%chk=000269933.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269933

0 1
O -5.241397 -0.036061 -0.000281
C 0.452689 0.057963 0.000033
C 2.581930 1.446070 0.000212
C 2.510460 -0.730416 1.261288
C 2.510563 -0.730252 -1.261154
C 1.038694 1.494737 0.000153
C 0.968479 -0.677819 1.267851
C 0.968583 -0.677657 -1.267837
C 3.076190 0.705577 1.260941
C 3.076291 0.705741 -1.260573
C 2.997269 -1.476792 0.000039
C -1.073295 0.045334 -0.000041
C -1.839184 1.223295 -0.000117
C -1.743958 -1.190562 -0.000048
C -3.232911 1.183126 -0.000198
C -3.137545 -1.266664 -0.000126
C -3.864678 -0.068825 -0.000202
H 2.980193 2.485375 0.000296
H 2.863465 -1.268069 2.169524
H 2.863644 -1.267787 -2.169432
H 0.685190 2.049924 0.886971
H 0.685266 2.050046 -0.886618
H 0.559476 -1.701425 1.315395
H 0.605273 -0.160817 2.173192
H 0.605451 -0.160538 -2.173143
H 0.559582 -1.701256 -1.315545
H 4.179205 0.683352 1.284799
H 2.758037 1.242840 2.170841
H 2.758212 1.243123 -2.170429
H 4.179309 0.683520 -1.284344
H 4.098566 -1.547989 0.000079
H 2.620464 -2.513798 -0.000044
H -1.354136 2.200169 -0.000113
H -1.168081 -2.117826 0.000011
H -3.831441 2.090598 -0.000259
H -3.638528 -2.228048 -0.000127
H -5.632729 -0.941888 -0.000293


%chk=000269933-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269933

0 1
O -5.352552 -0.027538 -0.000273
C 0.456129 0.050464 0.000031
C 2.600829 1.455451 0.000193
C 2.547619 -0.735216 1.268163
C 2.547726 -0.735086 -1.268005
C 1.048854 1.491784 0.000127
C 0.996300 -0.690655 1.270336
C 0.996407 -0.690530 -1.270303
C 3.104119 0.713710 1.267272
C 3.104224 0.713840 -1.266919
C 3.042614 -1.481960 0.000062
C -1.084757 0.042281 -0.000040
C -1.867263 1.227951 -0.000051
C -1.786140 -1.193651 -0.000113
C -3.277553 1.191277 -0.000129
C -3.194633 -1.252618 -0.000190
C -3.944237 -0.051879 -0.000198
H 2.985173 2.494818 0.000263
H 2.897182 -1.268248 2.174741
H 2.897367 -1.268026 -2.174606
H 0.693691 2.044827 0.893466
H 0.693775 2.044914 -0.893192
H 0.592764 -1.721699 1.305085
H 0.628528 -0.170263 2.177476
H 0.628709 -0.170049 -2.177422
H 0.592873 -1.721569 -1.305185
H 4.212550 0.697181 1.282746
H 2.770455 1.248319 2.179617
H 2.770635 1.248542 -2.179237
H 4.212657 0.697314 -1.282304
H 4.149814 -1.539820 0.000107
H 2.661237 -2.523620 -0.000008
H -1.378508 2.206444 0.000003
H -1.229035 -2.137885 -0.000109
H -3.871631 2.110404 -0.000137
H -3.704550 -2.225754 -0.000244
H -5.716773 -0.947157 -0.000322


