%chk=000130726.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130726

0 1
 S   -1.500900      -3.121500      2.7000001E-03
 O    1.702900     -5.1899999E-02 -0.3715000    
 O    1.205300      -2.028700      0.6978000    
 N    5.869000      0.2733000      0.3070000    
 C   -2.937600     -0.9611000     -2.1600001E-02
 C   -3.183400      0.4529000      2.0000001E-03
 C   -1.610400      -1.400500      4.2700000E-02
 C    3.874900      0.7342000      -1.037100    
 C   -2.097100       1.359700      8.8000000E-02
 C  -0.5333000     -0.4999000      0.1279000    
 C    5.372000      0.4430000      -1.053000    
 C  -0.7924000      0.8706000      0.1496000    
 C    3.094200     -0.3895000     -0.3687000    
 C   -3.834700      -2.087700     -0.1028000    
 C   -4.498600      0.9624000     -5.9799999E-02
 C   0.8466000     -0.9563000      0.1942000    
 C   -2.353600       2.740000      0.1096000    
 C   -3.189300      -3.300900     -9.8099999E-02
 C   -4.729900       2.338100     -3.7099998E-02
 C   -3.660600       3.224300      4.7400001E-02
 C    5.671800       1.497900       1.084600    
 C    7.285000     -9.8399997E-02  0.2961000    
 H    3.631500       1.701400     -0.5833000    
 H    3.525500      0.8280000      -2.074000    
 H    5.896700       1.252600      -1.576400    
 H    5.541900     -0.4750000      -1.630100    
 H   2.7899999E-02   1.582700      0.2311000    
 H    3.408000     -0.5313000      0.6709000    
 H    3.236400      -1.327500     -0.9180000    
 H   -4.913100      -2.010000     -0.1624000    
 H   -5.357200      0.2991000     -0.1264000    
 H   -1.535400       3.454600      0.1750000    
 H   -3.636200      -4.283700     -0.1498000    
 H   -5.746500       2.717400     -8.5299999E-02
 H    4.616600       1.681600       1.307400    
 H    6.092000       2.380200      0.5879000    
 H    6.155800       1.406800       2.064700    
 H    7.433300      -1.033100     -0.2561000    
 H    7.644500     -0.2781000       1.315400    
 H    7.912100      0.6760000     -0.1606000    
 H   -3.843000       4.294800      6.4999998E-02


%chk=000130726-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130726

0 1
S -1.426833 -3.151102 0.297554
O 1.733279 0.187705 -0.395467
O 1.214260 -2.057774 -0.050902
N 6.042719 0.199746 0.318516
C -2.991503 -0.978706 0.132888
C -3.348440 0.413449 -0.022222
C -1.625427 -1.366663 0.077429
C 3.948325 1.090311 -0.786288
C -2.286549 1.375688 -0.230828
C -0.575271 -0.412858 -0.129899
C 5.465259 0.820460 -0.899025
C -0.924086 0.935490 -0.279474
C 3.179143 -0.187265 -0.451112
C -3.879660 -2.103160 0.350316
C -4.699500 0.880598 0.021313
C 0.841728 -0.862038 -0.181337
C -2.618303 2.761926 -0.386511
C -3.217706 -3.307216 0.457688
C -4.993887 2.240022 -0.133853
C -3.946828 3.190637 -0.339597
C 6.033838 1.099079 1.490360
C 7.385438 -0.363248 0.068999
H 3.738517 1.859734 -0.020486
H 3.589909 1.496346 -1.751119
H 5.982807 1.780980 -1.159751
H 5.643640 0.123173 -1.741027
H -0.126094 1.666970 -0.438185
H 3.481606 -0.610149 0.521380
H 3.312157 -0.969935 -1.220608
H -4.965880 -2.017992 0.423595
H -5.513998 0.165711 0.178228
H -1.807278 3.482811 -0.543817
H -3.640830 -4.297517 0.621565
H -6.034471 2.581065 -0.097626
H 5.001984 1.400842 1.739611
H 6.638223 2.029357 1.333178
H 6.446397 0.565835 2.364966
H 7.334022 -1.099711 -0.752687
H 7.742337 -0.886808 0.973872
H 8.148999 0.409374 -0.205050
H -4.191343 4.251335 -0.459687


