%chk=000219261.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219261

0 1
O -1.435264 -2.345620 0.916153
O 0.873907 -1.447894 1.197389
O 8.503714 0.139661 -1.264106
O -5.254355 -1.821379 -0.173810
O -3.723690 -3.146687 0.593943
O -2.256368 3.515144 -1.061205
O -4.269228 2.751908 -1.308502
N 5.166986 0.075857 0.365847
N 1.475857 0.695192 0.746852
N -4.114634 -2.077392 0.179674
N -3.100655 2.635140 -0.993531
C 3.749786 0.142529 -0.100449
C 2.885072 0.445285 1.142316
C -0.854934 -0.059074 0.368930
C 6.131626 0.094188 -0.773136
C 0.542416 -0.316216 0.787881
C -1.778286 -1.158991 0.475036
C -1.310165 1.162305 -0.108571
C -3.142015 -0.970983 0.084796
C -2.655597 1.327273 -0.488522
C 7.555523 0.175364 -0.191938
C -3.571492 0.266401 -0.392154
H 3.647975 0.959900 -0.847615
H 3.397747 -0.788181 -0.596719
H 3.272601 1.342812 1.678329
H 2.925043 -0.408112 1.862908
H 5.304426 -0.782185 0.915819
H 1.258477 1.618048 0.382451
H 5.933214 0.987633 -1.404265
H 6.054564 -0.787584 -1.446445
H -0.636491 2.027089 -0.202371
H 7.703027 1.082668 0.419358
H 7.821645 -0.719059 0.402618
H -4.627180 0.411146 -0.693203
H -0.380549 -2.414920 1.195442
H 8.482497 0.973837 -1.773100


%chk=000219261-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219261

0 1
O -1.282395 -2.367269 0.919442
O 0.950514 -1.375345 1.218348
O 8.641082 -0.165037 -1.131287
O -5.280669 -1.898640 0.363736
O -3.601333 -3.335569 -0.216645
O -2.421434 3.608615 -0.937625
O -4.502404 2.701491 -1.200436
N 5.154151 0.098538 0.314348
N 1.453328 0.811126 0.668715
N -4.047837 -2.168929 0.080206
N -3.255193 2.619519 -0.883700
C 3.764996 0.250457 -0.152081
C 2.873302 0.660297 1.046384
C -0.861729 -0.026987 0.360144
C 6.182729 0.003472 -0.744900
C 0.564504 -0.218374 0.765675
C -1.731861 -1.186400 0.447800
C -1.379705 1.202887 -0.082593
C -3.103142 -1.024609 0.057543
C -2.738691 1.313577 -0.430893
C 7.592682 0.025520 -0.120373
C -3.613082 0.211066 -0.354562
H 3.744715 1.048117 -0.920048
H 3.337971 -0.667807 -0.620837
H 3.239368 1.611716 1.468291
H 2.925495 -0.114582 1.830445
H 5.241234 -0.670859 0.993263
H 1.153480 1.705972 0.280997
H 6.064089 0.879804 -1.414829
H 6.092462 -0.908279 -1.381501
H -0.775268 2.111989 -0.163713
H 7.732833 0.963898 0.453968
H 7.723579 -0.827283 0.568957
H -4.670082 0.318432 -0.613033
H -0.251464 -2.224824 1.162425
H 8.658976 0.619401 -1.735532


