%chk=000255364.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255364

0 1
S 2.419566 -1.467199 0.064781
O -0.063428 2.378979 0.475195
O 0.312713 -2.139265 -0.154743
N 0.197867 0.139259 -0.076022
N 2.450642 1.154317 -0.019211
C -2.696122 -0.036616 0.130306
C -2.013355 1.258134 -0.364771
C -1.891776 -1.235518 -0.425380
C -2.714797 -0.076463 1.663255
C -4.130795 -0.094562 -0.412096
C -0.572067 1.376837 0.059279
C -0.411440 -1.154428 -0.205417
C 1.616456 0.135418 -0.003450
C 3.959558 -0.648972 0.102671
C 3.789244 0.701171 0.048130
H -2.563458 2.150232 0.009830
H -2.070767 1.333654 -1.471963
H -2.071691 -1.349481 -1.518933
H -2.265367 -2.187149 0.017345
H -1.707360 -0.076822 2.096972
H -3.239882 0.789834 2.084283
H -3.224264 -0.970901 2.040725
H -4.737554 0.736097 -0.030381
H -4.168075 -0.044371 -1.505704
H -4.638500 -1.019123 -0.111494
H 4.879503 -1.201574 0.154382
H 4.559449 1.466509 0.049713


%chk=000255364-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255364

0 1
S 2.403149 -0.315825 1.601022
O 0.147427 2.320026 0.480624
O 0.209156 -2.226926 -0.590730
N 0.177602 0.062398 -0.122252
N 2.435422 0.301850 -0.994828
C -2.706757 -0.039104 0.139868
C -2.002221 1.317065 -0.125931
C -1.968747 -1.113560 -0.701285
C -2.650625 -0.395361 1.649009
C -4.182896 0.048113 -0.316070
C -0.499964 1.310446 0.116970
C -0.465988 -1.177903 -0.470239
C 1.601267 0.055176 -0.006046
C 3.965090 -0.094493 0.760346
C 3.767037 0.220544 -0.574844
H -2.422862 2.123170 0.499845
H -2.158623 1.616830 -1.183125
H -2.122912 -0.910802 -1.781671
H -2.364716 -2.125303 -0.506613
H -1.613121 -0.469978 2.024104
H -3.169837 0.374002 2.249216
H -3.145611 -1.365357 1.838258
H -4.725922 0.823462 0.255375
H -4.260989 0.299692 -1.390653
H -4.702594 -0.914399 -0.154155
H 4.902150 -0.210106 1.300508
H 4.560387 0.404340 -1.299400


