%chk=000089135.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089135

0 1
 S   -2.278400       2.691600      5.3399999E-02
 P    2.644100      0.5532000     -0.6639000    
 P   -3.142300      0.8585000      0.5976000    
 O    2.088000     -0.9210000     -0.2566000    
 O    4.052400      0.6330000      0.1475000    
 O   -2.443000     -0.3560000     -0.2262000    
 O   -4.680200      0.8256000      7.0500001E-02
 O    2.848200      0.6691000      -2.153300    
 O   -3.047500      0.6567000       2.088000    
 N    1.649500       1.681800      3.2200001E-02
 C   0.2674000       1.770900     -0.4117000    
 C  -0.5487000       2.572500      0.5948000    
 C   -2.596700      -1.693900      0.2151000    
 C   -2.297400      -2.631600     -0.9444000    
 C    2.002600      -1.305800       1.105200    
 C    5.109900     -0.2310000     -0.2329000    
 C   -2.457100      -4.088500     -0.5484000    
 C    1.456300      -2.715200       1.186100    
 C    6.304300      2.8400000E-02  0.6605000    
 C   -4.931400       1.001800      -1.313400    
 H   0.2374000       2.236800      -1.403300    
 H  -0.1387000      0.7593000     -0.5062000    
 H  -0.1539000       3.590300      0.6849000    
 H  -0.5185000       2.111900       1.587800    
 H    2.030300       2.622900      0.1272000    
 H   -3.621400      -1.843600      0.5720000    
 H   -1.908300      -1.867400       1.048100    
 H   -2.962200      -2.399700      -1.785200    
 H   -1.278600      -2.452800      -1.308400    
 H    2.991400      -1.263300       1.570000    
 H    1.336100     -0.6185000       1.634900    
 H    4.788600      -1.272800     -0.1415000    
 H    5.375000     -3.6600001E-02  -1.276800    
 H   -2.234100      -4.739600      -1.399400    
 H   -3.480900      -4.296000     -0.2211000    
 H   -1.775600      -4.350100      0.2673000    
 H   0.4753000      -2.777600      0.7057000    
 H    2.113500      -3.413200      0.6568000    
 H    1.362000      -3.039200       2.226200    
 H    6.624900       1.072500      0.5825000    
 H    6.045400     -0.1476000       1.709800    
 H    7.142600     -0.6198000      0.3902000    
 H   -5.955600      0.6823000      -1.522500    
 H   -4.246900      0.3996000      -1.916000    
 H   -4.833400       2.057200      -1.578300    


%chk=000089135-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089135

0 1
S -2.377311 2.631452 0.454328
P 2.013441 -0.252167 -0.463449
P -2.936883 0.438833 0.890743
O 1.347876 -1.102291 0.897291
O 3.703171 -0.009198 -0.148222
O -2.367785 -0.338514 -0.554057
O -4.661187 0.417414 0.766260
O 1.623671 -1.050952 -1.781592
O -2.419988 -0.180641 2.259430
N 1.554571 1.401486 -0.319224
C 0.173721 1.848665 -0.578302
C -0.504234 2.369907 0.706527
C -1.916194 -1.779068 -0.480134
C -1.591941 -2.198319 -1.913675
C 1.669468 -0.654176 2.287919
C 4.663071 -1.051998 -0.619967
C -1.055365 -3.648560 -1.943173
C 0.664056 -1.336075 3.212071
C 6.053488 -0.432733 -0.518448
C -5.301041 0.831976 -0.505783
H 0.164944 2.631842 -1.359338
H -0.410541 0.999806 -0.977670
H -0.126829 3.359596 1.015056
H -0.375120 1.665462 1.544805
H 2.308383 2.088183 -0.265316
H -2.731322 -2.388578 -0.044236
H -1.023695 -1.832375 0.168798
H -2.498610 -2.102686 -2.540495
H -0.817053 -1.522893 -2.317199
H 2.711729 -0.949790 2.512491
H 1.594199 0.450325 2.341803
H 4.565243 -1.944005 0.027890
H 4.406754 -1.334451 -1.658233
H -0.846679 -3.958126 -2.982397
H -1.779923 -4.366033 -1.512699
H -0.109877 -3.719184 -1.376516
H -0.368240 -1.024325 2.977260
H 0.736080 -2.433507 3.118469
H 0.883486 -1.063791 4.262005
H 6.134666 0.454086 -1.169501
H 6.271812 -0.128104 0.519341
H 6.815442 -1.169560 -0.833409
H -6.363089 0.578613 -0.372122
H -4.873225 0.279391 -1.360218
H -5.188738 1.920163 -0.662312


