%chk=000124812.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124812

0 1
 S  -0.8552000      -1.509000     -0.2277000    
 O  -0.2229000      -1.298500      -1.516300    
 O   -1.303300      -2.833700      0.1587000    
 O    4.979500       1.150300     -0.3743000    
 O    2.150200      -2.476700     -0.2015000    
 N   0.1160000     -0.8570000      0.9970000    
 N    3.566300     -0.6438000     -0.2840000    
 N    2.882000       1.485800      0.5234000    
 N   -5.567200       2.107800      4.4900000E-02
 C   -2.256700     -0.4332000     -0.1464000    
 C    1.386100     -0.3880000      0.6261000    
 C   -2.272100      0.7143000     -0.9195000    
 C   -3.310700     -0.7597000      0.6888000    
 C   -3.377200       1.563000     -0.8553000    
 C   -4.415800      8.9000002E-02  0.7527000    
 C   -4.449000       1.250300     -1.9300001E-02
 C    2.378500      -1.291800      1.1000000E-02
 C    1.678800      0.8992000      0.8398000    
 C    3.756400      0.6964000     -1.6300000E-02
 C    5.136200       2.535200     -8.2099997E-02
 H  -0.3742000     -0.2185000       1.639500    
 H   -1.444100      0.9786000      -1.569900    
 H   -3.299900      -1.654900       1.302800    
 H   -3.390500       2.466000      -1.460500    
 H   -5.244200     -0.1647000       1.409200    
 H   0.9547000       1.572700       1.288300    
 H    4.321100      -1.172100     -0.7109000    
 H   -6.343800       1.882200      0.6522000    
 H   -5.591200       2.950800     -0.5132000    
 H    6.142800       2.826300     -0.3978000    
 H    5.062300       2.727100      0.9939000    
 H    4.425700       3.146000     -0.6498000    


%chk=000124812-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124812

0 1
S -0.912198 -1.299443 -0.484195
O -0.202370 -0.790540 -1.867012
O -1.253184 -2.857471 -0.199509
O 5.394219 0.898987 -0.182170
O 2.178481 -2.415789 0.212261
N 0.201871 -0.524447 1.106388
N 3.740659 -0.682865 0.036745
N 3.218440 1.613795 0.439628
N -6.076663 1.812285 0.209225
C -2.496985 -0.326732 -0.257340
C 1.475803 -0.117360 0.698610
C -2.661435 0.880672 -0.963769
C -3.493512 -0.850816 0.588796
C -3.861821 1.594633 -0.807363
C -4.690193 -0.130934 0.745936
C -4.891681 1.104008 0.054389
C 2.425296 -1.187969 0.314964
C 1.916256 1.216661 0.690494
C 4.076887 0.650172 0.115027
C 5.821777 2.318604 -0.138949
H -0.390285 0.289246 1.376455
H -1.876658 1.230028 -1.643477
H -3.339402 -1.811646 1.090774
H -4.013480 2.530000 -1.358303
H -5.479129 -0.524667 1.397037
H 1.217866 2.026928 0.933402
H 4.449513 -1.372553 -0.235950
H -6.821224 1.460668 0.804610
H -6.236762 2.679851 -0.294879
H 6.891354 2.285062 -0.388007
H 5.653388 2.734399 0.867621
H 5.253772 2.906633 -0.877939


