  0.8645000    
 C   -3.363300      -2.115400      -1.039600    
 C   -4.214800      -1.071600      0.9661000    
 C  -0.6369000       3.264100     -8.6000003E-03
 C   -4.276900      -2.089200      1.4000000E-02
 H    4.953200      -1.694600      8.2800001E-02
 H    4.495700      -1.219100      -1.548900    
 H  -0.1297000      0.8239000      -1.925500    
 H    5.094400       1.144700      -1.078300    
 H    5.555900      0.7187000      0.5722000    
 H    6.468300      6.1700001E-02 -0.7969000    
 H   -1.697800      -1.159200      -1.977300    
 H   -3.173900      0.6182000       1.688400    
 H   -3.413300      -2.906900      -1.781700    
 H   -4.911200      -1.066200       1.799600    
 H   -1.037500       4.229100      0.3169000    
 H  -0.3690000       3.346200      -1.065400    
 H   0.2499000       3.043100      0.5905000    
 H   -5.033500      -2.864100      9.6000001E-02


%chk=000107457-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107457

0 1
S 0.621340 -1.535785 0.002905
S 3.099233 -3.383007 0.195244
O 2.849515 1.601819 -0.953936
O -3.429234 2.366396 -0.715523
N 3.102395 -0.693979 -0.442062
N -1.393565 1.244245 -0.521592
C 4.580721 -0.632979 -0.569240
C 0.889866 0.213564 -0.445901
C 2.329880 0.491324 -0.643889
C -0.006658 1.236778 -0.635709
C 2.432789 -1.862686 -0.097329
C -2.118772 0.067594 -0.042351
C 5.261543 -0.339841 0.781403
C -2.180644 2.406668 -0.846949
C -2.766389 -0.778225 -0.968488
C -2.177850 -0.189870 1.344666
C -3.473472 -1.905290 -0.497385
C -2.885496 -1.320638 1.808354
C -1.442633 3.642620 -1.342625
C -3.531744 -2.178865 0.889289
H 4.912681 -1.604436 -0.973323
H 4.795252 0.168395 -1.296461
H 0.456223 2.186424 -0.923893
H 4.930766 0.632137 1.185600
H 5.036859 -1.132945 1.514698
H 6.356520 -0.299474 0.641205
H -2.719817 -0.552121 -2.038502
H -1.679193 0.486387 2.046676
H -3.976377 -2.567333 -1.209950
H -2.930804 -1.529550 2.882214
H -2.200129 4.408854 -1.561150
H -0.864358 3.441925 -2.262335
H -0.747100 4.043042 -0.582606
H -4.079648 -3.055444 1.251343


