%chk=000154700.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154700

0 1
 S   3.4800000E-02  6.4099997E-02   1.332900    
 O  -0.8664000     -9.7199999E-02 -2.1800000E-02
 O   0.2473000      -1.248100       1.920800    
 O  -0.5208000       1.159900       2.111400    
 O   -3.804400       2.310400      -1.508500    
 O   -1.677000       1.982700      -1.077900    
 N    2.020900      -1.537700     -0.2088000    
 N   -2.871400       1.601800      -1.062100    
 C    1.604000      0.5927000      0.7499000    
 C    2.425600     -0.2774000      3.8500000E-02
 C    3.675200      0.2036000     -0.4052000    
 C    1.991800       1.906500       1.024300    
 C    4.065400       1.525100     -0.1295000    
 C    3.223900       2.373600      0.5842000    
 C   -2.179900     -0.4993000     -1.2200000E-02
 C    4.502600     -0.6718000      -1.121500    
 C   -3.178200      0.3237000     -0.5193000    
 C    4.088400      -1.970900      -1.377800    
 C   -2.488500      -1.747400      0.5160000    
 C    2.849200      -2.350700     -0.9035000    
 C   -4.504700     -0.1072000     -0.4978000    
 C   -3.815000      -2.178300      0.5373000    
 C   -4.823100      -1.358200      3.0600000E-02
 H    1.355900       2.592600       1.575200    
 H    5.027900       1.900900     -0.4698000    
 H    3.529000       3.394200      0.7943000    
 H    5.474900     -0.3457000      -1.483800    
 H    4.715300      -2.660900      -1.930100    
 H   -1.719700      -2.414500      0.8911000    
 H    2.472200      -3.353800      -1.073400    
 H   -5.318000      0.5024000     -0.8834000    
 H   -4.062400      -3.155000      0.9427000    
 H   -5.855500      -1.694900      4.6300001E-02


%chk=000154700-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154700

0 1
S 0.135689 -0.502596 1.623770
O -0.885802 -1.305439 0.020829
O 0.610276 -1.739412 2.547640
O -0.852437 0.607509 2.283190
O -2.607499 1.963141 -2.012211
O -0.810895 1.361516 -0.750250
N 2.393944 -1.687113 -0.092204
N -2.033553 1.206504 -1.131586
C 1.573328 0.417005 0.816074
C 2.542002 -0.324513 0.081270
C 3.649361 0.430964 -0.475989
C 1.612501 1.793111 0.992498
C 3.711656 1.847516 -0.276223
C 2.715230 2.515008 0.439139
C -2.230791 -1.043202 0.047592
C 4.626471 -0.304577 -1.223160
C -2.838472 0.122012 -0.534367
C 4.473951 -1.681966 -1.387870
C -3.099256 -2.034717 0.594396
C 3.336550 -2.330490 -0.804609
C -4.241936 0.261955 -0.592651
C -4.496782 -1.886703 0.551353
C -5.071652 -0.734448 -0.042454
H 0.808585 2.303604 1.530722
H 4.550568 2.407402 -0.706088
H 2.761215 3.599525 0.575893
H 5.480038 0.225922 -1.660106
H 5.200579 -2.272032 -1.953844
H -2.629178 -2.918669 1.036722
H 3.192885 -3.410130 -0.926269
H -4.658367 1.154152 -1.068118
H -5.139972 -2.661966 0.980498
H -6.158935 -0.613671 -0.074489


