%chk=000117947.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000117947

0 1
P 1.186386 0.937539 0.038698
P -1.195827 -0.986228 0.540463
O -0.313989 0.405081 0.483371
O 1.748110 -0.237747 -0.917005
O -2.328870 -0.579359 1.608713
O 1.983777 0.716702 1.464016
O -1.959867 -0.906498 -0.916041
O 1.140078 2.293878 -0.490308
O -0.415181 -2.202652 0.779885
C 2.376787 -1.424108 -0.328341
C -3.035498 0.691278 1.405904
C 3.805572 -1.116718 0.065844
C -4.152922 0.515825 0.400466
H 1.766801 -1.819664 0.511575
H 2.313386 -2.120895 -1.189527
H -3.415076 0.865818 2.434273
H -2.320190 1.490027 1.129008
H 4.376240 -2.040106 0.227396
H 4.324660 -0.539901 -0.712009
H 3.863509 -0.534549 0.999380
H -4.826139 1.381569 0.398396
H -3.777223 0.393404 -0.629748
H -4.756100 -0.376204 0.620950
H 1.857968 1.398488 2.169016
H -1.529089 -1.356780 -1.685571


%chk=000117947-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117947

0 1
P 1.326949 0.456265 1.354063
P -1.527914 -0.919252 1.774938
O -0.307029 0.407399 1.812777
O 1.279355 -0.822030 0.182592
O -2.949216 -0.004902 1.721017
O 2.245868 -0.359078 2.556959
O -1.287884 -1.481836 0.178290
O 1.865450 1.880485 0.930169
O -1.439321 -1.924997 2.981145
C 2.555533 -1.360663 -0.404457
C -3.214505 0.986131 0.620667
C 3.141322 -0.407511 -1.445936
C -3.991865 0.329082 -0.517936
H 3.249341 -1.562890 0.430502
H 2.236364 -2.318189 -0.847174
H -3.803536 1.761020 1.137622
H -2.257379 1.424931 0.284566
H 4.043186 -0.865686 -1.893055
H 2.416209 -0.211129 -2.253580
H 3.431421 0.556759 -0.994296
H -4.265218 1.097132 -1.266318
H -3.385908 -0.447692 -1.012921
H -4.921263 -0.129337 -0.139746
H 2.580717 0.211535 3.294845
H -0.303374 -1.447345 -0.075930


