%chk=000002471.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002471

0 1
 S   -2.915300      -2.068500      0.4127000    
 O  -2.6600000E-02  -1.519100      0.9881000    
 O   -2.181900      -2.915600       1.341000    
 O   -4.333700      -1.819600      0.6223000    
 O   -2.168500       4.140600     -0.6000000    
 O   -4.137800       3.033800     -0.8521000    
 N    1.274000      0.9498000      0.8192000    
 N   -2.688500      -2.659400      -1.173600    
 C    2.092500       2.050600      0.3714000    
 C    3.574500       1.700800      0.4758000    
 C  -7.5000003E-02  0.8244000      0.5262000    
 C  -0.7356000     -0.4167000      0.6090000    
 C   -2.093800     -0.5271000      0.3111000    
 C    4.484900       2.857200      5.4800000E-02
 C  -0.8238000       1.950500      0.1342000    
 C   -2.181900       1.840200     -0.1638000    
 C   -2.816900      0.6014000     -7.5400002E-02
 C    5.952900       2.501100      0.2322000    
 C    1.050900      -1.888400      0.2033000    
 C   -2.936000       3.016800     -0.5664000    
 C   0.9104000      -1.902000      -1.173500    
 C    2.243100      -2.236400      0.8136000    
 C    1.996600      -2.275400      -1.965100    
 C    3.329400      -2.609800      2.2200000E-02
 C    3.206100      -2.629300      -1.367200    
 H    1.871300       2.292100     -0.6757000    
 H    1.881300       2.938900      0.9779000    
 H    3.806900       1.413900       1.509600    
 H    3.787700      0.8213000     -0.1451000    
 H    1.694700      0.2538000       1.422100    
 H    4.297100       3.114000     -0.9941000    
 H    4.256800       3.746500      0.6536000    
 H  -0.3286000       2.916100      7.8599997E-02
 H   -3.873600      0.5187000     -0.3163000    
 H    6.220900       1.630300     -0.3746000    
 H    6.585900       3.338800     -7.6899998E-02
 H    6.177900       2.273300       1.279000    
 H   -3.508000      -2.693500      -1.792100    
 H   -2.037900      -3.444100      -1.302000    
 H  -2.0900000E-02  -1.642000      -1.665600    
 H    2.341000      -2.222000       1.894900    
 H    1.900200      -2.292700      -3.046700    
 H    4.271300      -2.884600      0.4877000    
 H    4.051800      -2.920000      -1.983300    
 H   -2.686300       4.928200     -0.8720000    


%chk=000002471-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002471

0 1
S -2.938550 -1.993309 0.656640
O 0.083825 -1.453619 0.833802
O -2.617785 -2.535933 2.151268
O -4.472706 -1.777538 0.159026
O -2.236068 4.313445 -0.761204
O -4.248375 3.155665 -0.710992
N 1.403953 1.030730 0.415284
N -2.168137 -3.097820 -0.600598
C 2.174320 2.272578 0.264741
C 3.675890 2.009307 0.487666
C 0.034550 0.948507 0.249522
C -0.638615 -0.308461 0.428833
C -2.035234 -0.366701 0.320627
C 4.523267 3.294967 0.359929
C -0.765627 2.077031 -0.087875
C -2.168563 1.968277 -0.220438
C -2.833619 0.735137 -0.004591
C 6.028811 3.037469 0.581769
C 1.019638 -2.062217 -0.064266
C -3.002863 3.148401 -0.576735
C 1.011976 -1.833234 -1.456952
C 1.932815 -2.953605 0.539196
C 1.960139 -2.510473 -2.256441
C 2.869879 -3.624910 -0.277088
C 2.891185 -3.402759 -1.674848
H 2.019523 2.692589 -0.751467
H 1.818630 3.036952 0.989500
H 3.826339 1.570876 1.496025
H 4.029553 1.258412 -0.247696
H 1.904665 0.196956 0.723357
H 4.367745 3.738194 -0.644537
H 4.163753 4.045189 1.092815
H -0.303450 3.054447 -0.238730
H -3.920190 0.648280 -0.097526
H 6.420978 2.310912 -0.154291
H 6.613566 3.969437 0.480302
H 6.218224 2.628642 1.591924
H -2.936433 -3.607787 -1.069128
H -1.490507 -3.719717 -0.129188
H 0.268702 -1.167044 -1.904947
H 1.891464 -3.111575 1.621230
H 1.961659 -2.344473 -3.339189
H 3.580975 -4.320964 0.180710
H 3.619474 -3.924859 -2.303978
H -2.849276 5.061499 -0.992463


