%chk=000288580.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288580

0 1
O -0.014338 1.763750 -1.876841
O -2.713936 2.261883 1.140920
O -0.876019 -1.670655 -0.481882
N -1.469345 0.435953 0.369793
N 3.066057 0.751062 -1.492214
C -0.147759 1.059386 0.494085
C 0.858133 0.218588 1.346940
C 2.093858 0.211276 0.521384
C 1.890373 0.798300 -0.741942
C 0.518880 1.278767 -0.915130
C 3.445062 -0.219364 0.582030
C 4.032356 0.128063 -0.696493
C -2.689686 1.154809 0.674412
C -1.725128 -0.882079 -0.166068
C -3.793260 0.207314 0.309581
C -3.223198 -0.997987 -0.187124
C 4.246582 -0.862655 1.553238
C 5.389293 -0.161329 -0.987373
C 5.562989 -1.137139 1.254934
C -5.159089 0.370988 0.393620
C -4.016834 -2.045352 -0.602000
C 6.128234 -0.787404 -0.008619
C -5.977003 -0.703337 -0.031567
C -5.420333 -1.880867 -0.516722
H -0.281668 2.076763 0.959581
H 0.488644 -0.815717 1.511715
H 1.007083 0.661603 2.347122
H 3.170439 1.085069 -2.430693
H 3.809665 -1.128901 2.513748
H 5.816212 0.104187 -1.949083
H 6.201460 -1.631925 1.984308
H -5.599748 1.294601 0.771561
H -3.583842 -2.970260 -0.985727
H 7.176030 -1.030917 -0.187585
H -7.061458 -0.594576 0.024830
H -6.067408 -2.697497 -0.841539


%chk=000288580-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288580

0 1
O -0.036109 1.464692 -2.037744
O -2.645607 2.218577 1.246237
O -1.000843 -1.739319 -0.702414
N -1.499412 0.349751 0.320170
N 3.106233 0.675531 -1.494311
C -0.147311 0.885536 0.416540
C 0.851752 0.063677 1.308073
C 2.134976 0.147971 0.516891
C 1.920492 0.676765 -0.761623
C 0.537708 1.054597 -0.993236
C 3.527101 -0.197940 0.608857
C 4.113827 0.145898 -0.676550
C -2.663041 1.085113 0.708229
C -1.833633 -0.903117 -0.272421
C -3.825454 0.215176 0.346099
C -3.329222 -0.975672 -0.239373
C 4.354145 -0.764902 1.617369
C 5.484350 -0.063012 -0.949557
C 5.716372 -0.972108 1.342289
C -5.201453 0.433630 0.507685
C -4.192955 -1.988146 -0.681604
C 6.273258 -0.623949 0.073011
C -6.084141 -0.584785 0.062352
C -5.587595 -1.777109 -0.522901
H -0.267937 1.904351 0.835993
H 0.507254 -0.983489 1.393177
H 0.924803 0.479524 2.328688
H 3.211205 1.001126 -2.452957
H 3.934312 -1.035898 2.592006
H 5.922155 0.197332 -1.919009
H 6.366884 -1.407941 2.107969
H -5.572851 1.358815 0.959087
H -3.798339 -2.902811 -1.134853
H 7.339495 -0.799475 -0.107949
H -7.165691 -0.449666 0.169609
H -6.293429 -2.544324 -0.858629


