%chk=000282012.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282012

0 1
S 1.594542 -0.112850 0.046585
O 1.674146 -1.366266 0.757125
O 1.612456 -0.055298 -1.396656
O -1.453797 -1.519818 -0.697260
O -2.766484 -0.520479 0.825335
N -1.750806 2.032929 -0.162907
N 2.930240 0.826144 0.590217
C 0.218992 0.810725 0.653247
C -0.978224 0.780757 -0.299443
C -1.846986 -0.447753 0.046103
H -0.068916 0.486792 1.677261
H 0.508543 1.882865 0.814866
H -0.626900 0.691697 -1.374997
H -2.203038 2.103012 0.747297
H -2.470736 2.109402 -0.876770
H 3.485296 1.318510 -0.108251
H 3.559391 0.410095 1.275341
H -1.950419 -2.358765 -0.483792


%chk=000282012-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282012

0 1
S 1.622149 -0.057625 -0.027296
O 1.342864 -1.513110 0.651903
O 1.900970 0.120392 -1.622651
O -1.573674 -1.489344 -0.865136
O -2.183447 -0.733345 1.253051
N -2.037044 1.922500 -0.046409
N 3.038372 0.716404 0.882733
C 0.197364 1.154828 0.448524
C -1.099261 0.828507 -0.323232
C -1.667662 -0.530109 0.131656
H 0.100369 1.047415 1.540448
H 0.586103 2.141135 0.159882
H -0.877808 0.787760 -1.402392
H -2.520610 1.845135 0.853269
H -2.640054 2.195305 -0.824233
H 3.750054 0.992937 0.184549
H 3.393263 0.021537 1.561989
H -1.864647 -2.378622 -0.523355


