%chk=000004004.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004004

0 1
 S  -0.2651000      -1.353100     -0.9465000    
 S   -3.053400      -3.403400     -0.4080000    
 P   -2.202200      -1.656700     -0.1353000    
 O   -1.202400       1.814000      0.5875000    
 O    4.039100      0.2019000     -0.3236000    
 O   -3.145400     -0.4268000     -0.6564000    
 O   -2.137900      -1.238500       1.444400    
 O  -0.8189000       1.761400      -1.684100    
 O    2.604800      -1.138200      0.8878000    
 C   0.3207000      0.2019000     -0.1888000    
 C    1.741000      0.5446000     -0.6453000    
 C  -0.6254000       1.330500     -0.5549000    
 C    2.812000     -0.2513000      7.1099997E-02
 C   -2.100500       2.913800      0.4079000    
 C    5.160300     -0.4396000      0.2926000    
 C   -2.649500       3.327300       1.756800    
 C    6.435800      0.1715000     -0.2472000    
 C   -3.509200     -0.3317000      -2.023700    
 C   -1.403900      -2.027800       2.365600    
 H   0.3052000      6.1999999E-02  0.8978000    
 H    1.857700      0.4042000      -1.726600    
 H    1.938400       1.602200     -0.4251000    
 H   -1.562700       3.753600     -4.6000000E-02
 H   -2.923000       2.610600     -0.2492000    
 H    5.111800     -0.2966000       1.377800    
 H    5.138100      -1.511200      6.5300003E-02
 H   -3.341800       4.167700       1.656500    
 H   -1.836900       3.616600       2.431400    
 H   -3.174000       2.491300       2.231200    
 H    7.315100     -0.2968000      0.2037000    
 H    6.464100       1.247000     -4.3499999E-02
 H    6.490100      5.2400000E-02  -1.334400    
 H   -3.797900      0.7010000      -2.235000    
 H   -4.362900     -0.9840000      -2.222900    
 H   -2.674200     -0.6045000      -2.673400    
 H   -1.151000      -1.407900       3.229500    
 H  -0.4803000      -2.401700       1.917300    
 H   -2.018800      -2.866500       2.700800    


%chk=000004004-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004004

0 1
S -0.172903 -0.957428 -1.533938
S -1.798552 -4.200684 -1.309061
P -1.725888 -2.311765 -0.484305
O -1.030387 2.582482 0.341745
O 3.577073 0.297825 0.023468
O -3.169720 -1.364982 -0.399610
O -1.398109 -2.131072 1.205011
O -2.005338 1.561886 -1.508429
O 1.987623 -0.806236 1.316326
C -0.127023 0.462151 -0.272641
C 1.310622 1.024848 -0.207680
C -1.157254 1.553371 -0.593166
C 2.280640 0.059954 0.459493
C -2.017075 3.705784 0.226552
C 4.651921 -0.544234 0.645046
C -1.692688 4.692465 1.342109
C 5.975272 -0.075233 0.051624
C -3.877922 -1.089245 -1.674889
C -0.391926 -3.030428 1.828331
H -0.385263 0.015393 0.707349
H 1.691915 1.296708 -1.206428
H 1.289064 1.953096 0.395965
H -1.917425 4.148806 -0.780626
H -3.030975 3.276888 0.318586
H 4.603419 -0.411723 1.740953
H 4.431375 -1.601586 0.413155
H -2.401997 5.539321 1.307110
H -0.670213 5.093046 1.233774
H -1.776789 4.210591 2.330884
H 6.804849 -0.670192 0.475049
H 6.157551 0.988086 0.282733
H 5.982589 -0.200479 -1.044350
H -4.839567 -0.658739 -1.359391
H -4.044794 -2.024998 -2.239621
H -3.304638 -0.355937 -2.266647
H -0.620765 -2.983929 2.903468
H 0.619816 -2.640691 1.632520
H -0.509620 -4.063919 1.454631


