%chk=000220527.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220527

0 1
S -2.228392 0.048634 0.110827
O -2.737527 -1.030278 0.904695
O -2.520038 1.435989 0.382788
O 2.204169 2.318895 0.172967
O 2.377952 -2.250835 -0.220916
N 0.213701 1.169214 0.139984
N 2.318433 0.012229 -0.027996
N -2.651877 -0.253463 -1.508953
C -0.449324 -0.050776 0.059173
C 0.205854 -1.223517 -0.055569
C 1.642919 1.247032 0.101613
C 1.675112 -1.273140 -0.111199
H -0.316591 2.050247 0.267120
H -0.293184 -2.195746 -0.104510
H 3.348916 0.044157 -0.059843
H -2.995609 0.510246 -2.089266
H -3.135714 -1.116989 -1.750416


%chk=000220527-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220527

0 1
S -2.273345 -0.016272 0.096726
O -2.843975 -1.351911 0.814503
O -2.569938 1.514032 0.586571
O 2.213124 2.377760 -0.023716
O 2.509566 -2.306694 -0.004771
N 0.232745 1.117092 0.027464
N 2.318191 0.025698 -0.035811
N -2.681202 -0.035900 -1.674325
C -0.362850 -0.122455 0.052785
C 0.288709 -1.316213 0.054311
C 1.646031 1.260946 -0.012453
C 1.762681 -1.293458 0.006109
H -0.341214 1.965688 0.131560
H -0.227531 -2.275345 0.104070
H 3.341543 0.081781 -0.069048
H -3.289323 0.769527 -1.891054
H -3.064413 -0.952379 -1.952421


