%chk=000173487.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173487

0 1
 S    2.871900      2.0500001E-02  0.2891000    
 O    4.309800      9.8999999E-02 -0.4799000    
 O    2.824700      -1.215700       1.055000    
 O    2.617200       1.305700      0.9226000    
 N   -2.197400     -0.8703000      0.2930000    
 C   -1.372100      -2.038800      1.0300000E-02
 C   8.0000004E-03  -1.661600     -0.4762000    
 C   0.4575000     -0.4052000     -0.6386000    
 C  -0.4516000      0.7185000     -0.3226000    
 C   -1.753800      0.4330000      0.1345000    
 C   -1.250200      -2.856800       1.303200    
 C   -2.081800      -2.870300      -1.067000    
 C    1.850300     -0.1358000      -1.128700    
 C  -5.7399999E-02   2.060300     -0.4639000    
 C   -2.623200       1.495000      0.4363000    
 C  -0.9343000       3.102200     -0.1586000    
 C   -2.217600       2.820100      0.2914000    
 H   0.6760000      -2.490100     -0.7080000    
 H   -3.144100      -1.018200      0.6254000    
 H   -2.236500      -3.152500       1.679800    
 H  -0.6648000      -3.770500       1.147900    
 H  -0.7619000      -2.277200       2.096300    
 H   -3.085900      -3.167000     -0.7411000    
 H   -2.199400      -2.300500      -1.996900    
 H   -1.524200      -3.784200      -1.302800    
 H    1.944100      0.7446000      -1.766500    
 H    2.227200     -0.9899000      -1.703700    
 H   0.9278000       2.341000     -0.8220000    
 H   -3.632000       1.291600      0.7900000    
 H  -0.6136000       4.133300     -0.2759000    
 H   -2.902700       3.628200      0.5289000    
 H    4.615900     -0.7423000     -0.8932000    


%chk=000173487-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173487

0 1
S 3.047940 0.036578 0.182885
O 4.421904 -0.605686 -0.927280
O 2.785134 -1.024638 1.373066
O 3.375941 1.579581 0.562676
N -2.355082 -0.868536 -0.202813
C -1.470943 -2.062080 -0.153994
C -0.125659 -1.676072 -0.747570
C 0.338269 -0.381758 -0.772456
C -0.506365 0.728748 -0.292916
C -1.888509 0.436090 -0.035627
C -1.238577 -2.529734 1.320606
C -2.132581 -3.198164 -0.972308
C 1.691163 -0.132634 -1.316729
C -0.038390 2.057266 -0.123865
C -2.768454 1.489378 0.333762
C -0.912941 3.094153 0.260215
C -2.282936 2.804050 0.475221
H 0.505381 -2.498666 -1.106364
H -3.347290 -1.039596 -0.028487
H -2.195591 -2.854886 1.772119
H -0.529225 -3.376419 1.360765
H -0.821043 -1.705482 1.923796
H -3.116905 -3.463533 -0.541454
H -2.280649 -2.889575 -2.021344
H -1.505127 -4.106792 -0.952520
H 1.861975 0.828911 -1.821542
H 2.138719 -0.977258 -1.858399
H 1.022722 2.289166 -0.273817
H -3.827579 1.270067 0.517862
H -0.533952 4.111564 0.396068
H -2.972677 3.603753 0.768011
H 5.287226 -0.491697 -0.439469


