%chk=000292162.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292162

0 1
O -0.665637 1.641473 -1.470250
O -1.172175 1.602000 0.746985
O -3.747721 0.573203 -0.950215
O -3.605210 -1.557743 -0.602945
N 2.359447 -2.505099 -0.714144
N -3.127685 -0.448946 -0.741580
C -1.019530 -1.348155 0.327449
C 0.419939 -1.590795 0.067525
C -1.604195 -0.348653 -0.690475
C 1.521490 -0.830545 0.610198
C 2.726845 -1.424783 0.106428
C 0.955173 -2.596774 -0.727744
C 1.615120 0.282268 1.469150
C -1.158477 1.071000 -0.334310
C 4.003925 -0.928704 0.442297
C 2.869023 0.764838 1.796976
C 4.052134 0.164127 1.287878
C -0.164212 3.021343 -1.390053
C -1.326630 3.983312 -1.300266
H -1.593873 -2.304184 0.281259
H -1.167352 -0.964128 1.363891
H -1.228070 -0.601328 -1.726197
H 0.445541 -3.361193 -1.288483
H 2.987647 -3.115878 -1.197638
H 0.706750 0.747520 1.857871
H 4.903582 -1.391369 0.051827
H 2.966275 1.622025 2.461040
H 5.014725 0.583558 1.579310
H 0.522210 3.088660 -0.527652
H 0.390536 3.085293 -2.344462
H -0.998309 5.024104 -1.406171
H -2.076415 3.788192 -2.079707
H -1.846170 3.898059 -0.332691


%chk=000292162-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292162

0 1
O -0.791311 1.832906 -1.588587
O -1.038241 1.662706 0.730216
O -3.695737 0.761350 -0.785595
O -3.569236 -1.510271 -0.886768
N 2.401957 -2.674010 -0.602553
N -3.042395 -0.343953 -0.795156
C -0.957233 -1.301258 0.320688
C 0.504478 -1.622899 0.121474
C -1.486610 -0.281627 -0.722566
C 1.659404 -0.923538 0.668081
C 2.835835 -1.608703 0.196782
C 1.002453 -2.681270 -0.642354
C 1.818137 0.202018 1.522998
C -1.095495 1.167254 -0.416388
C 4.143519 -1.205485 0.547576
C 3.119037 0.605657 1.878343
C 4.269502 -0.087337 1.395540
C -0.472198 3.295416 -1.466203
C -1.762818 4.117452 -1.453460
H -1.567180 -2.215332 0.215668
H -1.134958 -0.884930 1.328789
H -1.158963 -0.555217 -1.739555
H 0.458862 -3.443868 -1.198299
H 3.007210 -3.350882 -1.061661
H 0.943972 0.746981 1.894540
H 5.028410 -1.738089 0.181384
H 3.255403 1.468973 2.539008
H 5.267454 0.254681 1.691735
H 0.117514 3.443690 -0.544837
H 0.147188 3.495886 -2.354181
H -1.512953 5.194244 -1.427666
H -2.364865 3.921280 -2.356634
H -2.371442 3.880873 -0.565260


