%chk=000179100.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179100

0 1
O -1.738227 1.790526 -0.765192
O 1.806274 -2.771126 0.561649
O 3.938689 -3.272256 0.085457
O -4.549599 -1.619333 0.920464
O -5.087106 -2.310418 -1.151463
C 0.253941 1.664397 0.553762
C 1.632750 0.968620 0.726585
C 1.744252 -0.407253 0.016320
C -0.285561 1.620744 -0.921777
C 1.336092 -0.279968 -1.465609
C -0.899815 0.967175 1.334434
C -0.084912 0.255071 -1.605131
C 2.770854 1.873160 0.183869
C -2.169071 1.301442 0.525499
C 0.317389 3.110424 1.079838
C 3.169425 -0.930262 0.122730
C 0.967478 -1.577816 0.688027
C 0.128252 2.775596 -1.820589
C 4.180957 1.304122 0.395153
C 4.264600 -0.181256 0.261729
C 3.114106 -2.410590 0.219665
C -3.084488 0.132517 0.331580
C -3.708060 -0.583925 1.514210
C -3.525926 -0.419713 -0.808707
C -4.457476 -1.536203 -0.492537
H 1.801980 0.815194 1.819865
H 1.420763 -1.264994 -1.968571
H 2.052954 0.379437 -1.994313
H -0.970895 1.333935 2.371486
H -0.749084 -0.119196 1.416818
H -0.358751 0.332162 -2.676252
H -0.813029 -0.470922 -1.188319
H 2.722233 2.871612 0.662846
H 2.601385 2.050442 -0.900395
H -2.741382 2.158246 0.957288
H -0.648721 3.617333 0.954241
H 0.571013 3.138956 2.144953
H 1.060801 3.720844 0.553735
H 0.803528 -1.437699 1.767288
H 0.030211 -1.854972 0.179665
H -0.264304 3.733249 -1.454635
H 1.219732 2.848074 -1.898117
H -0.277366 2.654495 -2.834301
H 4.549983 1.579035 1.409609
H 4.885629 1.790878 -0.312971
H 5.263145 -0.621935 0.332666
H -2.986267 -1.111746 2.158780
H -4.381912 0.048633 2.116634
H -3.298664 -0.142236 -1.827869


%chk=000179100-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179100

0 1
O -1.786832 1.752618 -0.837059
O 2.013687 -2.833867 0.246172
O 4.293484 -3.145194 -0.168697
O -4.870777 -1.401869 1.094307
O -5.430715 -2.197737 -1.043283
C 0.240213 1.625194 0.488158
C 1.656910 0.963470 0.699906
C 1.848213 -0.410449 -0.028987
C -0.297344 1.573205 -0.997162
C 1.414239 -0.294893 -1.525608
C -0.892171 0.844043 1.236633
C -0.046524 0.186564 -1.652001
C 2.829787 1.912482 0.285569
C -2.199104 1.274701 0.499791
C 0.218458 3.074408 1.048505
C 3.298494 -0.879992 0.078991
C 1.154709 -1.661073 0.608358
C 0.124212 2.708399 -1.941771
C 4.234741 1.367134 0.636355
C 4.375681 -0.109205 0.368500
C 3.342243 -2.367757 0.017740
C -3.233448 0.186422 0.394956
C -3.935743 -0.385699 1.616284
C -3.723573 -0.420853 -0.720021
C -4.748590 -1.429958 -0.347847
H 1.761292 0.783210 1.793682
H 1.525719 -1.279806 -2.017772
H 2.097683 0.395195 -2.054511
H -0.921615 1.112279 2.307469
H -0.759355 -0.246182 1.167469
H -0.331819 0.245611 -2.718813
H -0.729690 -0.554990 -1.197229
H 2.710694 2.890729 0.779839
H 2.783386 2.102753 -0.802603
H -2.656176 2.141116 1.025389
H -0.802407 3.493533 1.011437
H 0.553007 3.078487 2.103290
H 0.867552 3.764374 0.486987
H 1.119721 -1.597442 1.712623
H 0.159129 -1.897685 0.204846
H -0.076519 3.699778 -1.506510
H 1.194252 2.644885 -2.204636
H -0.461039 2.630549 -2.874702
H 4.461585 1.542998 1.710305
H 5.007878 1.934088 0.080006
H 5.359618 -0.585232 0.479932
H -3.244975 -0.883168 2.323107
H -4.521138 0.376888 2.164262
H -3.449234 -0.209566 -1.751560


