%chk=000101240.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101240

0 1
 S    2.415800      -1.058700     -0.4605000    
 O    2.786400      -2.411000     -6.5300003E-02
 O    2.693300     -0.6040000      -1.816000    
 O    2.906300       2.020900     -0.6156000    
 O   -3.983300       1.424500     -0.9657000    
 N    3.112500      5.0799999E-02  0.6454000    
 N   -3.377800     -0.2818000      0.5445000    
 C   0.7100000     -0.8299000     -0.1648000    
 C  -2.3000001E-03  0.1237000     -0.8919000    
 C   5.9999999E-02  -1.600700      0.7989000    
 C   -2.015100     -0.4648000      0.3079000    
 C   -1.364900      0.3061000     -0.6556000    
 C   -1.302600      -1.418300       1.035300    
 C    3.284400       1.450100      0.4012000    
 C   -4.251000      0.6187000     -8.0399998E-02
 C    3.981900       2.169100       1.520300    
 C   -5.653600      0.5052000      0.4623000    
 H   0.4838000      0.7383000      -1.644300    
 H   0.5971000      -2.344300       1.381000    
 H   -1.848300       1.063700      -1.256600    
 H   -1.796100      -2.025000       1.790300    
 H    3.486700     -0.3415000       1.519300    
 H   -3.778300     -0.8819000       1.262600    
 H    4.077300       3.230300       1.274300    
 H    3.401400       2.069400       2.441300    
 H    4.980000       1.747100       1.664500    
 H   -6.044200     -0.4978000      0.2691000    
 H   -6.300500       1.239300     -2.6000001E-02
 H   -5.651500      0.6959000       1.539200    


%chk=000101240-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101240

0 1
S 2.460158 -1.178885 -0.292793
O 2.838301 -2.540038 0.515456
O 2.872051 -0.982220 -1.841224
O 2.480811 1.963331 -0.309134
O -4.047846 1.424312 -1.019588
N 3.346740 0.089795 0.763105
N -3.493424 -0.282740 0.496176
C 0.633744 -0.825913 -0.046894
C 0.006479 0.153910 -0.831648
C -0.040439 -1.622401 0.894263
C -2.098958 -0.428649 0.278243
C -1.378883 0.355247 -0.668129
C -1.421479 -1.413894 1.052808
C 3.278124 1.460808 0.530584
C -4.391328 0.596708 -0.129141
C 4.244791 2.292660 1.373234
C -5.834497 0.477114 0.351978
H 0.584146 0.754361 -1.539108
H 0.496661 -2.388122 1.462370
H -1.907368 1.107695 -1.254892
H -1.977263 -2.022813 1.776283
H 4.025066 -0.354004 1.393789
H -3.894858 -0.905193 1.200979
H 3.735361 3.220905 1.677163
H 4.610854 1.764989 2.269728
H 5.112443 2.569946 0.747690
H -6.478299 0.228717 -0.509248
H -6.166256 1.458237 0.732699
H -5.987433 -0.280465 1.139952


