%chk=000133358.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133358

0 1
 S   -1.443500      -2.211500       1.936700    
 S    2.913500      -3.451000      4.6900000E-02
 S   -5.730300     -0.4476000      -1.140400    
 O   -1.728200       1.658700     -0.6233000    
 O    1.096600      0.6773000      -1.686500    
 O   4.6300001E-02 -0.9775000      -2.865000    
 O   -4.323000       2.168100       1.071700    
 O    4.007600      0.8191000      -2.768500    
 O    5.653500       1.964600      -1.698200    
 O    6.318400       2.210400       1.167200    
 O    4.279000       3.021200       1.116000    
 N  -0.6980000     -0.2400000      0.3223000    
 N   -3.393100      0.1490000       1.738200    
 N    5.081100       2.061500       1.033500    
 C  -0.8902000     -0.5026000       1.736900    
 C   -1.995000      0.5755000       1.688600    
 C   -1.481800      0.8575000      0.2476000    
 C   7.9700001E-02  -1.003000     -0.4882000    
 C   0.5023000      -2.232800     -0.1098000    
 C   7.0299998E-02  -2.906200       1.190900    
 C    1.433000      -3.105400     -0.9174000    
 C   0.3880000     -0.4611000      -1.820100    
 C   -4.452700      0.9958000       1.420400    
 C   -5.812100      0.3338000       1.525700    
 C   -6.474400      0.3551000      0.1764000    
 C    3.561700      -1.804200      0.3325000    
 C   -7.658700      0.9573000     -0.1877000    
 C    3.911300     -0.9944000     -0.7481000    
 C    3.716400      -1.332900       1.636300    
 C    4.415100      0.2870000     -0.5250000    
 C   -7.959300      0.7567000      -1.566000    
 C    4.220500     -5.1500000E-02   1.859600    
 C   -6.993200      9.2000002E-03  -2.202700    
 C    4.569600      0.7584000      0.7788000    
 C    4.769500       1.105000      -1.679000    
 H  -2.1299999E-02 -0.2221000       2.344200    
 H   -1.809800       1.408900       2.376600    
 H  -0.1414000      -3.966000       1.013200    
 H   0.8601000      -2.837900       1.945000    
 H   -3.611100     -0.8051000       2.014900    
 H   0.9363000      -4.052500      -1.155200    
 H    1.727800      -2.663300      -1.871900    
 H   -5.734300     -0.6962000       1.890100    
 H   -6.402100      0.8956000       2.258800    
 H    1.329200       1.072100      -2.553900    
 H   -8.282800       1.516000      0.4981000    
 H    3.808200      -1.380200      -1.759800    
 H    3.448400      -1.949600       2.490500    
 H   -8.839100       1.141400      -2.065000    
 H    4.334700      0.3023000       2.881400    
 H   -6.968600     -0.2904000      -3.240900    
 H    4.251400       1.372900      -3.540600    


%chk=000133358-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133358

0 1
S -2.414956 -2.080500 0.798828
S 2.649583 -3.414676 -0.124290
S -6.887201 -1.625096 0.800591
O -1.662794 2.106529 -0.832719
O 1.451928 1.371147 -0.695244
O 1.489404 -0.052197 -2.531997
O -4.456530 1.744916 3.110076
O 3.845439 2.178823 -1.687015
O 5.766854 1.122824 -2.469468
O 6.137450 1.836248 2.425453
O 6.021215 2.509112 0.246736
N -0.786602 0.093437 0.243923
N -3.915726 0.709091 1.094663
N 5.775761 1.665522 1.200560
C -1.595803 -0.467412 1.346606
C -2.493720 0.828431 1.292788
C -1.633669 1.229801 0.040448
C 0.129686 -0.601233 -0.562792
C 0.189645 -1.982452 -0.534560
C -0.732238 -2.837029 0.326903
C 1.234347 -2.757194 -1.289841
C 1.061591 0.248758 -1.386383
C -4.819155 1.199179 2.028614
C -6.311868 1.076261 1.646035
C -6.645658 0.149427 0.508807
C 3.603332 -1.893257 0.218046
C -6.799046 0.440292 -0.842268
C 3.925820 -0.960671 -0.799064
C 4.055139 -1.673952 1.545508
C 4.613814 0.230223 -0.487815
C -7.101620 -0.707428 -1.665069
C 4.788508 -0.516480 1.858002
C -7.184085 -1.889388 -0.948480
C 5.041677 0.436190 0.847224
C 4.878945 1.205513 -1.607865
H -1.031279 -0.646362 2.273846
H -2.333598 1.480326 2.170029
H -0.992111 -3.764473 -0.213206
H -0.226466 -3.132876 1.264130
H -4.282725 0.266031 0.246795
H 0.835050 -3.702801 -1.692895
H 1.693487 -2.186020 -2.105599
H -6.843645 0.803796 2.574370
H -6.648798 2.100106 1.393555
H 2.226709 1.839183 -1.157254
H -6.705261 1.456127 -1.236894
H 3.628234 -1.140591 -1.835303
H 3.813730 -2.397859 2.329581
H -7.255124 -0.653074 -2.745250
H 5.145282 -0.319659 2.872219
H -7.399133 -2.895925 -1.302569
H 4.041680 2.816714 -2.424695


