%chk=000243977.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243977

0 1
S 0.657758 -3.069873 0.000139
O 0.920231 1.421395 0.000077
C -0.466336 -0.605146 0.000099
C -0.326123 0.796827 0.000046
C 2.052862 0.613009 0.000135
C 0.726462 -1.441616 0.000219
C 1.985856 -0.738189 0.000184
C -1.781685 -1.120609 0.000037
C -1.415313 1.682177 -0.000065
C -2.875303 -0.261104 -0.000060
C -2.693702 1.133931 -0.000111
C 3.247560 1.486216 0.000105
H 2.898703 -1.342745 0.000199
H -1.930517 -2.206605 0.000092
H -1.246300 2.756561 -0.000100
H -3.885453 -0.669338 -0.000097
H -3.564890 1.791226 -0.000189
H 3.265016 2.147323 0.883851
H 3.265062 2.147198 -0.883734
H 4.184412 0.907863 0.000171


%chk=000243977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243977

0 1
S 0.684372 -3.160595 0.000242
O 0.917702 1.456965 0.000008
C -0.478263 -0.589816 0.000040
C -0.346273 0.828713 -0.000013
C 2.068285 0.656548 0.000098
C 0.728294 -1.443288 0.000097
C 1.985198 -0.719501 0.000151
C -1.799430 -1.120885 0.000032
C -1.460097 1.694505 -0.000079
C -2.919904 -0.275544 -0.000033
C -2.751050 1.136923 -0.000089
C 3.316866 1.485976 0.000129
H 2.911144 -1.299376 0.000232
H -1.898775 -2.211989 0.000072
H -1.295847 2.776004 -0.000117
H -3.927865 -0.702866 -0.000042
H -3.626016 1.795492 -0.000138
H 3.350959 2.140820 0.890022
H 3.351078 2.140712 -0.889840
H 4.207920 0.839704 0.000227


