%chk=000284551.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284551

0 1
O -2.360459 0.212249 -0.832313
O -4.774993 0.419642 -1.631418
N 3.171570 -0.074984 -0.120718
N 5.386304 0.999492 0.324896
N 5.137540 -1.435996 0.250300
N -5.782223 0.160327 0.393556
N 3.046913 -2.491169 0.037556
N 7.208107 -0.419277 0.820196
C 3.961225 1.244481 0.080598
C 3.818032 2.064872 -1.209679
C 3.372083 1.980832 1.293475
C 1.733206 -0.012651 -0.249087
C 3.815255 -1.309252 0.052226
C 0.912338 -0.146353 0.879569
C 1.170310 0.183509 -1.529373
C 5.868533 -0.226166 0.441275
C -1.022007 0.124355 -0.525411
C -0.478267 -0.078095 0.748377
C -0.206542 0.255019 -1.672979
C -7.135202 0.268921 -0.224735
C -5.723281 -0.107938 1.850617
C -3.303667 0.114886 0.266839
C -4.657941 0.245617 -0.434527
C -7.736440 1.655609 -0.009188
C -5.553812 -1.596807 2.152186
H 4.465935 2.952305 -1.155384
H 4.139218 1.496879 -2.089864
H 2.792618 2.408220 -1.371943
H 3.965903 2.883057 1.501500
H 2.336050 2.289918 1.131402
H 3.414783 1.367318 2.200511
H 1.358917 -0.309354 1.862338
H 1.821253 0.281244 -2.400028
H -1.103365 -0.181537 1.628415
H -0.678348 0.410582 -2.643737
H 3.581458 -3.355561 -0.006453
H 2.206244 -2.502935 -0.524522
H -7.041308 0.063249 -1.320994
H -7.792810 -0.519390 0.200606
H -4.899114 0.481029 2.311052
H -6.661396 0.268737 2.322002
H -3.123817 0.943932 0.974623
H -3.188118 -0.866208 0.763115
H 7.830461 0.366275 0.683755
H 7.611012 -1.322032 0.607593
H -7.862366 1.897808 1.050929
H -7.100886 2.436767 -0.449269
H -8.720156 1.732191 -0.487611
H -6.375283 -2.190219 1.729427
H -4.625548 -2.004088 1.734219
H -5.539818 -1.782110 3.232679


%chk=000284551-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284551

0 1
O -2.381854 -0.027158 -1.010990
O -4.916692 0.344908 -1.818945
N 3.205583 -0.053755 0.007930
N 5.401488 1.097299 -0.136607
N 5.238511 -1.320597 0.269967
N -5.819919 0.117344 0.314836
N 3.181767 -2.415905 0.269335
N 7.284033 -0.299900 -0.190637
C 3.988157 1.261142 0.234410
C 3.385003 2.370946 -0.648349
C 3.888169 1.639540 1.740238
C 1.779951 -0.052156 -0.207653
C 3.903352 -1.240754 0.190702
C 0.874972 0.022152 0.879157
C 1.258725 -0.129941 -1.529026
C 5.922758 -0.117024 -0.009608
C -1.024114 -0.032867 -0.660662
C -0.522374 0.035666 0.663916
C -0.127146 -0.121281 -1.756769
C -7.193492 0.214498 -0.241893
C -5.690613 -0.047964 1.780453
C -3.347614 0.116561 0.068544
C -4.751965 0.197370 -0.574140
C -7.705941 1.669077 -0.297133
C -5.790787 -1.520121 2.242432
H 3.980213 3.285235 -0.490131
H 3.460805 2.096775 -1.714059
H 2.330729 2.578606 -0.396254
H 4.511030 2.532030 1.924270
H 2.847348 1.870117 2.033602
H 4.272539 0.815001 2.367137
H 1.267891 0.066520 1.900369
H 1.957868 -0.193337 -2.368962
H -1.194019 0.095438 1.525540
H -0.543379 -0.174509 -2.766996
H 3.717097 -3.278637 0.318256
H 2.165724 -2.424439 0.266366
H -7.170050 -0.209059 -1.259995
H -7.859634 -0.412634 0.380127
H -4.740857 0.396334 2.126931
H -6.493811 0.545734 2.257059
H -3.145075 1.046283 0.643699
H -3.278202 -0.747029 0.761873
H 7.867997 0.505051 -0.396158
H 7.654975 -1.244859 -0.188047
H -7.710069 2.138119 0.704324
H -7.066306 2.270738 -0.964602
H -8.738598 1.696394 -0.690462
H -6.749980 -1.967025 1.926723
H -4.977307 -2.131082 1.812187
H -5.728784 -1.585644 3.344293


