%chk=000211797.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211797

0 1
O 2.850098 -0.311505 -1.159248
O 4.653259 1.261206 -0.079004
N -1.247379 -0.025562 -0.074553
N 3.514933 0.884462 0.664246
C -1.752016 1.130808 -0.886757
C -2.200458 -1.182619 -0.124204
C -3.114244 1.593542 -0.343438
C -3.570432 -0.752450 0.427210
C -4.129481 0.444022 -0.352448
C 0.126104 -0.430476 -0.511180
C 1.131016 0.141396 0.521828
C 1.194300 -0.723950 1.779688
C 2.511455 0.226090 -0.122455
H -1.840160 0.888987 -1.968254
H -1.015226 1.957545 -0.796844
H -1.782955 -1.992750 0.512557
H -2.319354 -1.597140 -1.148413
H -3.484996 2.443486 -0.944121
H -2.988664 1.970136 0.691487
H -3.466786 -0.482569 1.497384
H -4.271902 -1.605025 0.385066
H -5.085490 0.776044 0.092649
H -4.361014 0.147330 -1.392809
H 0.387860 -0.071929 -1.531603
H 0.237497 -1.534813 -0.558265
H 0.792256 1.170941 0.808507
H 1.563939 -1.734179 1.566638
H 1.842682 -0.290536 2.549233
H 0.186997 -0.826178 2.211897
H 3.283189 1.717914 1.204591
H 4.953872 0.409570 -0.554485


%chk=000211797-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211797

0 1
O 3.101287 -1.180043 -0.052454
O 4.732668 0.818931 -0.643975
N -1.231316 -0.148103 -0.023305
N 3.388938 1.072455 -0.192310
C -1.694604 1.198628 -0.442460
C -2.150068 -1.210973 -0.509414
C -3.111916 1.494032 0.091244
C -3.579586 -0.994888 0.026992
C -4.107999 0.403902 -0.365895
C 0.179125 -0.409158 -0.384471
C 1.184469 0.275385 0.592007
C 1.002081 -0.241069 2.039510
C 2.599285 -0.009289 0.105282
H -1.695746 1.286702 -1.562616
H -0.988100 1.957604 -0.058038
H -1.759977 -2.187860 -0.168765
H -2.181553 -1.236536 -1.631434
H -3.436582 2.492471 -0.260273
H -3.076452 1.522230 1.197584
H -3.562275 -1.087855 1.130252
H -4.243234 -1.788533 -0.366976
H -5.106488 0.580573 0.076658
H -4.228749 0.455282 -1.468088
H 0.408214 -0.084982 -1.431520
H 0.365179 -1.497651 -0.338071
H 1.014717 1.372133 0.574315
H 1.304255 -1.301488 2.103060
H 1.613146 0.335961 2.756700
H -0.062494 -0.157437 2.316282
H 3.186605 2.067123 -0.117455
H 4.736072 -0.195747 -0.627468


