%chk=000249950.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249950

0 1
O -0.020940 -0.861858 -0.926280
O -2.519816 1.310404 -0.281572
O -5.468185 2.872653 0.275991
O -6.771382 5.306041 -1.197427
C 0.681302 -3.503106 -0.640087
C 0.252476 -3.950489 0.778809
C 4.655623 0.770931 -0.491659
C 4.648876 1.523885 0.860695
C 1.704981 -2.407068 -0.595826
C 3.631734 -0.329620 -0.524143
C 1.336409 -1.045261 -0.749355
C 2.275328 -0.012750 -0.720330
C 3.057980 -2.686597 -0.401384
C 4.016328 -1.665124 -0.364588
C -0.355297 -5.358909 0.729828
C -0.741745 -2.955108 1.387615
C 5.488744 2.803054 0.752236
C 5.169412 0.629045 1.990582
C -0.509067 0.494305 -1.149270
C -2.024555 0.300781 -1.193538
C -3.913922 1.137933 0.074010
C -4.233444 2.403441 0.870647
C -5.901638 4.161871 0.773317
C -7.129880 4.482682 -0.082401
H -0.210097 -3.168830 -1.211943
H 1.084489 -4.367724 -1.203597
H 1.163131 -3.982446 1.427635
H 5.669924 0.371175 -0.689228
H 4.462750 1.486507 -1.316635
H 3.593432 1.811860 1.096115
H 1.982013 1.024097 -0.838457
H 3.377368 -3.721635 -0.275510
H 5.061663 -1.917661 -0.209062
H -0.692039 -5.676727 1.722515
H 0.370398 -6.098648 0.377448
H -1.222938 -5.402488 0.063197
H -0.904555 -3.150681 2.451031
H -0.375043 -1.924152 1.285086
H -1.714226 -2.995669 0.887317
H 6.531267 2.583831 0.497692
H 5.495974 3.351285 1.700839
H 5.097072 3.480042 -0.013651
H 5.116220 1.137604 2.958521
H 4.577668 -0.291760 2.068718
H 6.211487 0.334355 1.830628
H -0.087521 0.870128 -2.094756
H -0.213569 1.141911 -0.300855
H -2.455013 0.488853 -2.190984
H -2.303527 -0.712498 -0.842551
H -4.018143 0.215712 0.668670
H -4.536746 1.076324 -0.839043
H -3.436679 3.162263 0.744645
H -4.403941 2.207032 1.941355
H -5.099190 4.907778 0.631559
H -6.145760 4.069338 1.844788
H -7.612209 3.554696 -0.446955
H -7.864282 5.105908 0.461402
H -6.151999 4.820682 -1.784904


%chk=000249950-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249950

0 1
O -0.055844 -0.903978 -0.512659
O -2.548790 1.754890 -0.225230
O -5.829226 3.384083 -0.017389
O -8.151327 4.264433 -1.377683
C 0.755004 -3.619740 -0.764973
C 0.625779 -4.430235 0.563978
C 4.675753 0.806265 -0.401848
C 4.802492 1.408336 1.033729
C 1.751469 -2.473324 -0.688998
C 3.675224 -0.335104 -0.513630
C 1.339744 -1.115519 -0.550752
C 2.282920 -0.065247 -0.465051
C 3.142250 -2.719526 -0.742750
C 4.094765 -1.678483 -0.656890
C -0.260463 -5.678018 0.341179
C 0.076480 -3.560941 1.717914
C 5.683711 2.678784 1.002353
C 5.358920 0.373331 2.037769
C -0.538051 0.475576 -0.389680
C -2.062875 0.381881 -0.387162
C -4.012744 1.830777 -0.222217
C -4.365185 3.301970 -0.008407
C -6.329729 4.750765 0.213008
C -7.840943 4.677283 -0.006595
H -0.243612 -3.236141 -1.041729
H 1.072691 -4.320667 -1.562973
H 1.644383 -4.772536 0.845791
H 5.678255 0.458508 -0.721739
H 4.386288 1.624745 -1.092184
H 3.783484 1.698606 1.366491
H 1.951841 0.974556 -0.368403
H 3.482474 -3.755879 -0.863115
H 5.165380 -1.908380 -0.706824
H -0.335388 -6.283682 1.263615
H 0.145108 -6.324959 -0.459815
H -1.286708 -5.381576 0.049229
H 0.016742 -4.144076 2.656070
H 0.720014 -2.681489 1.898157
H -0.938228 -3.191391 1.475614
H 6.705720 2.436685 0.651412
H 5.771929 3.127440 2.009247
H 5.265513 3.444961 0.322311
H 5.402833 0.796618 3.058559
H 4.732477 -0.535887 2.068592
H 6.385771 0.070346 1.753173
H -0.191059 1.091485 -1.242936
H -0.182169 0.934422 0.553997
H -2.425533 -0.056306 -1.341048
H -2.407319 -0.260480 0.451009
H -4.438377 1.211506 0.595592
H -4.427175 1.471636 -1.188451
H -3.930894 3.924103 -0.819075
H -3.958763 3.653755 0.963018
H -5.865175 5.448960 -0.515864
H -6.085452 5.084119 1.245160
H -8.285753 3.975926 0.730393
H -8.298216 5.672441 0.123101
H -7.603714 3.455973 -1.557493


