%chk=000219701.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219701

0 1
O 0.191563 -1.368203 0.486236
O 0.811383 1.726123 -0.046764
O -1.440478 1.268147 0.344283
O 2.447821 -0.811553 0.665892
O -3.718328 -0.760272 -0.092676
C -0.052904 -0.535054 -0.666221
C 1.027165 0.554684 -0.862379
C -1.463859 0.057802 -0.446257
C 2.435331 0.091369 -0.451814
C -2.372214 -0.874567 0.375505
C -0.513021 2.249283 -0.106411
C 1.521821 -1.884780 0.560502
H -0.061396 -1.212311 -1.554585
H 1.021627 0.895554 -1.925285
H -1.928214 0.304899 -1.429575
H 2.965153 -0.383579 -1.295249
H 3.021523 0.948664 -0.051458
H -2.307540 -0.631238 1.453624
H -2.127007 -1.942602 0.218942
H -0.532963 3.030142 0.675132
H -0.758335 2.588380 -1.124115
H 1.742765 -2.523362 -0.307625
H 1.562549 -2.383905 1.545381
H -4.097240 0.103079 0.179917


%chk=000219701-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219701

0 1
O 0.254785 -1.260255 0.749680
O 0.799683 1.720498 0.081081
O -1.533081 1.183877 0.411072
O 2.599630 -0.654425 0.693353
O -3.842118 -0.382127 -0.001577
C -0.025367 -0.573227 -0.520976
C 1.008454 0.560216 -0.800325
C -1.457086 -0.008635 -0.469678
C 2.445151 0.061370 -0.583607
C -2.507518 -0.979334 0.079811
C -0.574624 2.191948 -0.007077
C 1.635261 -1.733776 0.780382
H 0.041369 -1.312023 -1.355935
H 0.886514 0.883538 -1.862124
H -1.740803 0.305167 -1.500832
H 2.725267 -0.609766 -1.426510
H 3.140832 0.912590 -0.537058
H -2.239088 -1.250952 1.117790
H -2.549158 -1.892340 -0.536785
H -0.662630 3.028280 0.698628
H -0.795626 2.499817 -1.058286
H 1.794405 -2.449438 -0.063936
H 1.778233 -2.208577 1.759667
H -3.807283 0.474275 0.498243


