%chk=000278719.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278719

0 1
O -4.223448 1.340163 1.877576
O 1.704008 -0.105390 2.773378
O 0.762914 0.233371 -1.713529
O -6.395230 1.264572 1.619750
N 1.073829 0.110006 0.566786
C -0.314166 0.413673 0.881809
C -2.679530 0.203842 0.361936
C 3.911633 -1.173418 0.225662
C 4.048249 0.151172 -0.413631
C 2.924165 -1.420087 1.191532
C 2.930528 0.842814 -0.904871
C -1.333473 -0.094185 0.073133
C -3.799697 -0.270898 -0.447762
C 1.912576 -0.409043 1.622668
C 1.528540 0.342878 -0.784380
C -2.947391 1.000524 1.491357
C -0.608908 1.224421 2.005667
C -5.109319 0.070826 -0.048395
C -1.927034 1.513411 2.316697
C 4.796172 -2.208339 -0.128661
C 5.323829 0.728715 -0.547996
C 2.846593 -2.674583 1.820216
C 3.091392 2.078621 -1.554157
C -3.622731 -1.050544 -1.608786
C -5.356857 0.890626 1.142411
C -6.219384 -0.369382 -0.797477
C 4.702905 -3.458540 0.483296
C 5.477197 1.965400 -1.175253
C 3.732162 -3.691626 1.464940
C 4.361518 2.639148 -1.686740
C -4.724959 -1.478340 -2.341189
C -6.028221 -1.141068 -1.937002
H -1.090153 -0.708928 -0.800982
H 0.204406 1.602365 2.634736
H -2.193856 2.124794 3.179723
H 5.552266 -2.034602 -0.895257
H 6.196632 0.211239 -0.147979
H 2.091178 -2.847311 2.591496
H 2.216737 2.596368 -1.956689
H -2.614496 -1.311932 -1.934966
H -7.225995 -0.093892 -0.468471
H 5.389625 -4.256448 0.197486
H 6.469731 2.408283 -1.268696
H 3.668120 -4.665159 1.950936
H 4.484294 3.599905 -2.186711
H -4.579699 -2.080846 -3.239659
H -6.882749 -1.483476 -2.518651


%chk=000278719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278719

0 1
O -4.310363 1.463248 1.811329
O 1.294409 -0.687077 2.705978
O 0.749541 0.968544 -1.621771
O -6.576987 1.334263 1.523287
N 1.049059 0.155713 0.545798
C -0.344651 0.480604 0.854791
C -2.733533 0.225806 0.356439
C 3.935309 -1.181255 0.204953
C 4.107858 0.171580 -0.384681
C 2.876455 -1.514611 1.099441
C 3.016440 0.974427 -0.827707
C -1.374014 -0.081775 0.084593
C -3.867850 -0.306761 -0.413435
C 1.751964 -0.617571 1.532532
C 1.556521 0.642701 -0.708419
C -3.001068 1.102746 1.444031
C -0.633971 1.362099 1.926096
C -5.196558 0.059346 -0.027308
C -1.971575 1.668093 2.223820
C 4.901256 -2.185701 -0.090588
C 5.427119 0.674926 -0.572517
C 2.842400 -2.801077 1.707259
C 3.268409 2.210529 -1.486308
C -3.710059 -1.170274 -1.532741
C -5.460213 0.964018 1.114928
C -6.320991 -0.434848 -0.739822
C 4.839787 -3.467337 0.486028
C 5.666745 1.915983 -1.189946
C 3.807458 -3.776926 1.402626
C 4.579243 2.687742 -1.662513
C -4.828146 -1.654763 -2.233654
C -6.142312 -1.290623 -1.838780
H -1.110996 -0.749237 -0.738258
H 0.178690 1.783138 2.522330
H -2.239107 2.334517 3.047824
H 5.695884 -1.959649 -0.808600
H 6.274302 0.090451 -0.199694
H 2.043793 -3.008413 2.425539
H 2.410991 2.780386 -1.856228
H -2.708857 -1.460394 -1.864103
H -7.317951 -0.128108 -0.408074
H 5.590591 -4.219929 0.222769
H 6.693631 2.279781 -1.301829
H 3.754064 -4.765907 1.868936
H 4.751049 3.649601 -2.156160
H -4.681486 -2.317037 -3.093775
H -7.008372 -1.671871 -2.389116


