%chk=000071347.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071347

0 1
 S   -1.456400      -4.049900     -0.8339000    
 O   -2.333300      -1.125900     -0.1466000    
 O   -4.358700      2.4000001E-03 -0.4803000    
 O  -0.2162000       4.671100      -1.521200    
 O    5.453600      0.2352000     -0.2309000    
 O    4.097700     -0.5900000       1.415500    
 N   -2.059400      0.1729000       2.427800    
 N  -0.2689000     -0.5182000       3.517300    
 N    3.616200     -0.9080000     -0.8577000    
 C   -3.072200      7.1300000E-02  0.1683000    
 C   -3.275600      -1.998300     -0.7746000    
 C   -4.231300      -1.044100      -1.442500    
 C   -3.307400      0.1145000       1.677700    
 C   -2.305900       1.305100     -0.2847000    
 C   -2.573800      -2.937400      -1.731900    
 C   -1.065400       1.165800     -0.9068000    
 C   -2.844300       2.574800     -7.7900000E-02
 C   -1.409000       1.304900       2.800600    
 C   -1.350300     -0.8968000       2.872900    
 C  -0.3629000       2.296800      -1.322300    
 C   -2.141800       3.706000     -0.4935000    
 C  -0.9010000       3.567100      -1.115600    
 C  -0.2998000      0.8533000       3.476300    
 C   6.5200001E-02  -3.107700     -0.8411000    
 C   0.6519000      -2.753900      -2.051700    
 C   0.6511000      -2.734800      0.3642000    
 C    1.837700      -2.019400      -2.057200    
 C    1.836800      -2.000100      0.3586000    
 C    2.430100      -1.642400     -0.8521000    
 C    1.046400       4.457300      -2.150400    
 C    4.354700     -0.4416000      0.2271000    
 C    6.319200      0.7806000      0.7717000    
 C    7.472900       1.489300      9.4800003E-02
 H   -3.796500      -2.550600      1.8700000E-02
 H   -5.207000      -1.487500      -1.657300    
 H   -3.820700     -0.6125000      -2.362300    
 H   -3.833300     -0.7896000       2.011300    
 H   -3.928400      0.9621000       1.990700    
 H   -3.315300      -3.559000      -2.244700    
 H   -2.028300      -2.381700      -2.500300    
 H  -0.6151000      0.1947000      -1.085100    
 H   -3.813800       2.703400      0.3952000    
 H   -1.770400       2.301100       2.590300    
 H   -1.660200      -1.919900       2.708900    
 H   0.5951000       2.116900      -1.798200    
 H   -2.567200       4.692700     -0.3317000    
 H   0.4755000       1.446000       3.939300    
 H   0.2144000      -3.046200      -3.002700    
 H   0.2067000      -3.014900       1.315200    
 H    2.290300      -1.749100      -3.007900    
 H    2.237300      -1.745300       1.330100    
 H    1.761600       3.986100      -1.467600    
 H   0.9397000       3.901300      -3.088000    
 H    1.450700       5.442100      -2.406900    
 H    3.993300     -0.6819000      -1.775100    
 H    6.701400     -2.9100001E-02   1.403200    
 H    5.759200       1.491500       1.389300    
 H    8.155500       1.919000      0.8332000    
 H    8.031600      0.7949000     -0.5415000    
 H    7.105200       2.290200     -0.5551000    


%chk=000071347-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071347

0 1
S -1.517127 -4.044733 -1.260681
O -2.723590 -1.279828 0.203799
O -4.560127 0.096650 -0.332538
O 0.308807 4.210953 -1.452313
O 5.495650 0.292049 -0.550532
O 3.274840 0.808367 0.045344
N -2.466706 0.237010 2.759762
N -0.711641 -0.595374 3.935510
N 3.907644 -1.281846 -0.880432
C -3.272079 0.093096 0.381309
C -3.472720 -1.943475 -0.902945
C -4.344677 -0.798272 -1.486481
C -3.636008 0.273521 1.878828
C -2.306806 1.141701 -0.159710
C -2.517154 -2.557258 -1.926170
C -0.911483 0.944930 -0.067724
C -2.793222 2.369450 -0.681847
C -1.771175 1.339918 3.278140
C -1.785024 -0.905964 3.180498
C 0.002324 1.934875 -0.484830
C -1.897522 3.366836 -1.110073
C -0.497719 3.152899 -1.008078
C -0.700224 0.810568 3.999276
C 0.146302 -3.261095 -1.082162
C 1.134227 -3.495800 -2.066826
C 0.438249 -2.424905 0.019549
C 2.384724 -2.847766 -1.981584
C 1.682193 -1.766334 0.106921
C 2.650022 -1.955170 -0.911749
C 1.762013 4.029311 -1.352430
C 4.126351 0.004009 -0.412782
C 5.911493 1.650827 -0.098700
C 7.425754 1.722911 -0.265612
H -4.107217 -2.726528 -0.445442
H -5.336640 -1.127636 -1.829511
H -3.811555 -0.259605 -2.295271
H -4.332094 -0.538325 2.148990
H -4.154898 1.239172 1.998790
H -3.093332 -2.953625 -2.782065
H -1.791335 -1.811442 -2.287968
H -0.529679 0.002981 0.329762
H -3.873826 2.531076 -0.763831
H -2.084283 2.361698 3.080233
H -2.108444 -1.907956 2.910849
H 1.074568 1.738314 -0.385795
H -2.254320 4.315005 -1.524233
H 0.069755 1.342014 4.553293
H 0.914540 -4.159789 -2.908714
H -0.311731 -2.280709 0.802348
H 3.135808 -3.005627 -2.764848
H 1.891702 -1.104279 0.950934
H 2.076787 3.866276 -0.304325
H 2.102354 3.174133 -1.967081
H 2.192944 4.965899 -1.736404
H 4.715299 -1.735775 -1.312096
H 5.595206 1.782303 0.951676
H 5.384856 2.402245 -0.715853
H 7.789205 2.715803 0.056011
H 7.926198 0.954892 0.348240
H 7.715741 1.572022 -1.319525


