%chk=000210593.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210593

0 1
O 0.103649 0.624638 1.436980
O 1.498119 -3.640022 -0.093378
O 5.677132 2.919740 -0.502026
O -2.438735 -1.854803 -1.516943
N -1.170259 -0.529929 -0.075316
N -0.456556 -2.729330 -0.784383
C 1.146663 -1.332014 0.524075
C 2.285281 -0.690080 -0.304344
C 3.004516 0.420427 0.469554
C 0.019885 -0.327196 0.699167
C 4.070366 1.092629 -0.399668
C 0.788694 -2.660981 -0.109207
C -1.441355 -1.699613 -0.852235
C 4.766245 2.226074 0.361349
C -2.208864 0.504935 -0.046573
C -1.895944 1.793406 -0.503217
C -3.485965 0.186042 0.436520
C -2.887708 2.777193 -0.467894
C -4.464198 1.183698 0.457206
C -4.167785 2.475234 0.008808
H 1.546086 -1.557326 1.558346
H 1.880676 -0.297351 -1.258623
H 3.015312 -1.481889 -0.583298
H 2.270471 1.176904 0.826124
H 3.467962 0.005730 1.386967
H 3.618375 1.506013 -1.324748
H 4.816836 0.350447 -0.741619
H -0.687367 -3.608106 -1.279625
H 5.311275 1.863569 1.250106
H 4.061861 3.026863 0.659710
H -0.897279 2.029429 -0.866213
H -3.718831 -0.822336 0.775356
H -2.659038 3.784774 -0.815121
H -5.463192 0.950277 0.825506
H 6.390834 2.325006 -0.802058
H -4.935561 3.247449 0.030515


%chk=000210593-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210593

0 1
O 0.016479 0.455281 1.691619
O 1.505677 -3.746514 -0.028918
O 5.729092 2.961918 -0.572897
O -2.380472 -1.802029 -1.653579
N -1.154625 -0.562414 -0.062026
N -0.423826 -2.721080 -0.808472
C 1.131241 -1.403834 0.584741
C 2.250090 -0.705607 -0.280874
C 2.943659 0.467305 0.441884
C -0.032700 -0.445100 0.817571
C 4.039489 1.116046 -0.436561
C 0.770887 -2.726673 -0.073475
C -1.384173 -1.688836 -0.900606
C 4.726301 2.297095 0.274500
C -2.176537 0.482794 -0.035665
C -1.830536 1.788075 -0.445115
C -3.483296 0.182664 0.402949
C -2.806888 2.806783 -0.413133
C -4.456935 1.204676 0.425427
C -4.121338 2.516960 0.020015
H 1.575107 -1.626837 1.570770
H 1.813048 -0.361563 -1.239737
H 2.994594 -1.488059 -0.522053
H 2.200155 1.231546 0.735766
H 3.392253 0.096109 1.385977
H 3.602836 1.484327 -1.385730
H 4.801555 0.354448 -0.707560
H -0.648624 -3.563337 -1.348885
H 5.177351 1.958653 1.233051
H 3.994009 3.090551 0.500671
H -0.810420 2.005409 -0.777985
H -3.738691 -0.835741 0.711455
H -2.542027 3.821769 -0.727571
H -5.474210 0.975599 0.759820
H 6.441724 2.311049 -0.796653
H -4.878649 3.308067 0.041081


