%chk=000259321.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259321

0 1
O -0.361218 0.671207 -1.093599
O 3.464163 -1.195242 0.542555
O 3.929712 -0.436323 -1.510400
N 1.109051 0.156844 0.564959
N -0.746723 -1.803563 1.383450
C -2.561852 -0.676261 0.018376
C -3.302379 0.664687 -0.185335
C -1.267142 -0.520283 0.837881
C -3.847607 1.210612 1.139883
C -4.438570 0.481986 -1.198836
C -0.161278 0.135699 -0.016055
C 2.250415 0.761335 -0.143419
C 2.932470 1.829158 0.709630
C 3.287391 -0.313129 -0.498289
H -2.323399 -1.105101 -0.976840
H -3.236060 -1.399495 0.512422
H -2.569761 1.402330 -0.608864
H -1.461853 0.169128 1.709205
H -4.333108 2.182278 0.993282
H -3.050267 1.354083 1.876986
H -4.592244 0.540058 1.581070
H -4.054265 0.157407 -2.172918
H -5.172772 -0.258129 -0.866023
H -4.974765 1.423488 -1.363091
H 1.883107 1.213497 -1.118027
H 1.319338 -0.381680 1.409901
H -0.652524 -2.501229 0.648707
H -1.388154 -2.182413 2.075380
H 3.766520 2.299640 0.172272
H 2.223351 2.627019 0.972638
H 3.326559 1.422355 1.650435
H 4.126965 -1.906965 0.334662


%chk=000259321-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259321

0 1
O -0.355751 1.444399 -0.538298
O 3.300663 -1.608157 0.269582
O 4.559803 -0.114427 -0.984640
N 1.156842 -0.071256 0.378218
N -0.649833 -1.691914 1.382520
C -2.495835 -0.564781 0.038012
C -3.359083 0.706355 -0.196813
C -1.213299 -0.397514 0.905052
C -3.947141 1.258234 1.123991
C -4.494228 0.381933 -1.196336
C -0.110742 0.414650 0.171722
C 2.326969 0.578909 -0.209790
C 2.789635 1.822684 0.604896
C 3.500936 -0.378000 -0.377770
H -2.199094 -0.984349 -0.946110
H -3.129313 -1.329735 0.537320
H -2.700403 1.475391 -0.639582
H -1.472142 0.191213 1.806990
H -4.579865 2.143395 0.927016
H -3.159805 1.575292 1.833181
H -4.578198 0.497846 1.626268
H -4.087799 0.024615 -2.161095
H -5.165963 -0.404320 -0.797109
H -5.109731 1.277700 -1.400229
H 2.046682 0.939321 -1.219417
H 1.216088 -0.923140 0.957982
H -0.704077 -2.433500 0.672746
H -1.048379 -2.007913 2.272206
H 3.653910 2.302513 0.115258
H 1.953579 2.539517 0.645904
H 3.070099 1.534608 1.633147
H 4.108575 -2.176572 0.147178


