%chk=000070665.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070665

0 1
 S   -3.657400     -0.3525000     -0.6988000    
 S    2.128100       2.035700      0.2554000    
 O   -4.498100      0.7216000      -1.217100    
 O   -3.536700      -1.578500      -1.480700    
 N    1.431400     -0.9628000     -0.2828000    
 N   -4.194100     -0.7590000      0.8951000    
 C   -2.054700      0.2871000     -0.4362000    
 C   0.3489000     -6.9799997E-02 -0.2516000    
 C   0.5237000       1.303500     -1.9200001E-02
 C  -0.9503000     -0.5641000     -0.4590000    
 C    2.790600     -0.6645000     -9.9100001E-02
 C   -1.875900       1.646100     -0.2051000    
 C  -0.5935000       2.153000      2.3000001E-03
 C    3.238400      0.6423000      0.1503000    
 C    3.733000      -1.704800     -0.1661000    
 C   -3.397200      -1.755600       1.654700    
 C   -4.670000      0.3489000       1.762000    
 C    4.609300      0.8857000      0.3271000    
 C    5.093400      -1.454100      1.1000000E-02
 C    5.531300     -0.1582000      0.2579000    
 H   -1.085900      -1.629400     -0.6346000    
 H    1.205700      -1.935500     -0.4574000    
 H   -2.719300       2.330000     -0.1761000    
 H  -0.4794000       3.219900      0.1825000    
 H    3.408800      -2.725500     -0.3582000    
 H   -3.079000      -2.573800       1.002900    
 H   -4.017500      -2.193700       2.443200    
 H   -2.521200      -1.288800       2.113300    
 H   -5.379900      0.9816000       1.222600    
 H   -5.197400     -6.0500000E-02   2.629500    
 H   -3.830300      0.9541000       2.113900    
 H    4.976900       1.891200      0.5212000    
 H    5.808100      -2.269700     -4.3900002E-02
 H    6.589700      4.1800000E-02  0.3965000    


%chk=000070665-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070665

0 1
S -3.606138 -0.460734 -0.734913
S 2.199523 1.945774 0.916082
O -4.453927 0.712006 -1.474758
O -3.351224 -1.934545 -1.377749
N 1.546466 -1.033862 0.190096
N -4.538941 -0.788393 0.884471
C -1.900179 0.251546 -0.317958
C 0.458190 -0.148036 0.099648
C 0.610299 1.253374 0.320665
C -0.828102 -0.648455 -0.228639
C 2.913601 -0.680681 0.084675
C -1.771903 1.638134 -0.146831
C -0.483361 2.129918 0.169243
C 3.359174 0.647139 0.315538
C 3.866416 -1.669912 -0.268139
C -3.858749 -1.832442 1.683780
C -4.823635 0.479776 1.594154
C 4.719748 0.979760 0.171877
C 5.235229 -1.343561 -0.377504
C 5.667403 -0.015739 -0.165384
H -0.988466 -1.710659 -0.449060
H 1.331554 -2.024332 0.065798
H -2.625798 2.306704 -0.287130
H -0.332460 3.205534 0.307949
H 3.528559 -2.696057 -0.459646
H -3.603429 -2.676299 1.021638
H -4.585642 -2.195542 2.432990
H -2.947978 -1.476009 2.216737
H -5.204649 1.215433 0.866454
H -5.628454 0.273103 2.322810
H -3.949216 0.901732 2.139514
H 5.043207 2.013140 0.337543
H 5.957050 -2.124059 -0.639555
H 6.725334 0.247945 -0.258899


