%chk=000106170.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106170

0 1
 S    8.060500      0.7828000      0.4619000    
 O    8.635000       1.501500     -0.8896000    
 O    8.009400       1.805000       1.497100    
 O    8.807500     -0.4478000      0.6711000    
 O  -0.7972000       1.518400     -0.1129000    
 O   -3.319100      -2.402800      0.5084000    
 N    2.476200     -0.7800000     -0.8523000    
 N   -4.316000     -0.3660000      0.7254000    
 N    1.451700      6.4000003E-02 -0.6222000    
 N   -3.211400      0.3577000      0.4605000    
 C    6.420900      0.3238000      7.5599998E-02
 C    3.794700     -0.4111000     -0.5424000    
 C    6.159400     -0.9288000     -0.4798000    
 C    5.372300       1.209700      0.3228000    
 C    4.849300      -1.295300     -0.7883000    
 C    4.062200      0.8431000      1.4500000E-02
 C   -5.590400      0.1239000      0.3997000    
 C   0.3419000     -0.5373000     -0.3594000    
 C   -8.129200       1.099700     -0.2509000    
 C   -2.169900     -0.3661000      0.2234000    
 C  -0.8699000      0.3037000     -8.5199997E-02
 C   -6.730300     -0.6354000      0.6816000    
 C   -5.729200       1.374700     -0.2099000    
 C   -7.996600     -0.1486000      0.3570000    
 C   -6.995500       1.861400     -0.5344000    
 C   0.1607000      -2.008200     -0.3042000    
 C   -2.256300      -1.860200      0.2572000    
 C   -1.007300      -2.601600     -2.7000001E-02
 C   -9.483100       1.619900     -0.5976000    
 H    6.960300      -1.632400     -0.6883000    
 H    5.553400       2.192800      0.7481000    
 H    4.659800      -2.274100      -1.222000    
 H    3.270500       1.559000      0.2193000    
 H    2.351900      -1.620900      -1.403500    
 H   -6.641300      -1.610500       1.154000    
 H   -4.868500       1.994800     -0.4461000    
 H   -8.872200     -0.7523000      0.5810000    
 H   -7.086200       2.834700      -1.009500    
 H    1.003700      -2.668700     -0.4695000    
 H   -4.276200      -1.189200       1.314700    
 H   -1.072300      -3.684600      7.0000002E-03
 H   -10.23970       1.250600      0.1031000    
 H   -9.510200       2.714000     -0.5504000    
 H   -9.758700       1.305600      -1.609100    
 H    8.158500       2.318300      -1.169200    


%chk=000106170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106170

0 1
S 7.883615 1.720308 -0.038826
O 8.075573 1.821366 -1.887117
O 7.669174 3.218980 0.532224
O 9.058687 0.773091 0.546244
O -0.794890 0.855029 -0.099221
O -3.489126 -3.175005 -0.046571
N 2.656767 -1.313380 -0.058283
N -4.533337 -0.811571 -0.040560
N 1.478442 -0.655411 -0.070909
N -3.312924 -0.274619 -0.054418
C 6.269224 0.794912 -0.059560
C 3.866936 -0.584168 -0.059477
C 6.313707 -0.609089 -0.035505
C 5.073557 1.536047 -0.084370
C 5.091076 -1.304861 -0.032081
C 3.854127 0.837211 -0.080221
C -5.681026 0.019243 -0.025545
C 0.309898 -1.313082 -0.071735
C -8.036509 1.612581 0.007763
C -2.230914 -1.103512 -0.063074
C -0.908030 -0.404987 -0.079945
C -6.954514 -0.601585 -0.009243
C -5.572545 1.434319 -0.025313
C -8.116902 0.196571 0.007478
C -6.743809 2.209798 -0.008593
C 0.143125 -2.759754 -0.065605
C -2.334972 -2.568663 -0.055916
C -1.096532 -3.354147 -0.059355
C -9.285642 2.473691 0.021836
H 7.271511 -1.136918 -0.003897
H 5.097968 2.630022 -0.090368
H 5.091408 -2.401054 -0.010677
H 2.894473 1.358868 -0.095786
H 2.722523 -2.341994 -0.045667
H -7.033775 -1.695298 -0.008780
H -4.578845 1.890284 -0.037493
H -9.099644 -0.288285 0.020868
H -6.659692 3.303226 -0.007704
H 1.022862 -3.418488 -0.068356
H -4.594764 -1.866310 -0.038972
H -1.216486 -4.442463 -0.056421
H -10.201384 1.861311 0.079290
H -9.286041 3.165955 0.884533
H -9.352927 3.096162 -0.890581
H 8.903674 2.352868 -2.074392


