%chk=000116725.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116725

0 1
P -0.568584 0.633106 -0.034586
O 0.813927 0.712126 0.818290
O -1.203749 -0.807327 0.474169
O -1.497570 1.641295 0.875107
O -0.507337 0.867189 -1.486703
C 4.085711 0.079692 -0.049190
C 2.992315 1.593177 1.252926
C 2.674142 0.156196 -0.731861
C 1.966304 1.268236 0.115691
C 3.666135 0.197034 1.455852
C 4.766908 1.439490 -0.236478
C 4.123623 2.335324 0.535751
C 2.696732 0.482205 -2.213345
C -0.562513 -1.966466 0.036928
C -2.838975 1.782874 0.500085
C -0.294144 -2.217734 -1.314222
C -3.224146 2.159016 -0.791696
C -0.289076 -2.898589 1.048669
C -3.754221 1.622298 1.549700
C 0.272959 -3.450842 -1.648866
C -4.585247 2.374608 -1.027948
C 0.270965 -4.123138 0.683425
C -5.105184 1.850859 1.284897
C 0.555908 -4.398812 -0.659959
C -5.521339 2.223719 0.000591
H 4.676354 -0.793843 -0.331560
H 2.556693 2.066578 2.135786
H 2.162441 -0.823202 -0.577471
H 1.669404 2.161360 -0.464303
H 2.967955 -0.578950 1.793449
H 4.512717 0.215153 2.150319
H 5.601225 1.573803 -0.894088
H 4.298723 3.381969 0.673028
H 3.193148 -0.306281 -2.789277
H 1.671129 0.583605 -2.608458
H 3.219068 1.421631 -2.427786
H -0.527229 -1.485492 -2.092387
H -2.495722 2.279681 -1.597681
H -0.522300 -2.656373 2.083741
H -3.400917 1.330166 2.536672
H 0.490782 -3.672791 -2.693898
H -4.914759 2.665144 -2.025765
H 0.488451 -4.867039 1.449690
H -5.838414 1.735007 2.082710
H 0.995294 -5.355423 -0.934947
H -6.577285 2.395959 -0.197498


%chk=000116725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116725

0 1
P -0.511091 0.454832 -0.122010
O 0.957549 0.576761 0.734624
O -1.166296 -1.042875 0.456434
O -1.494284 1.539725 0.787021
O -0.448074 0.671782 -1.697399
C 4.367779 0.399193 -0.013057
C 3.051956 1.719566 1.298717
C 2.985094 0.385658 -0.786766
C 2.110783 1.329341 0.111274
C 3.856890 0.390130 1.464220
C 4.921268 1.831223 -0.102887
C 4.127993 2.622991 0.675472
C 3.038297 0.788320 -2.270055
C -0.687892 -2.313710 0.005878
C -2.879898 1.767997 0.503064
C -0.360052 -2.568213 -1.345130
C -3.381505 1.861611 -0.813734
C -0.627852 -3.323731 0.988621
C -3.701641 1.967750 1.630895
C 0.048396 -3.873390 -1.704317
C -4.753446 2.153552 -0.990104
C -0.230238 -4.624088 0.607383
C -5.066719 2.271190 1.433715
C 0.113419 -4.902397 -0.736869
C -5.597520 2.360961 0.125190
H 5.050964 -0.408337 -0.316614
H 2.511160 2.114621 2.169503
H 2.559888 -0.634012 -0.701926
H 1.706634 2.199014 -0.435562
H 3.214805 -0.475900 1.703576
H 4.669875 0.480707 2.203056
H 5.747542 2.148190 -0.744623
H 4.168594 3.709336 0.788105
H 3.656744 0.078187 -2.850129
H 2.021325 0.793608 -2.702069
H 3.470531 1.797998 -2.394429
H -0.429061 -1.771682 -2.093309
H -2.718990 1.711821 -1.672597
H -0.892268 -3.080150 2.021645
H -3.266956 1.883190 2.630982
H 0.306167 -4.083721 -2.748168
H -5.157778 2.225429 -2.005708
H -0.185004 -5.416159 1.362720
H -5.713834 2.430253 2.303117
H 0.424932 -5.911380 -1.027070
H -6.657885 2.591011 -0.023176


