%chk=000198389.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198389

0 1
O -1.712860 -1.154170 -0.555344
O -1.442642 -0.000373 1.429100
O -1.712825 1.154455 -0.554750
C 0.406837 0.000011 -0.163805
C 1.933170 0.000050 -0.407130
C -0.280681 -1.236405 -0.796147
C 0.010293 -0.000097 1.330059
C -0.280707 1.236499 -0.795977
C -2.095192 -0.000038 0.172296
C 2.603014 1.255062 0.164070
C 2.603033 -1.255109 0.163725
H 2.090369 0.000205 -1.517980
H -0.173776 -1.280601 -1.891963
H 0.029887 -2.189950 -0.337809
H 0.334228 -0.906252 1.867038
H 0.333937 0.906149 1.867063
H 0.030069 2.190026 -0.337747
H -0.174065 1.280649 -1.891822
H -3.181918 -0.000060 0.320159
H 2.497561 1.320729 1.252861
H 3.678953 1.256111 -0.051363
H 2.191862 2.175786 -0.263812
H 2.497584 -1.321071 1.252499
H 3.678971 -1.256083 -0.051714
H 2.191897 -2.175724 -0.264403


%chk=000198389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198389

0 1
O -1.778818 -1.195450 -0.589239
O -1.523874 -0.000287 1.473376
O -1.778866 1.195661 -0.588778
C 0.369748 0.000059 -0.140277
C 1.916912 0.000133 -0.389835
C -0.300231 -1.246905 -0.785734
C -0.031927 0.000190 1.359118
C -0.300364 1.246818 -0.785994
C -2.138977 -0.000045 0.154640
C 2.630049 1.266044 0.154438
C 2.630018 -1.266237 0.153411
H 2.042843 0.000571 -1.494756
H -0.103561 -1.279238 -1.875098
H 0.052298 -2.184838 -0.322016
H 0.336332 -0.901742 1.881103
H 0.335790 0.902527 1.880792
H 0.052465 2.184916 -0.322845
H -0.104139 1.278647 -1.875457
H -3.224720 -0.000091 0.290562
H 2.551217 1.336317 1.255333
H 3.705698 1.220609 -0.095446
H 2.231155 2.200193 -0.278106
H 2.550981 -1.337541 1.254227
H 3.705710 -1.220510 -0.096234
H 2.231261 -2.200003 -0.280082


