%chk=000134096.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134096

0 1
 S   -1.477400       2.115100     -0.7649000    
 P   -1.009400      -2.913800     -0.6557000    
 O   -1.121600      -1.953900      0.6169000    
 O   -1.794800       3.520200     -0.5986000    
 O   -1.130000       1.573400      -2.064800    
 O    1.513000      -1.218000       1.349600    
 O  -0.8088000      -4.367300      2.6000001E-02
 O   0.4549000      -2.602400      -1.269800    
 O   -2.133400      -2.845800      -1.647900    
 N  -0.2881000       1.655100      0.4004000    
 N    2.173000      0.6059000      1.4100000E-02
 N    4.270600       1.394200     -0.7421000    
 C   -2.848300       1.176100     -0.1933000    
 C   -2.581200     -6.8899997E-02  0.3885000    
 C  -0.1118000      0.2279000      0.5052000    
 C   -1.192900     -0.5783000      0.5005000    
 C   -4.138200       1.691100     -0.3111000    
 C  -0.3150000       2.377800       1.705400    
 C   -3.678200     -0.8126000      0.8468000    
 C    1.274100     -0.2176000      0.6765000    
 C   -5.208800      0.9351000      0.1554000    
 C   -4.980600     -0.3138000      0.7318000    
 C    3.582600      0.4796000     -3.7300002E-02
 C    4.137500     -0.5812000      0.6454000    
 C    5.520800     -0.7147000      0.6006000    
 C    5.612600       1.231900     -0.7629000    
 C    6.279700      0.2049000     -0.1148000    
 H   -4.324000       2.660000     -0.7637000    
 H  -0.2102000       3.453400       1.536700    
 H   0.5276000       2.065500       2.331100    
 H   -1.245500       2.179400       2.245300    
 H   -3.541900      -1.787100       1.310100    
 H   -6.222200       1.316300      6.9899999E-02
 H   -5.817900     -0.9027000       1.095800    
 H    1.808700       1.401800     -0.5050000    
 H    3.617600      -1.330600       1.217700    
 H   -1.593500      -4.836300      0.3816000    
 H   0.5793000      -1.798100      -1.817200    
 H    6.008300      -1.533500       1.121600    
 H    6.158600       1.975200      -1.334400    
 H    7.359200      0.1204000     -0.1635000    


%chk=000134096-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134096

0 1
S -2.057554 2.614052 -0.666741
P -0.077581 -2.085346 -2.349265
O -0.722891 -1.237202 1.753469
O -2.978493 3.124670 -1.920393
O -0.519747 1.803226 -1.300568
O 2.037889 1.346749 2.311691
O 1.411265 -2.709073 -2.162734
O -0.257562 -0.737672 -1.456124
O -1.198002 -2.705729 -3.282182
N -0.814710 2.189895 1.931115
N 1.667530 -0.040502 0.440199
N 3.139935 -1.496738 -0.689173
C -3.019746 1.013925 -0.108832
C -2.546437 0.006676 0.776059
C -0.258172 1.079646 1.538484
C -1.168308 -0.119306 1.345228
C -4.304632 0.956000 -0.671832
C -0.079651 3.398834 2.325879
C -3.433485 -1.066935 1.078627
C 1.247061 0.810624 1.483476
C -5.168062 -0.114703 -0.347960
C -4.731333 -1.124566 0.538768
C 2.960378 -0.516218 0.266645
C 4.103838 -0.075945 0.999762
C 5.359235 -0.636722 0.722092
C 4.364870 -2.041585 -0.968878
C 5.508577 -1.632296 -0.280094
H -4.597363 1.738478 -1.384021
H -0.662343 4.270480 1.981367
H 0.962677 3.459689 1.964815
H -0.052378 3.434802 3.432196
H -3.060661 -1.858695 1.736728
H -6.169542 -0.157655 -0.789087
H -5.394153 -1.957264 0.795552
H 0.928814 -0.351650 -0.249930
H 3.963499 0.687856 1.763713
H 2.309016 -1.938998 -1.271209
H -0.664493 0.829339 -1.585306
H 6.231750 -0.293812 1.286913
H 4.367112 -2.806649 -1.748731
H 6.478251 -2.075981 -0.513817


