%chk=000133453.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133453

0 1
 S    1.636800     -0.8033000      -2.698600    
 S    7.647900       1.402500       1.193000    
 O    1.616700      3.3900000E-02   1.705100    
 O   -1.973100     -0.3722000     -4.9100000E-02
 O   -2.346900      -2.509400     -0.8426000    
 O    3.797400       2.148200       1.059900    
 N   0.4937000     -0.5387000     -0.2794000    
 N    3.118000       1.135900     -0.9149000    
 C   0.7562000      0.2337000      -1.484700    
 C    1.687900       1.110400     -0.6164000    
 C  -0.1421000      -1.822000     -0.1647000    
 C    1.304200      0.1644000      0.5443000    
 C   0.4163000      -2.780100      -1.192100    
 C   0.7030000      -2.276500      -2.540600    
 C   -1.609700      -1.638600     -0.4005000    
 C    4.065000       1.660900     -3.7300002E-02
 C   0.6846000      -4.053100     -0.8499000    
 C   0.2872000      -2.908200      -3.650600    
 C   -3.358300     -5.8699999E-02 -0.2252000    
 C    5.488300       1.565600     -0.5491000    
 C   -4.145100     -0.4716000       1.001300    
 C   -3.563100       1.397700     -0.5949000    
 C    6.294600      0.7196000      0.3965000    
 C   -5.479300     -0.8592000      0.8762000    
 C   -4.649600       1.770100      -1.386600    
 C   -3.535600     -0.4650000       2.256100    
 C   -2.665500       2.365100     -0.1428000    
 C    6.102700     -0.5999000      0.7423000    
 C   -6.204000      -1.239700       2.005700    
 C   -4.838200       3.109700      -1.726500    
 C   -4.260400     -0.8456000       3.385500    
 C   -2.854500       3.704700     -0.4826000    
 C    7.079600      -1.056300       1.673700    
 C    7.980800     -6.8300001E-02   2.004100    
 C   -5.594600      -1.233000       3.260200    
 C   -3.940800       4.077000      -1.274500    
 H  -0.1308000      0.7453000      -1.870900    
 H    1.299900       2.126300     -0.4693000    
 H  -1.3000000E-03  -2.186200      0.8596000    
 H    3.446600      0.7563000      -1.799400    
 H    1.111100      -4.761800      -1.552800    
 H   0.4862000      -4.418200      0.1529000    
 H   0.5080000      -2.531300      -4.645000    
 H  -0.2979000      -3.821600      -3.600900    
 H   -3.727500     -0.6376000      -1.084300    
 H    5.522000       1.119800      -1.549400    
 H    5.879400       2.585500     -0.6360000    
 H   -5.966800     -0.8743000     -9.4700001E-02
 H   -5.355800       1.028500      -1.749900    
 H   -2.501500     -0.1566000       2.382900    
 H   -1.816400       2.099900      0.4811000    
 H    5.302200      -1.213100      0.3481000    
 H   -7.242500      -1.542400       1.908200    
 H   -5.683600       3.399600      -2.343700    
 H   -3.787000     -0.8380000       4.362900    
 H   -2.156600       4.458100     -0.1294000    
 H    7.119400      -2.058400       2.080500    
 H    8.818800     -0.1399000       2.683000    
 H   -6.158900      -1.529000       4.139600    
 H   -4.087800       5.120100      -1.538900    


%chk=000133453-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133453

0 1
S 2.092518 -0.787191 -1.796378
S 6.289395 0.843324 -1.730600
O 1.513721 -0.933170 2.711420
O -2.071502 -0.505903 -0.022498
O -2.466540 -2.708369 -0.694870
O 3.156942 3.232797 0.945930
N 0.496016 -0.890861 0.506858
N 3.255461 0.933176 0.576276
C 1.012145 0.072708 -0.473290
C 1.835221 0.738135 0.704115
C -0.257408 -2.103474 0.236772
C 1.318678 -0.474145 1.572343
C 0.477189 -2.967628 -0.806185
C 1.001821 -2.287856 -2.027048
C -1.716960 -1.828277 -0.220709
C 3.831974 2.186467 0.719434
C 0.616221 -4.304731 -0.613219
C 0.820794 -2.756294 -3.290243
C -3.495439 -0.108747 -0.399926
C 5.375219 2.232139 0.630901
C -4.408440 -0.357433 0.797961
C -3.417973 1.331496 -0.878698
C 6.062624 1.021573 0.060478
C -5.107350 -1.589028 0.886916
C -4.369916 1.788847 -1.823120
C -4.564668 0.604197 1.827911
C -2.445996 2.236796 -0.384012
C 6.589394 -0.080980 0.723901
C -5.945886 -1.857014 1.990763
C -4.354589 3.130470 -2.264197
C -5.398180 0.332830 2.934283
C -2.425708 3.577027 -0.830699
C 7.170526 -1.075368 -0.147405
C 7.095408 -0.740431 -1.488896
C -6.091688 -0.897293 3.018946
C -3.380780 4.029315 -1.769892
H 0.250340 0.679533 -0.981755
H 1.394764 1.701252 1.017790
H -0.330727 -2.667699 1.186318
H 3.861415 0.134833 0.363580
H 1.154300 -4.931376 -1.331905
H 0.193888 -4.802806 0.266993
H 1.236007 -2.241012 -4.161786
H 0.233065 -3.664511 -3.463007
H -3.792925 -0.781964 -1.225314
H 5.620332 3.150896 0.069749
H 5.735636 2.403226 1.663579
H -4.974676 -2.338950 0.098860
H -5.125733 1.096256 -2.213501
H -4.045909 1.566055 1.758314
H -1.705054 1.885750 0.341559
H 6.567653 -0.173913 1.813553
H -6.481815 -2.810710 2.049696
H -5.095224 3.471279 -2.996079
H -5.512490 1.080899 3.726605
H -1.665266 4.265610 -0.445943
H 7.628207 -2.000166 0.211326
H 7.447187 -1.293480 -2.357855
H -6.741894 -1.103681 3.876519
H -3.364022 5.068575 -2.116120


