%chk=000148713.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148713

0 1
 S    1.938800      -1.897600     -0.7408000    
 O   -3.887100       1.828500     -0.8468000    
 N   -3.625400     -0.1124000      0.4658000    
 C   -2.324400     -0.5299000      0.1837000    
 C   0.2772000      -1.364400     -0.3804000    
 C   -1.536600      0.1978000     -0.7081000    
 C   -1.811600      -1.674900      0.7935000    
 C  -0.2359000     -0.2195000     -0.9902000    
 C  -0.5107000      -2.092200      0.5115000    
 C    2.884700     -0.4783000     -0.2078000    
 C    2.816900     -5.8899999E-02   1.118400    
 C    3.686100      0.2028000      -1.120600    
 C    3.555300       1.049000       1.534600    
 C    4.424500       1.310600     -0.7044000    
 C   -4.306500       1.001000     -4.4199999E-02
 C    4.359100       1.733600      0.6233000    
 C   -5.704300       1.104700      0.5125000    
 H   -1.864000       1.092200      -1.219300    
 H   -2.414300      -2.251400       1.490700    
 H   0.3582000      0.3593000      -1.693300    
 H  -0.1278000      -2.986500      0.9969000    
 H   -4.135100     -0.6959000       1.126000    
 H    2.202500     -0.5808000       1.847600    
 H    3.748600     -0.1123000      -2.159100    
 H    3.505600       1.377800       2.568500    
 H    5.050300       1.844100      -1.413900    
 H    4.934200       2.596000      0.9473000    
 H   -6.282900      0.2227000      0.2240000    
 H   -6.195700       1.997700      0.1167000    
 H   -5.665200       1.175800       1.603200    


%chk=000148713-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148713

0 1
S 1.925362 -1.741946 -0.923354
O -4.119746 1.919932 -0.493504
N -3.800925 -0.190401 0.489454
C -2.450670 -0.482465 0.147202
C 0.228114 -1.197107 -0.460599
C -1.635900 0.395826 -0.620603
C -1.910693 -1.715115 0.603863
C -0.311340 0.024618 -0.926848
C -0.578365 -2.066678 0.309475
C 2.984304 -0.358568 -0.305548
C 2.626793 0.440727 0.805004
C 4.222670 -0.156450 -0.962029
C 3.510080 1.449879 1.250816
C 5.105640 0.845100 -0.498640
C -4.561549 0.942985 0.177098
C 4.752494 1.654576 0.606095
C -5.989893 0.890205 0.721540
H -2.051441 1.341168 -0.972951
H -2.528401 -2.399460 1.199936
H 0.308063 0.694998 -1.531622
H -0.164232 -3.009475 0.680482
H -4.276967 -0.911072 1.037972
H 1.670506 0.281823 1.313773
H 4.489963 -0.768864 -1.830329
H 3.226898 2.070297 2.108626
H 6.062808 0.997017 -1.009971
H 5.434890 2.435745 0.958135
H -6.559580 0.057006 0.269389
H -6.493363 1.835148 0.472905
H -6.001022 0.759151 1.819533


