%chk=000151777.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151777

0 1
 S    3.343400       2.894900      0.1682000    
 O    2.946900      -1.908200     -0.7729000    
 O    1.185800       1.124600       1.628700    
 O    1.833600      -3.484900      0.4038000    
 N    1.164400     -3.3000000E-02 -0.3825000    
 C   0.7882000      -1.317200      0.1611000    
 C  -0.5201000      -1.820000     -0.4627000    
 C   -1.673400     -0.8667000     -0.2614000    
 C    1.333600       1.094600      0.4085000    
 C    1.891100      -2.344900     -4.5200001E-02
 C    1.709200       2.324900     -0.4045000    
 C   -2.471800     -0.9948000      0.8641000    
 C   -1.912900      0.1190000      -1.205700    
 C   0.6887000       3.443400     -0.2387000    
 C   -3.537400     -0.1142000       1.050300    
 C   -2.978500      0.9996000      -1.019400    
 C   -3.790800      0.8831000      0.1085000    
 H   0.6668000      -1.214300       1.246400    
 H  -0.3811000      -1.995400      -1.538900    
 H  -0.7839000      -2.802200     -4.8000000E-02
 H    1.345400      2.1100000E-02  -1.380500    
 H    1.798900       2.078100      -1.467200    
 H   -2.280600      -1.766600       1.604000    
 H   -1.288700      0.2180000      -2.089000    
 H  -0.2971000       3.107600     -0.5799000    
 H   0.5768000       3.745900      0.8088000    
 H   0.9604000       4.325700     -0.8283000    
 H   -4.169400     -0.2044000       1.928900    
 H   -3.175300       1.776300      -1.752700    
 H   -4.620200       1.569100      0.2536000    
 H    3.629700      -2.603900     -0.8826000    
 H    4.025000       1.797600     -0.1928000    


%chk=000151777-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000151777

0 1
S 3.743256 2.433400 0.010826
O 3.036949 -1.635491 -0.740385
O 0.979634 1.055003 1.760767
O 1.848590 -3.399378 0.191410
N 1.111240 0.160272 -0.384069
C 0.754402 -1.191526 0.034612
C -0.510377 -1.756934 -0.678747
C -1.772564 -0.915012 -0.521209
C 1.265079 1.192521 0.533900
C 1.900717 -2.196360 -0.136531
C 1.820479 2.488142 -0.068043
C -2.045316 -0.153757 0.644514
C -2.743238 -0.940020 -1.556009
C 1.368274 3.731546 0.705965
C -3.263475 0.551485 0.772528
C -3.961978 -0.237243 -1.429454
C -4.228059 0.511609 -0.260075
H 0.561419 -1.126183 1.123570
H -0.290110 -1.891356 -1.756527
H -0.677150 -2.772535 -0.269548
H 1.367773 0.313755 -1.360653
H 1.553142 2.567868 -1.137074
H -1.309863 -0.088781 1.454428
H -2.545045 -1.519551 -2.466963
H 0.274476 3.855815 0.613099
H 1.608332 3.617894 1.775370
H 1.859434 4.638846 0.314380
H -3.454973 1.135316 1.679824
H -4.699053 -0.272691 -2.239705
H -5.171438 1.059294 -0.156955
H 3.740469 -2.336847 -0.814929
H 3.885673 1.173699 -0.556321


