%chk=000077908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077908

0 1
 S  -0.2564000      -1.879800       1.527300    
 S   -3.242900      -1.493200       1.169700    
 O    1.897300      -2.200800      -2.262100    
 O   0.3416000      -2.811800     -0.8389000    
 O    4.759000       2.449200      0.6231000    
 O    4.901200       1.366800      -1.281500    
 N   -1.468300      0.1433000      0.2614000    
 N    1.303700      -2.079000      -1.165700    
 N    4.362500       1.556300     -0.1642000    
 C    1.126400     -0.8780000      0.9792000    
 C   -3.805900     -0.1079000      0.3114000    
 C   -2.707300      0.6535000     -9.8800004E-02
 C    1.738800      -1.071600     -0.2578000    
 C   -1.630700     -0.9754000      0.9284000    
 C    1.583900      0.1201000       1.838200    
 C    2.811600     -0.2648000     -0.6371000    
 C    3.270600      0.7343000      0.2213000    
 C    2.656700      0.9269000       1.458900    
 C   -5.124800      0.2777000      2.2200000E-02
 C   -2.939800       1.842700     -0.8236000    
 C   -5.327100       1.458800     -0.6966000    
 C   -4.250200       2.232600      -1.114800    
 H    1.119800      0.2876000       2.807300    
 H    3.295400     -0.4085000      -1.600400    
 H    2.987100       1.695400       2.153000    
 H   -5.970500     -0.3213000      0.3458000    
 H   -2.105700       2.454600      -1.155200    
 H   -6.340200       1.775300     -0.9308000    
 H   -4.426700       3.148100      -1.672800    


%chk=000077908-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077908

0 1
S -0.254620 -1.254962 2.193976
S -3.253924 -1.484325 1.357646
O 0.607450 -0.661065 -2.284902
O -0.219323 -2.096151 -0.720378
O 5.695618 1.603090 0.621643
O 4.984018 1.181129 -1.507606
N -1.600920 0.438632 0.437993
N 0.544352 -1.127356 -1.085312
N 4.834701 1.150640 -0.227175
C 1.206972 -0.568425 1.331120
C -3.902561 -0.211611 0.232213
C -2.858306 0.695024 -0.148863
C 1.454936 -0.526820 -0.069694
C -1.637439 -0.613298 1.216139
C 2.197248 -0.042067 2.201412
C 2.631193 0.051978 -0.584345
C 3.588360 0.552303 0.313177
C 3.395343 0.502219 1.710466
C -5.215816 -0.072365 -0.253968
C -3.139938 1.755572 -1.041086
C -5.478919 0.993776 -1.143855
C -4.451743 1.896021 -1.532964
H 2.003384 -0.042291 3.278208
H 2.795509 0.097585 -1.664005
H 4.159608 0.906092 2.378844
H -6.011894 -0.764077 0.036588
H -2.337940 2.440137 -1.331202
H -6.491526 1.121278 -1.540643
H -4.684723 2.710436 -2.226528


