%chk=000175828.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175828

0 1
 S   -2.999000      -2.957100      0.3550000    
 P   -1.780200      -1.482100     -2.0500001E-02
 O   -1.023700      -1.655600      -1.451800    
 O  -0.5106000      -1.459500      0.9963000    
 O    5.239400       1.000800      0.7315000    
 O    4.684500       1.142500      -1.392200    
 N   -2.408800      5.6000002E-02  2.4999999E-03
 N    4.426400      0.8238000     -0.2070000    
 C   -2.877100      0.5474000       1.305500    
 C   -3.373200      0.3798000      -1.057400    
 C   -3.151600       2.049700       1.296000    
 C   -3.661700       1.877100      -1.142400    
 C   -4.135400       2.426500      0.1965000    
 C   1.9099999E-02 -0.7527000      -1.797000    
 C   0.9941000     -0.5515000     -0.6722000    
 C   0.6880000     -0.8949000      0.6489000    
 C    2.241000      2.9800000E-02 -0.9418000    
 C    1.611900     -0.6942000       1.675700    
 C    3.165200      0.2394000      8.3499998E-02
 C    2.851500     -0.1253000       1.391000    
 H   -2.116800      0.3490000       2.069400    
 H   -3.782100      7.7000000E-03   1.610500    
 H   -4.309500     -0.1684000     -0.8959000    
 H   -2.981400      5.5799998E-02  -2.027900    
 H   -2.210000       2.592900       1.145900    
 H   -3.547800       2.360300       2.269300    
 H   -4.421700       2.065200      -1.909100    
 H   -2.753400       2.407800      -1.455100    
 H   -5.125400       2.017300      0.4325000    
 H   -4.240300       3.515500      0.1414000    
 H  -0.4209000      0.2062000      -2.089000    
 H   0.5333000      -1.175800      -2.666100    
 H    2.466100      0.3088000      -1.969300    
 H    1.370000     -0.9739000       2.697400    
 H    3.546400      2.0600000E-02   2.214000    


%chk=000175828-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175828

0 1
S -2.486124 -3.180117 0.122020
P -1.686290 -1.316378 -0.106325
O -0.775288 -1.161387 -1.590044
O -0.447926 -0.837709 1.113583
O 5.849399 0.026504 0.787973
O 5.271982 0.575969 -1.351047
N -2.656654 0.143030 -0.056471
N 4.977965 0.185396 -0.153402
C -2.939976 0.785730 1.264921
C -3.836408 0.131470 -0.979331
C -3.368212 2.248512 1.026829
C -4.282234 1.583810 -1.248886
C -4.582715 2.325468 0.073815
C 0.148646 0.019492 -1.605389
C 1.238153 -0.166007 -0.571332
C 0.885308 -0.608391 0.739058
C 2.593270 0.076998 -0.856325
C 1.864351 -0.794337 1.742503
C 3.561137 -0.092565 0.157940
C 3.213082 -0.526257 1.457834
H -2.029677 0.735381 1.882617
H -3.751939 0.237376 1.793325
H -4.673657 -0.448009 -0.530255
H -3.545738 -0.368183 -1.920703
H -2.515081 2.805936 0.594234
H -3.607377 2.711237 2.003358
H -5.177179 1.565115 -1.899467
H -3.479422 2.110108 -1.800223
H -5.463608 1.861482 0.563422
H -4.846584 3.379837 -0.129090
H -0.449764 0.932806 -1.415337
H 0.546161 0.038771 -2.631129
H 2.917273 0.405043 -1.848617
H 1.545990 -1.144479 2.727841
H 3.995438 -0.652750 2.210200


