%chk=000013709.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013709

0 1
 S   -1.081300      2.3700001E-02 -0.9194000    
 S    3.570900      -1.398000     -0.3556000    
 S   -4.516200      0.3719000      -1.595300    
 P   -3.087400      0.2685000     -0.2544000    
 O   -3.096900       1.550000      0.7612000    
 O   -3.368700     -0.9002000      0.8546000    
 O    4.302900       1.183000     -0.1815000    
 O    1.351600      -2.777500     -6.0500000E-02
 N    1.268100     -0.4501000      0.2566000    
 N    2.087800      0.6539000      0.2238000    
 C  -0.1164000     -0.2679000      0.5752000    
 C    1.867100      -1.670600     -2.8000001E-02
 C    3.291300      0.2954000     -7.8900002E-02
 C   -2.887500       2.861200      0.2631000    
 C   -3.455600      -2.258800      0.4581000    
 C    3.870400       2.515400      8.1100002E-02
 H  -0.4920000      -1.172300       1.062700    
 H  -0.2264000      0.5742000       1.265500    
 H   -2.098000       2.872900     -0.4919000    
 H   -2.590000       3.505000       1.094600    
 H   -3.816600       3.245400     -0.1648000    
 H   -2.715200      -2.492700     -0.3106000    
 H   -4.460000      -2.468300      8.2000002E-02
 H   -3.267900      -2.888100       1.331700    
 H    4.740400       3.171200     -2.1500001E-02
 H    3.499100       2.617600       1.106500    
 H    3.123100       2.841900     -0.6503000    


%chk=000013709-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013709

0 1
S -1.017434 1.059970 -0.863958
S 3.137535 -1.738963 -0.301656
S -4.406471 0.074974 -1.882355
P -3.124786 0.297626 -0.284320
O -3.573645 1.369038 1.007272
O -2.841971 -1.028995 0.786999
O 4.572589 0.576564 -0.408267
O 0.441718 -2.338838 0.281048
N 1.184038 -0.089264 0.433209
N 2.290602 0.766140 0.222700
C -0.087805 0.526519 0.746163
C 1.321446 -1.462770 0.191645
C 3.342562 0.056574 -0.143051
C -4.005300 2.730695 0.623705
C -2.854489 -2.413819 0.242899
C 4.692881 2.054780 -0.281216
H -0.742167 -0.195352 1.258710
H 0.086081 1.428449 1.344475
H -3.178069 3.284839 0.141723
H -4.279729 3.208085 1.575589
H -4.879402 2.688778 -0.051169
H -1.852448 -2.665735 -0.137803
H -3.625505 -2.516173 -0.542058
H -3.104588 -3.041478 1.111080
H 5.739012 2.263599 -0.541128
H 4.465058 2.362298 0.753264
H 3.996885 2.549159 -0.979500


