%chk=000227000.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227000

0 1
 S  -0.3294000      -2.598200     -0.6016000    
 O   0.3857000      -2.451500      -1.854700    
 O   -1.021500      -3.834300     -0.2919000    
 O    5.003300       1.812100      0.2771000    
 O    4.460300     -0.1557000     -0.7982000    
 O   -5.920100       1.010300       1.155700    
 N   0.6970000      -2.164000      0.6837000    
 N   -4.268000       1.826100     -0.3154000    
 N    1.336300     -0.8685000      0.5896000    
 C   -1.503800      -1.279800     -0.5166000    
 C   -1.275800     -0.1247000      -1.243900    
 C   -2.628800      -1.427100      0.2758000    
 C   -3.342000      0.7850000     -0.3833000    
 C   -2.202200      0.9160000      -1.176800    
 C   -3.555200     -0.3865000      0.3430000    
 C    2.498800     -0.7753000       1.159100    
 C    3.327400      0.4925000       1.245200    
 C    3.047600      -2.002300       1.843800    
 C    4.316400      0.6435000      0.1170000    
 C   -5.459600       1.877600      0.4204000    
 C    5.973000       2.099400     -0.7353000    
 C   -6.182400       3.186500      0.2234000    
 C    6.643000       3.418900     -0.4160000    
 H  -0.3927000       0.000000      -1.862900    
 H   -2.806800      -2.329200      0.8533000    
 H   -2.022400       1.824000      -1.746900    
 H   -4.411500     -0.5606000      0.9794000    
 H   0.4890000      -2.509200       1.628700    
 H    2.637800       1.343200       1.211000    
 H    3.863200      0.5053000       2.199500    
 H   -4.040900       2.646400     -0.8738000    
 H    2.466500      -2.221300       2.744000    
 H    4.084900      -1.828900       2.146100    
 H    3.047300      -2.864200       1.170200    
 H    5.476000       2.163000      -1.709700    
 H    6.722400       1.300500     -0.7605000    
 H   -5.557600       4.010500      0.5791000    
 H   -7.119200       3.181200      0.7875000    
 H   -6.408300       3.330000     -0.8370000    
 H    7.129500       3.376900      0.5641000    
 H    5.903600       4.225200     -0.3694000    
 H    7.392400       3.670000      -1.171900    


%chk=000227000-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227000

0 1
S -0.540371 -2.946262 -1.022055
O -0.110755 -2.952889 -2.578962
O -1.182682 -4.237179 -0.266350
O 4.713695 1.905807 0.140546
O 5.236243 -0.347722 0.425067
O -5.434001 1.347947 1.669883
N 1.032121 -2.658881 0.004882
N -4.097291 1.915060 -0.176822
N 1.503054 -1.371392 -0.046154
C -1.636172 -1.447359 -0.733797
C -1.480934 -0.337270 -1.581628
C -2.584242 -1.499960 0.300365
C -3.289120 0.758432 -0.324576
C -2.319242 0.770972 -1.368369
C -3.423897 -0.387413 0.510135
C 2.410417 -0.972162 0.824849
C 2.889334 0.454206 0.668436
C 2.965737 -1.861137 1.917289
C 4.390730 0.574242 0.405625
C -5.103542 2.169435 0.769419
C 6.159133 2.190352 -0.135239
C -5.762075 3.538122 0.608237
C 6.269065 3.687537 -0.401857
H -0.741232 -0.352084 -2.386890
H -2.684265 -2.402072 0.913118
H -2.221573 1.651391 -2.015565
H -4.178316 -0.389802 1.298020
H 0.910981 -3.170316 0.902042
H 2.344799 0.936036 -0.161401
H 2.668128 1.046570 1.580044
H -3.921066 2.662625 -0.852960
H 2.167073 -2.213315 2.604557
H 3.726797 -1.338168 2.514220
H 3.444026 -2.756341 1.475563
H 6.471413 1.579137 -1.000947
H 6.748161 1.869423 0.742945
H -5.026976 4.354895 0.732890
H -6.540648 3.644685 1.376616
H -6.229882 3.645244 -0.387987
H 5.931085 4.270571 0.471858
H 5.658120 3.978817 -1.273195
H 7.321372 3.953017 -0.610953


