%chk=000110156.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110156

1 1
 S   -1.882800     -0.8065000      -1.105600    
 O   -1.116100       2.089100     -0.4808000    
 O    3.155000      -1.400000     -0.4057000    
 N    3.547700       1.311500      0.1277000    
 N    4.542100       1.699700      0.3534000    
 C   -3.888700      -1.842800      0.5406000    
 C   -2.484300      -1.239600      0.5533000    
 C   -4.960800     -0.8942000     -2.7000001E-03
 C  -0.2616000     -0.1478000     -0.7328000    
 C  -7.5199999E-02   1.208000     -0.4678000    
 C   0.8250000      -1.020700     -0.7112000    
 C   -6.348100      -1.509300      0.1032000    
 C    2.101200     -0.5365000     -0.4237000    
 C    1.200900       1.692000     -0.1802000    
 C    2.289100      0.8198000     -0.1581000    
 C   -1.381900       2.793800      0.7296000    
 C    3.095000      -2.476200      0.5281000    
 C   -2.859600       3.115500      0.7984000    
 C    4.503000      -2.855700      0.9343000    
 H   -4.147800      -2.122100       1.569700    
 H   -3.888300      -2.773000     -4.1700002E-02
 H   -1.789600      -1.960500      0.9978000    
 H   -2.474200     -0.3413000       1.180100    
 H   -4.771800     -0.6504000      -1.053200    
 H   -4.943200      4.6399999E-02  0.5595000    
 H   0.6852000      -2.077800     -0.9260000    
 H   -7.100300     -0.8172000     -0.2882000    
 H   -6.600900      -1.731200       1.144900    
 H   -6.409700      -2.439000     -0.4715000    
 H    1.358000       2.749400      1.8400000E-02
 H  -0.7997000       3.721600      0.7376000    
 H   -1.103400       2.192900       1.604500    
 H    2.601600      -3.331700      5.4099999E-02
 H    2.526600      -2.190200       1.421900    
 H   -3.097300       3.668900       1.711100    
 H   -3.165000       3.713000     -6.6900000E-02
 H   -3.455400       2.197400      0.7768000    
 H    5.013600      -2.003600       1.395100    
 H    5.092900      -3.144100      5.7999998E-02
 H    4.494700      -3.688100       1.643600    


%chk=000110156-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000110156

1 1
S -1.794915 -1.227174 0.037662
O -1.287810 1.798535 0.629078
O 3.382630 -1.296024 0.141901
N 3.561899 1.309544 0.660250
N 4.651205 1.722353 0.756499
C -4.467628 -1.213131 0.835698
C -3.274581 -0.247378 0.786248
C -4.995297 -1.661648 -0.547902
C -0.255951 -0.347254 0.287019
C -0.113153 1.074138 0.550232
C 0.905551 -1.153814 0.137895
C -6.253466 -2.547479 -0.431241
C 2.198508 -0.619656 0.253923
C 1.162070 1.631975 0.682892
C 2.315596 0.793512 0.537768
C -1.205958 3.273530 0.855843
C 3.368542 -2.772264 -0.156470
C -2.632155 3.807471 0.871005
C 4.820752 -3.217370 -0.237401
H -5.276545 -0.674197 1.371668
H -4.224480 -2.096960 1.457282
H -2.953958 0.087462 1.783888
H -3.453352 0.620156 0.136042
H -4.205001 -2.217771 -1.091820
H -5.223903 -0.765329 -1.158691
H 0.775624 -2.222110 -0.054099
H -6.612570 -2.861755 -1.426747
H -7.078172 -2.005684 0.067712
H -6.046563 -3.461452 0.155750
H 1.302015 2.696851 0.878956
H -0.612031 3.719494 0.033199
H -0.692799 3.449907 1.822287
H 2.832366 -2.917617 -1.113304
H 2.822526 -3.276177 0.663404
H -2.612375 4.898890 1.039028
H -3.138212 3.619974 -0.090740
H -3.221780 3.348798 1.682302
H 5.346295 -3.041396 0.715599
H 5.356450 -2.689452 -1.043366
H 4.856527 -4.299999 -0.453650


