%chk=000188581.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188581

0 1
O 2.174874 3.151471 0.001691
O -0.434007 4.023941 -0.001280
C 0.371995 0.054625 -0.000304
C -1.007346 0.469849 -0.000246
C 0.752573 -1.377085 -0.000296
C 1.456781 0.881159 -0.000220
C -2.003482 -0.553037 -0.000055
C 2.229079 -1.352810 -0.000217
C 2.658629 0.030144 -0.000079
C -1.315055 1.820549 -0.000268
C -1.627543 -1.948305 -0.000090
C -0.202404 -2.327310 -0.000249
C -3.362819 -0.156144 0.000189
C 1.286306 2.340858 -0.000015
C -0.217459 2.839771 -0.000861
C -2.686904 2.201425 0.000042
C -3.675191 1.241933 0.000264
C 3.161937 -2.371850 -0.000208
C 4.002119 0.353924 0.000073
C -2.631460 -2.896600 0.000074
C -4.365153 -1.177889 0.000381
C -4.000844 -2.502705 0.000308
C 4.530875 -2.029032 -0.000050
C 4.940688 -0.698335 0.000075
H 0.033581 -3.391213 -0.000194
H -2.928893 3.268392 -0.000005
H -4.725379 1.537065 0.000452
H 2.858826 -3.415965 -0.000296
H 4.325556 1.395899 0.000178
H -2.397354 -3.961162 0.000043
H -5.414739 -0.885091 0.000575
H -4.761889 -3.284890 0.000453
H 5.274552 -2.825081 -0.000049
H 6.003849 -0.457501 0.000184


%chk=000188581-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188581

0 1
O 2.223277 3.196541 0.001320
O -0.451452 4.084103 0.001924
C 0.363623 0.050739 -0.000914
C -1.008554 0.459080 -0.000665
C 0.764857 -1.350990 -0.000535
C 1.478324 0.894041 -0.001546
C -2.016174 -0.552954 -0.000363
C 2.244288 -1.342884 -0.000197
C 2.678378 0.036685 -0.000603
C -1.335117 1.835815 -0.000293
C -1.633417 -1.949476 -0.000436
C -0.218657 -2.326681 -0.000423
C -3.398848 -0.156746 0.000103
C 1.288055 2.339640 -0.003017
C -0.221136 2.844736 -0.000464
C -2.707370 2.221252 0.000421
C -3.715342 1.245520 0.000502
C 3.189185 -2.384607 0.000475
C 4.049735 0.357998 -0.000429
C -2.660886 -2.918888 -0.000195
C -4.403633 -1.182758 0.000291
C -4.033622 -2.533828 0.000107
C 4.568989 -2.055243 0.000720
C 4.991125 -0.702313 0.000273
H 0.029541 -3.394867 -0.000057
H -2.950873 3.288382 0.000732
H -4.768704 1.547945 0.000924
H 2.875620 -3.434565 0.000831
H 4.371117 1.403419 -0.000903
H -2.399340 -3.983433 -0.000178
H -5.462035 -0.898584 0.000630
H -4.806679 -3.309112 0.000304
H 5.317427 -2.855013 0.001244
H 6.062601 -0.473953 0.000419


