%chk=000184679.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184679

0 1
S 4.951294 -0.473702 0.352062
O 3.720510 0.062523 -0.688802
O -5.625183 -0.486890 -1.042784
O -4.378279 -1.978963 0.063506
O 6.074384 -0.196763 -0.836313
O 5.126380 0.459906 1.401877
O 4.803578 -1.870116 0.565477
C -2.590863 0.555314 0.186753
C -4.073661 0.453237 0.469048
C -0.343573 -0.383758 0.127562
C 0.171534 0.863505 -0.317096
C -1.743429 -0.512661 0.377971
C -2.070885 1.808941 -0.263617
C -0.729761 1.959003 -0.507712
C -4.350732 0.445741 1.973983
C 0.549532 -1.489693 0.315220
C 1.572601 0.999527 -0.559605
C 2.383055 -0.094159 -0.363509
C 1.892998 -1.359550 0.075918
C -4.643205 -0.818502 -0.137401
H -4.608842 1.328419 0.004465
H -2.132323 -1.479587 0.714572
H -2.756202 2.644042 -0.409748
H -0.327647 2.912207 -0.850449
H -3.925315 -0.442654 2.462260
H -3.902174 1.324234 2.456754
H -5.425962 0.462150 2.189473
H 1.983095 1.948589 -0.898213
H 0.136164 -2.443710 0.649826
H 2.579884 -2.201991 0.202110
H -6.039760 -1.280612 -1.475621
H 5.713188 0.077774 -1.708066


%chk=000184679-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184679

0 1
S 5.169314 -0.023750 0.574130
O 3.659814 -0.110900 -0.964701
O -5.585267 -0.202457 -1.216797
O -4.694061 -1.895734 0.098278
O 6.355511 -0.451873 -0.763242
O 5.594932 1.421057 1.155645
O 5.027529 -1.267778 1.598195
C -2.655744 0.562591 0.214757
C -4.138283 0.472449 0.598424
C -0.420716 -0.459156 0.012501
C 0.124792 0.820870 -0.410578
C -1.808152 -0.555802 0.317226
C -2.114796 1.820287 -0.212327
C -0.760083 1.948429 -0.517539
C -4.312477 0.266141 2.129090
C 0.462255 -1.595107 0.123018
C 1.514004 0.925518 -0.690399
C 2.356599 -0.215104 -0.601961
C 1.813161 -1.486047 -0.171035
C -4.805367 -0.676482 -0.157135
H -4.640898 1.404208 0.289736
H -2.220968 -1.522889 0.628101
H -2.781099 2.685808 -0.299211
H -0.354194 2.913401 -0.841636
H -3.875412 -0.696817 2.441874
H -3.808443 1.078877 2.679300
H -5.381828 0.266240 2.404923
H 1.958071 1.880778 -0.992285
H 0.043685 -2.554889 0.446262
H 2.493861 -2.338720 -0.088504
H -5.988345 -0.972171 -1.704988
H 5.763008 -0.649177 -1.549222


