%chk=000150241.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150241

0 1
 S    3.310300     -0.2112000     -0.2699000    
 O    3.507700      -1.473700      0.4204000    
 O    4.406300      0.7271000     -0.4365000    
 O  -0.9070000      -3.249600      0.4420000    
 N    1.975900      0.5928000      0.3957000    
 N   -3.109500      -1.391400     -0.3810000    
 C  -0.3988000      0.8724000      0.4816000    
 C   0.2030000       2.179600      7.4800000E-02
 C  -0.4247000       2.041200       1.434700    
 C    1.697300       2.003200     -7.4500002E-02
 C   0.7141000     -9.6000001E-02  0.5074000    
 C   -1.715100      0.2663000      1.5900001E-02
 C   -1.826300      -1.108300      9.8000001E-03
 C   0.6158000      -1.434500      0.5052000    
 C   -2.924400      0.8407000     -0.3956000    
 C  -0.7598000      -2.035300      0.3399000    
 C   -3.778600     -0.2159000     -0.6409000    
 C   -3.253200       2.270400     -0.5436000    
 C    2.667000     -0.5777000      -1.885400    
 H  -0.2586000       2.808300     -0.6680000    
 H   0.2207000       2.015300       2.306100    
 H   -1.350900       2.571100       1.614500    
 H    1.983300       2.141600      -1.120300    
 H    2.243200       2.713600      0.5536000    
 H    1.410500      -2.159500      0.5435000    
 H   -3.500300      -2.317800     -0.4843000    
 H   -4.806900     -0.2427000     -0.9742000    
 H   -2.511900       2.785600      -1.160300    
 H   -4.225800       2.402800      -1.030500    
 H   -3.307400       2.763200      0.4313000    
 H    2.371500      0.3422000      -2.390300    
 H    3.478500      -1.040500      -2.454400    
 H    1.838800      -1.282300      -1.836000    


%chk=000150241-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000150241

0 1
S 3.232025 0.232697 0.219779
O 2.778905 -0.435639 1.640823
O 4.070931 1.637710 0.202816
O -1.439233 -3.289094 -0.802189
N 1.644505 0.501487 -1.132778
N -3.518878 -1.288574 -0.152910
C -0.552435 0.828201 -0.156020
C 0.064455 2.235244 -0.421996
C 0.035700 1.722336 1.001427
C 1.369405 1.986363 -1.190306
C 0.449625 -0.142529 -0.706715
C -1.944023 0.346264 -0.119641
C -2.161252 -1.040812 -0.310804
C 0.188298 -1.485460 -0.896464
C -3.218834 0.952309 0.161720
C -1.159453 -2.045233 -0.652541
C -4.166288 -0.092833 0.129041
C -3.524449 2.406805 0.423847
C 4.216051 -1.063270 -0.759962
H -0.566455 3.075843 -0.718324
H 0.953875 1.382497 1.492491
H -0.717185 2.131630 1.679310
H 1.257299 2.243619 -2.259872
H 2.238660 2.543907 -0.789393
H 0.939520 -2.161447 -1.318492
H -3.928871 -2.217524 -0.249671
H -5.242669 -0.046077 0.283016
H -3.232573 3.046430 -0.430409
H -4.604030 2.560219 0.594213
H -2.995472 2.789065 1.317362
H 4.357036 -0.638763 -1.761874
H 5.159884 -1.201682 -0.214515
H 3.600627 -1.972684 -0.770268


