%chk=000149901.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149901

0 1
 S    1.613500       2.361700     -0.3699000    
 O    1.600600       3.707600      0.1908000    
 O    1.985100       2.187300      -1.768800    
 O    2.410100      -4.075000     -0.1445000    
 O   -3.917800      -1.647500      -1.204500    
 N    2.623400       1.378900      0.6215000    
 N   -3.760100     -1.7000000E-03  0.4761000    
 N    3.009000     -0.5253000     -0.7162000    
 C   3.1700000E-02   1.666200     -0.1208000    
 C  -0.4172000      0.6389000     -0.9509000    
 C  -0.7834000       2.137800      0.9084000    
 C   -2.496000      0.5546000      0.2771000    
 C   -1.681000      8.3200000E-02 -0.7520000    
 C   -2.047300       1.581900       1.107300    
 C    2.550500     -4.8000000E-02  0.4576000    
 C    2.034000     -0.8240000       1.475800    
 C    1.983600      -2.198800       1.274300    
 C   -4.376400      -1.030300     -0.2487000    
 C    2.445400      -2.737900      7.8599997E-02
 C    2.944000      -1.866200     -0.8760000    
 C   -5.751800      -1.343600      0.2847000    
 H   0.2011000      0.2561000      -1.758000    
 H  -0.4519000       2.931400       1.572000    
 H    2.702800       1.685700       1.600300    
 H   -1.958400     -0.7082000      -1.434100    
 H   -2.671200       1.957600       1.914300    
 H   -4.293200      0.3964000       1.246500    
 H    1.675500     -0.3908000       2.403200    
 H    1.583500      -2.844200       2.051100    
 H    3.318800      -2.226100      -1.829100    
 H   -5.676700      -1.688200       1.319900    
 H   -6.213600      -2.129500     -0.3193000    
 H   -6.379400     -0.4489000      0.2416000    
 H    2.773200      -4.255200      -1.028800    


%chk=000149901-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149901

0 1
S 1.322704 1.864502 0.162438
O 1.433224 3.292555 0.946381
O 1.988592 1.661919 -1.304048
O 4.584929 -4.011077 -0.419917
O -4.703405 -1.579332 -1.092182
N 2.096300 0.638804 1.433408
N -4.592343 0.474996 0.042340
N 2.099851 -1.270684 0.038334
C -0.487625 1.372682 0.135055
C -0.874158 0.182480 -0.500083
C -1.394082 2.259806 0.738039
C -3.196190 0.735995 0.050706
C -2.245281 -0.141674 -0.543778
C -2.761338 1.932393 0.687951
C 2.781923 -0.489303 0.929761
C 4.091639 -0.827398 1.381882
C 4.681411 -2.024766 0.942080
C -5.277236 -0.625996 -0.494383
C 3.973522 -2.832377 0.021127
C 2.693239 -2.403322 -0.413642
C -6.787483 -0.585995 -0.262545
H -0.117362 -0.487910 -0.919232
H -1.036202 3.176433 1.217078
H 2.641215 1.239882 2.076140
H -2.589933 -1.058215 -1.024417
H -3.492726 2.609792 1.145833
H -5.173242 1.183168 0.498079
H 4.630903 -0.167406 2.069281
H 5.677279 -2.328386 1.276530
H 2.125384 -2.991345 -1.148830
H -7.026396 -0.984982 0.741084
H -7.273855 -1.230523 -1.009234
H -7.205375 0.434100 -0.338062
H 4.022518 -4.482915 -1.083677


