%chk=000188039.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188039

0 1
S 3.476937 -0.141143 -0.000882
O 3.552080 -0.836499 1.259246
O 3.544963 -0.826082 -1.267192
O 0.739703 -1.109322 0.003350
N -0.416654 0.890705 0.003554
C 2.021184 0.914335 0.007017
C 0.753181 0.100469 0.004314
C 4.746580 1.077370 0.000749
C -1.763535 0.394961 0.001152
C -2.798970 1.353670 0.001319
C -2.063314 -0.977310 -0.001297
C -4.126524 0.923982 -0.000967
C -3.399043 -1.382652 -0.003550
C -4.432766 -0.440652 -0.003399
H 2.041497 1.589370 -0.871628
H 2.043267 1.579037 0.893530
H 5.746666 0.612419 -0.003718
H 4.741528 1.728401 -0.880127
H 4.746077 1.721184 0.886935
H -0.324751 1.907102 0.004734
H -2.577615 2.416810 0.003188
H -1.262383 -1.725197 -0.001461
H -4.929554 1.660665 -0.000850
H -3.633466 -2.447890 -0.005451
H -5.469688 -0.767731 -0.005165


%chk=000188039-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188039

0 1
S 2.914365 0.640273 -0.630458
O 3.402994 -0.668014 -1.466887
O 1.791130 1.679667 -1.270520
O 0.366853 -1.174792 2.016471
N -0.111872 0.268481 0.201059
C 2.184675 0.084780 1.114864
C 0.705139 -0.341750 1.119349
C 4.449828 1.715362 -0.237312
C -1.514344 0.079616 0.019198
C -2.121491 0.799247 -1.045421
C -2.300460 -0.773920 0.838617
C -3.503081 0.668944 -1.287979
C -3.683432 -0.892834 0.580205
C -4.293637 -0.178225 -0.475742
H 2.347487 0.964879 1.761146
H 2.817437 -0.762825 1.416017
H 4.840212 2.003389 -1.223435
H 4.099959 2.583674 0.337208
H 5.157189 1.081478 0.315556
H 0.359625 0.922297 -0.466586
H -1.508209 1.450367 -1.680213
H -1.829261 -1.327979 1.652426
H -3.961018 1.226476 -2.112261
H -4.287175 -1.552708 1.213282
H -5.367513 -0.279880 -0.665182


