%chk=000205687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205687

0 1
O 1.925741 1.290953 0.101764
O -3.400862 -2.439517 -0.523980
O -2.466286 2.424827 -0.337348
O -4.514988 0.292452 -0.376606
N 6.649652 -0.890834 0.666487
N 3.339649 -0.523138 0.125949
N 0.999683 -0.845739 -0.108908
C 4.555339 0.326904 0.188911
C 5.384219 0.241588 -1.117197
C 5.504551 -0.181213 1.312659
C 6.766862 -0.308992 -0.709537
C 2.071692 0.084351 0.035354
C -0.379117 -0.497892 -0.203834
C -0.825422 0.825890 -0.217461
C -1.287821 -1.570843 -0.316446
C -2.660735 -1.295786 -0.399083
C -2.204552 1.085789 -0.305572
C -3.147542 0.031785 -0.347608
C -4.801744 -2.339309 -0.893193
C -3.802247 2.880600 -0.678284
C -5.093961 0.355751 0.960474
H 4.234930 1.383664 0.388255
H 4.900427 -0.396992 -1.874192
H 5.471599 1.236859 -1.585431
H 4.994767 -0.816906 2.059016
H 5.918154 0.687371 1.871556
H 7.516225 0.510967 -0.659824
H 7.153346 -1.053713 -1.427843
H 6.442502 -1.892621 0.601992
H 3.479661 -1.511913 -0.040339
H 1.204309 -1.846817 -0.103081
H -0.128042 1.670617 -0.163090
H -0.963711 -2.605731 -0.349796
H -4.999523 -3.336694 -1.302311
H -5.389640 -2.146486 0.007844
H -4.961575 -1.553217 -1.639860
H -4.422031 2.857668 0.221560
H -3.609922 3.907064 -1.012524
H -4.241795 2.268787 -1.473857
H -4.627793 1.160878 1.535113
H -6.146222 0.567417 0.749911
H -4.968978 -0.603027 1.470661


%chk=000205687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205687

0 1
O 1.887398 1.467767 0.146064
O -3.470869 -2.528736 -0.297197
O -2.854127 2.354026 0.262599
O -4.652292 0.112186 0.034278
N 6.399353 -1.076416 0.663727
N 3.295120 -0.387444 -0.081774
N 0.974028 -0.697800 -0.120069
C 4.538864 0.393285 0.034454
C 5.474375 0.223161 -1.214147
C 5.439414 -0.086684 1.224416
C 6.749664 -0.520911 -0.677425
C 2.037210 0.217990 -0.006362
C -0.420726 -0.424059 -0.103837
C -0.957311 0.880465 0.041356
C -1.293637 -1.531618 -0.262063
C -2.692693 -1.356920 -0.234732
C -2.355717 1.046136 0.052019
C -3.246196 -0.059194 -0.052145
C -4.572982 -2.548340 -1.284354
C -3.669724 2.895689 -0.848002
C -5.115100 0.469696 1.399094
H 4.208467 1.435710 0.169776
H 4.954395 -0.359960 -1.995332
H 5.727942 1.203232 -1.653844
H 4.854033 -0.509667 2.057104
H 6.015856 0.776588 1.608730
H 7.579155 0.199235 -0.548247
H 7.101130 -1.321943 -1.349901
H 5.975004 -2.013836 0.586632
H 3.377894 -1.396448 -0.221589
H 1.213745 -1.685255 -0.228297
H -0.303438 1.746645 0.146305
H -0.911368 -2.550181 -0.394897
H -5.052705 -3.530793 -1.155796
H -5.288420 -1.732892 -1.089846
H -4.165358 -2.460550 -2.310281
H -4.540662 2.247071 -1.051071
H -3.998375 3.890278 -0.509620
H -3.049345 2.995509 -1.759038
H -4.647481 1.415909 1.725129
H -6.207191 0.585865 1.320090
H -4.868528 -0.341992 2.108391


