%chk=000228972.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228972

0 1
O 3.078836 2.397188 0.186965
C 2.155624 0.168908 0.196989
C 3.900384 -1.571569 -0.526349
C 2.524176 -0.936385 -0.806443
C 4.991955 -0.482538 -0.493724
C 0.815237 0.836282 -0.154360
C 4.671565 0.652680 0.480314
C 3.276861 1.205014 0.261011
C -0.385854 -0.051200 0.190649
C 3.894264 -2.410951 0.754815
C -1.708756 0.643420 -0.160686
C -2.915250 -0.240615 0.182413
C -4.237381 0.455245 -0.168575
C -5.444516 -0.428082 0.173593
C -6.767506 0.267375 -0.177213
C -7.972892 -0.607152 0.161046
H 2.077395 -0.284491 1.218985
H 4.134094 -2.258234 -1.380821
H 2.514001 -0.522248 -1.833962
H 1.739097 -1.716879 -0.792442
H 5.967310 -0.932850 -0.227072
H 5.121220 -0.065656 -1.512739
H 0.740031 1.805545 0.385082
H 0.797699 1.109381 -1.227170
H 4.759539 0.301995 1.528248
H 5.415492 1.469480 0.377190
H -0.313090 -1.015161 -0.348971
H -0.371044 -0.305758 1.268013
H 4.861904 -2.898468 0.916484
H 3.133495 -3.198153 0.711613
H 3.683921 -1.803057 1.641332
H -1.724679 0.901678 -1.237188
H -1.782329 1.607520 0.379372
H -2.900183 -0.496907 1.259301
H -2.842625 -1.203929 -0.358015
H -4.252647 0.713218 -1.245075
H -4.310432 1.418516 0.372394
H -5.373131 -1.391541 -0.366542
H -5.430993 -0.685946 1.249952
H -6.783218 0.524757 -1.254377
H -6.841205 1.230719 0.364462
H -8.008769 -0.849162 1.229284
H -8.911748 -0.102408 -0.092566
H -7.950954 -1.554881 -0.388717


%chk=000228972-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228972

0 1
O 3.156636 2.467911 0.009298
C 2.204035 0.206159 0.167831
C 3.978488 -1.595699 -0.483163
C 2.600079 -0.955212 -0.800921
C 5.075760 -0.497328 -0.472039
C 0.841375 0.846781 -0.178954
C 4.733374 0.670792 0.496298
C 3.343447 1.236743 0.210326
C -0.372571 -0.066205 0.104773
C 3.959206 -2.424275 0.824735
C -1.721436 0.634290 -0.177218
C -2.949591 -0.255809 0.116928
C -4.295996 0.452222 -0.156779
C -5.527924 -0.428830 0.149673
C -6.872561 0.285632 -0.118323
C -8.099395 -0.597057 0.197460
H 2.142083 -0.226168 1.192545
H 4.216014 -2.296907 -1.310328
H 2.614433 -0.550636 -1.834026
H 1.811351 -1.730926 -0.772506
H 6.053345 -0.933861 -0.189953
H 5.189709 -0.086942 -1.495189
H 0.737482 1.787443 0.395342
H 0.844200 1.148331 -1.245910
H 4.753817 0.296467 1.540246
H 5.472522 1.486579 0.418012
H -0.315521 -0.989890 -0.506951
H -0.347726 -0.391995 1.166612
H 4.937007 -2.911798 0.994638
H 3.189868 -3.216967 0.775424
H 3.738773 -1.803835 1.712854
H -1.749089 0.959876 -1.238163
H -1.784699 1.560123 0.431743
H -2.918527 -0.584673 1.177063
H -2.890580 -1.179688 -0.496222
H -4.330683 0.774545 -1.218681
H -4.349831 1.380309 0.450213
H -5.479449 -1.355757 -0.459733
H -5.492788 -0.753520 1.210939
H -6.908839 0.606064 -1.179693
H -6.917149 1.213811 0.487422
H -8.104196 -0.902929 1.260833
H -9.046630 -0.063921 -0.004832
H -8.092926 -1.518548 -0.415125


