%chk=000133192.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133192

0 1
 I   -2.183900       3.075900       2.261100    
 I    5.317100       1.918200      -1.160700    
 I    2.106100      -1.953700       2.294200    
 S    4.900900      -1.828000     -0.3603000    
 O   8.0700003E-02   2.474600     -1.4900000E-02
 O   -4.083800      -1.492200       1.567600    
 O    4.590000     -0.6202000      0.7077000    
 O   -6.292700      -1.599700       1.099600    
 O    6.209000      -2.577900      0.2650000    
 O    3.797000      -2.770100     -0.3453000    
 O    5.310400      -1.212100      -1.609100    
 N   -5.659700      -2.487300      -1.493600    
 C   -4.688800     -0.2313000      -1.351400    
 C   -4.746600      -1.646600     -0.7605000    
 C   -3.417400      0.4977000     -0.9832000    
 C   -3.382800       1.260600      0.1723000    
 C   -2.311100      0.3885000      -1.809400    
 C   -1.085900       1.833400     -0.3100000    
 C   -2.208800       1.933100      0.5115000    
 C   -1.137100       1.061200      -1.470500    
 C   -5.129400      -1.580500      0.7110000    
 C    1.211300       1.697800      0.1661000    
 C    1.127000      0.5521000      0.9375000    
 C    2.398800       2.086500     -0.4285000    
 C    3.473300      0.1459000      0.5290000    
 C    3.539100       1.304100     -0.2456000    
 C    2.267300     -0.2302000       1.120500    
 H   -5.558800      0.3613000      -1.037000    
 H   -4.747700     -0.2732000      -2.448200    
 H   -3.762400      -2.128500     -0.8161000    
 H   -4.266300       1.336300      0.8011000    
 H   -2.341200     -0.2105000      -2.714900    
 H  -0.2765000      0.9801000      -2.129500    
 H   -5.367800      -2.552600      -2.468100    
 H   -6.587600      -2.065000      -1.510100    
 H   0.1938000      0.2665000       1.415000    
 H    2.426700       2.992400      -1.028300    
 H   -4.378100      -1.446200       2.502200    
 H    6.936300      -1.980500      0.5590000    


%chk=000133192-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133192

0 1
I -2.109176 3.445986 1.717661
I 5.575201 2.321694 0.621121
I 2.332801 -2.821548 1.560322
S 5.604223 -1.823958 -0.599583
O 0.199478 2.044374 -0.037121
O -4.297558 -1.725461 1.423562
O 4.800002 -0.763897 1.354753
O -6.186385 -0.387529 1.226867
O 7.235755 -0.933996 -0.603161
O 6.021336 -3.367168 -0.838001
O 4.591133 -1.116596 -1.668795
N -6.552033 -2.052088 -1.150956
C -4.902999 -0.150826 -1.597773
C -5.264166 -1.464015 -0.791400
C -3.558888 0.439755 -1.217654
C -3.471492 1.438889 -0.212422
C -2.360410 -0.029530 -1.816781
C -1.039782 1.445829 -0.397215
C -2.220036 1.943261 0.199511
C -1.107034 0.470492 -1.417988
C -5.325365 -1.127661 0.700122
C 1.307430 1.272559 0.303455
C 1.223184 -0.097137 0.676349
C 2.544531 1.975358 0.300211
C 3.705819 -0.119086 1.019269
C 3.709818 1.290091 0.633973
C 2.396074 -0.768458 1.027404
H -5.719954 0.573207 -1.423321
H -4.918119 -0.427919 -2.668301
H -4.467821 -2.211183 -0.946021
H -4.387208 1.819823 0.251367
H -2.407347 -0.781092 -2.612748
H -0.185901 0.128920 -1.901662
H -6.599377 -2.552399 -2.038124
H -7.376517 -1.497283 -0.912548
H 0.256835 -0.605556 0.694895
H 2.543381 3.031404 0.020675
H -4.376240 -1.478402 2.386523
H 7.057206 -0.058954 -0.141268


