%chk=000162440.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162440

0 1
 S  -0.1275000      7.5199999E-02   1.723800    
 O   0.6214000       2.575900      -1.377700    
 O   -1.851200       2.885500     -0.5882000    
 O    6.174700     -0.3487000      5.7200000E-02
 N   -2.297700      0.6042000     -0.5423000    
 N   -5.931300      0.4931000      0.2794000    
 C   0.7518000       1.208300      0.5819000    
 C   4.3499999E-02   1.422900     -0.7616000    
 C   -1.447000       1.719200     -0.5924000    
 C   -1.848200     -0.7466000     -0.3587000    
 C   -3.731200      0.8146000     -0.7439000    
 C    2.208200      0.7900000      0.4404000    
 C  -0.8342000      -1.088600      0.5611000    
 C   -4.501600      0.2670000      0.4507000    
 C   -2.464500      -1.779800      -1.089400    
 C  -0.4431000      -2.431000      0.7023000    
 C    3.214100       1.607800      0.9464000    
 C    2.525200     -0.4080000     -0.1930000    
 C   -2.057900      -3.107500     -0.9484000    
 C   -1.042900      -3.432300     -5.7900000E-02
 C    4.549000       1.224400      0.8177000    
 C    3.860100     -0.7914000     -0.3219000    
 C    4.872000      2.4800001E-02  0.1833000    
 C   -6.676100      8.2999999E-03   1.433100    
 C    6.434200      -1.587200     -0.6020000    
 H   0.7410000       2.171800       1.109700    
 H   0.1886000      0.5928000      -1.460900    
 H   -3.943100       1.885200     -0.8491000    
 H   -4.043300      0.3602000      -1.690400    
 H   -4.328400     -0.8047000      0.5914000    
 H   -4.152100      0.7725000       1.360400    
 H   -3.245900      -1.578700      -1.816500    
 H   0.3249000      -2.715800       1.418900    
 H    2.979000       2.545200       1.442600    
 H    1.761800      -1.051300     -0.6164000    
 H   0.2437000       2.648700      -2.271000    
 H   -2.534600      -3.885900      -1.537000    
 H  -0.7292000      -4.465300      5.8100000E-02
 H   -6.255700      1.3000000E-02 -0.5596000    
 H    5.333000       1.864300       1.213100    
 H    4.040700      -1.732700     -0.8299000    
 H   -6.543700      -1.069400       1.574000    
 H   -7.743400      0.1987000       1.283300    
 H   -6.375000      0.5293000       2.347800    
 H    6.105500      -1.563600      -1.646500    
 H    6.008300      -2.433000     -5.1800001E-02
 H    7.520200      -1.726800     -0.6119000    


%chk=000162440-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162440

0 1
S -0.391101 -0.463295 1.530243
O 0.447947 2.278046 -1.505829
O -2.086092 2.439182 -0.675926
O 6.258473 -0.002609 0.393576
N -2.437258 0.137320 -0.810261
N -5.897287 0.644159 0.663349
C 0.577133 0.900093 0.518740
C -0.087706 1.078820 -0.873835
C -1.619477 1.254083 -0.751469
C -1.919909 -1.204466 -0.770642
C -3.911281 0.360860 -0.765032
C 2.058814 0.620537 0.464016
C -0.952845 -1.598378 0.201097
C -4.425953 0.551676 0.681223
C -2.395940 -2.161640 -1.703350
C -0.486791 -2.935847 0.219586
C 2.966739 1.460545 1.161114
C 2.587626 -0.465404 -0.276399
C -1.939289 -3.494769 -1.663692
C -0.983395 -3.887296 -0.697467
C 4.353113 1.230571 1.120706
C 3.974624 -0.713884 -0.328996
C 4.862962 0.140748 0.373155
C -6.507691 1.248568 1.862864
C 6.838097 -1.104722 -0.377484
H 0.370498 1.808504 1.111687
H 0.164609 0.228389 -1.529160
H -4.150346 1.263993 -1.348818
H -4.408035 -0.507963 -1.230769
H -4.031252 -0.266915 1.331169
H -4.022096 1.502339 1.072130
H -3.110972 -1.849100 -2.471938
H 0.259507 -3.218955 0.968704
H 2.581659 2.312534 1.733816
H 1.911568 -1.138606 -0.817140
H -0.202412 3.008613 -1.287942
H -2.316644 -4.219245 -2.393189
H -0.621176 -4.920054 -0.663458
H -6.336292 -0.252125 0.415402
H 5.057121 1.879376 1.650196
H 4.348620 -1.560826 -0.912079
H -6.273709 0.720891 2.819155
H -7.605690 1.275058 1.745060
H -6.158472 2.292313 1.963652
H 6.603906 -1.008751 -1.455613
H 6.484031 -2.086477 -0.006522
H 7.924167 -1.021290 -0.225432


