%chk=000008381.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008381

0 1
 S   -2.044300      -1.083400      -2.269400    
 P   -2.486500     -0.4499000     -0.4816000    
 O   -1.943100       1.031000     -9.0999998E-02
 O   -1.926500      -1.332100      0.7654000    
 O   -4.065400     -0.3270000     -0.1120000    
 O    2.991900       2.708500      0.7299000    
 N    1.584500      0.9243000      0.1040000    
 N   0.2881000      0.5006000     -8.0600001E-02
 C    2.562500     -0.1135000     -0.1175000    
 C  -0.6463000       1.367500      7.1599998E-02
 C    1.881500       2.240800      0.4811000    
 C  -0.5205000       2.770600      0.4173000    
 C   0.7310000       3.174800      0.6123000    
 C    3.838700      0.2162000     -0.5754000    
 C    2.233100      -1.447200      0.1264000    
 C   -2.188600      -2.724400      0.8149000    
 C   -4.866800      0.6448000     -0.7624000    
 C    4.784300     -0.7866000     -0.7893000    
 C    3.178800      -2.450000     -8.7399997E-02
 C    4.454400      -2.119600     -0.5452000    
 C   -1.575900      -3.302900       2.043800    
 C   -6.265000      0.5576000     -0.2546000    
 H   -1.378800       3.421300      0.5075000    
 H   0.9464000       4.203500      0.8800000    
 H    4.121500       1.237400     -0.8100000    
 H    1.253200      -1.736700      0.4963000    
 H   -3.271400      -2.884100      0.8142000    
 H   -1.764300      -3.209000     -6.8999998E-02
 H   -4.456100       1.640300     -0.5675000    
 H   -4.846400      0.4673000      -1.841900    
 H    5.775000     -0.5307000      -1.153400    
 H    2.923100      -3.487900      0.1050000    
 H    5.190300      -2.900600     -0.7129000    
 H   -1.762500      -4.378600       2.110600    
 H  -0.4936000      -3.135800       2.056800    
 H   -1.977400      -2.823300       2.942900    
 H   -6.908900       1.297400     -0.7389000    
 H   -6.683800     -0.4386000     -0.4328000    
 H   -6.298300      0.7223000      0.8277000    


%chk=000008381-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008381

0 1
S -2.123775 -1.137620 -2.102892
P -2.609763 -0.446017 -0.221769
O -2.094226 1.228855 0.184218
O -2.219845 -1.356568 1.169557
O -4.261430 -0.193846 0.147153
O 3.220707 2.563078 0.339526
N 1.498841 0.934892 0.085493
N 0.151099 0.598509 0.067842
C 2.378936 -0.183538 -0.197601
C -0.745788 1.570090 0.193272
C 1.984302 2.284944 0.287820
C -0.416410 2.958572 0.362746
C 0.920561 3.285628 0.411521
C 3.691360 -0.243557 0.335038
C 1.888128 -1.231759 -1.019231
C -1.143072 -2.401332 1.095629
C -5.102248 0.567977 -0.831450
C 4.502823 -1.361350 0.040803
C 2.713628 -2.338204 -1.303500
C 4.024256 -2.410900 -0.775151
C -1.217773 -3.154503 2.418595
C -6.540144 0.414409 -0.348617
H -1.216125 3.697424 0.453355
H 1.263574 4.315724 0.538341
H 4.073848 0.573134 0.947189
H 0.877286 -1.168197 -1.433713
H -1.344140 -3.056289 0.227109
H -0.177573 -1.887078 0.951531
H -4.771695 1.622979 -0.825437
H -4.952715 0.139464 -1.841282
H 5.516568 -1.405014 0.453367
H 2.333659 -3.138125 -1.948235
H 4.664619 -3.270084 -1.002318
H -0.439087 -3.939386 2.435981
H -1.044883 -2.473415 3.268567
H -2.203290 -3.633122 2.545271
H -7.219075 0.970237 -1.021437
H -6.839411 -0.646938 -0.344918
H -6.653824 0.815228 0.672524


