%chk=000152890.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152890

0 1
 S    1.677900       3.224400     -0.1848000    
 O   -1.694300       1.370300      0.5693000    
 O    2.696600      0.4222000      7.3100001E-02
 O   -5.070900      0.8361000     -0.2660000    
 O    2.751300      -3.057300     -0.3478000    
 N   -3.649900     -0.8577000      0.1360000    
 N    1.090500      -1.438900     -0.6298000    
 C  -0.9279000       2.480100      0.3193000    
 C    3.669500       1.347300      0.2521000    
 C   0.4205000       2.518800      0.9507000    
 C    3.218600       2.703900      0.6529000    
 C   -2.488900      -1.662100      9.9500000E-02
 C  -0.1236000      -2.073800     -0.3092000    
 C   -2.847400       1.492100     -0.1587000    
 C    3.280400     -0.7667000     -0.2483000    
 C   -1.270400      -1.270800     -0.4423000    
 C   -1.630000       3.354800     -0.4833000    
 C    4.899700      0.7585000      4.3299999E-02
 C   -2.855500       2.723200     -0.7894000    
 C    4.649200     -0.6095000     -0.2663000    
 C   -3.892900      0.4916000     -0.1129000    
 C    2.386600      -1.889600     -0.4199000    
 C   -2.588400      -2.954900      0.6318000    
 C  -0.2289000      -3.347500      0.2419000    
 C   -1.471800      -3.794500      0.6890000    
 H   0.3835000       3.138000       1.852500    
 H   0.7154000       1.507400       1.244000    
 H    3.082900       2.758600       1.737800    
 H    3.991000       3.432700      0.3853000    
 H   -1.171000     -0.3234000     -0.9604000    
 H   -1.295700       4.325700     -0.8205000    
 H    5.862100       1.243300      0.1252000    
 H   -3.654400       3.116800      -1.402300    
 H    5.381500      -1.377800     -0.4694000    
 H   -4.494800      -1.376900      0.3677000    
 H   0.9925000     -0.4587000     -0.8912000    
 H   -3.533100      -3.317800       1.031500    
 H   0.6281000      -4.000300      0.3616000    
 H   -1.565900      -4.787100       1.120800    


%chk=000152890-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152890

0 1
S 1.636194 3.160554 -0.587411
O -1.530232 1.356659 0.286487
O 2.780934 0.389840 0.147571
O -5.046346 0.831665 -0.687146
O 2.806381 -3.225203 0.235874
N -3.625197 -0.918593 -0.284022
N 1.179307 -1.595837 -0.340571
C -0.960236 2.641769 0.432581
C 3.778839 1.373111 0.071062
C 0.457606 2.694949 0.877152
C 3.311352 2.782607 0.250644
C -2.491562 -1.762199 -0.091562
C -0.081300 -2.207361 -0.142554
C -2.863545 1.536311 -0.162691
C 3.407324 -0.878946 0.001819
C -1.187334 -1.371364 -0.436197
C -1.910247 3.600443 0.089243
C 5.008707 0.746060 -0.103475
C -3.109082 2.904342 -0.285579
C 4.773306 -0.682786 -0.135970
C -3.858474 0.460123 -0.394525
C 2.465934 -2.031171 -0.017660
C -2.703645 -3.067466 0.436413
C -0.276204 -3.513552 0.370204
C -1.602207 -3.926568 0.634784
H 0.603710 3.467672 1.648616
H 0.779677 1.712191 1.253796
H 3.184461 3.039908 1.318707
H 4.037992 3.489163 -0.180688
H -1.007462 -0.396188 -0.889386
H -1.756052 4.677549 0.100087
H 5.972436 1.242919 -0.196837
H -4.059278 3.327200 -0.601989
H 5.513006 -1.468898 -0.269359
H -4.520384 -1.414228 -0.370330
H 1.125131 -0.602129 -0.586850
H -3.715499 -3.396648 0.700526
H 0.580859 -4.162431 0.561581
H -1.776769 -4.932963 1.030452


