%chk=000089910.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000089910

0 1
S 3.039283 -0.223493 0.075509
O -2.420258 1.862322 -0.308881
O 3.195706 -1.507858 -0.569383
O 3.911840 0.892986 -0.224084
O -1.767624 -2.295669 0.141188
O -2.884084 -1.094208 -1.262065
N 3.204364 -0.518885 1.758830
N -1.956327 -1.268616 -0.487582
C 1.402550 0.298890 -0.094408
C 0.370687 -0.615589 -0.171522
C -0.977117 -0.192701 -0.316930
C 1.127115 1.685271 -0.170858
C -1.251409 1.193752 -0.320672
C -0.171216 2.128332 -0.277215
C -3.712954 1.202793 -0.248170
H 0.573547 -1.700195 -0.135775
H 1.959549 2.404200 -0.146519
H -0.413222 3.192521 -0.323846
H 3.349831 -1.477558 2.069834
H 3.798590 0.101985 2.303996
H -4.380066 2.063323 -0.095990
H -3.760349 0.509843 0.594329
H -3.920835 0.704454 -1.207186


%chk=000089910-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089910

0 1
S 3.102491 -0.323838 0.170642
O -2.510408 1.845572 -0.484807
O 3.139356 -1.876650 -0.316924
O 4.109665 0.826289 -0.387765
O -1.834575 -2.393837 -0.292375
O -2.885481 -0.911457 -1.676565
N 3.294337 -0.277925 1.999933
N -1.974791 -1.218783 -0.808417
C 1.346280 0.292160 -0.072907
C 0.331877 -0.647611 -0.229918
C -0.987824 -0.181577 -0.452202
C 1.122820 1.683485 -0.138364
C -1.282340 1.220167 -0.432601
C -0.191685 2.131209 -0.312163
C -3.767056 1.190590 -0.062981
H 0.539108 -1.722652 -0.238017
H 1.958701 2.384646 -0.054992
H -0.430977 3.197951 -0.328954
H 3.263252 -1.245335 2.363223
H 4.183979 0.206824 2.207231
H -4.412253 2.023927 0.251194
H -3.586559 0.504825 0.785340
H -4.210315 0.637920 -0.905010


