%chk=000287067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287067

0 1
O 3.528049 -2.052372 -0.332334
O 5.096266 0.208556 0.684860
N -1.067563 1.583858 -0.033079
N -3.636953 2.886582 1.720673
C -2.552161 1.444770 -0.208420
C -3.010638 -0.012077 -0.062293
C -0.260634 0.933253 -1.113520
C -2.993019 2.096257 -1.528764
C 1.154193 0.715167 -0.634736
C -3.034579 -0.600414 1.212814
C -3.360397 -0.782725 -1.177583
C 1.701545 -0.574489 -0.640065
C -3.157906 2.249604 0.886743
C 1.919811 1.804505 -0.189896
C 3.023219 -0.763345 -0.220385
C -3.409627 -1.936739 1.366864
C -3.734409 -2.121911 -1.021629
C 3.240976 1.622330 0.221310
C 3.801421 0.339435 0.196787
C -3.760297 -2.701634 0.249113
C 3.987682 -2.623378 0.924458
C 6.053255 -0.254272 -0.308661
H -0.784320 1.208832 0.883327
H -0.251526 1.629221 -1.987060
H -0.707917 -0.021545 -1.472999
H -2.624174 1.554664 -2.406346
H -2.606734 3.124831 -1.599581
H -4.086963 2.147089 -1.602115
H -2.768432 -0.017522 2.095540
H -3.350327 -0.349082 -2.177235
H 1.123894 -1.439132 -0.964249
H 1.474471 2.801267 -0.167305
H 3.847184 2.461364 0.562021
H -3.430737 -2.382672 2.360723
H -4.007615 -2.712054 -1.895378
H -4.053439 -3.743262 0.370202
H 4.704140 -1.956514 1.418260
H 4.460838 -3.554621 0.595977
H 3.122888 -2.819365 1.563986
H 5.717725 -1.194039 -0.761554
H 6.959332 -0.393475 0.290320
H 6.191577 0.523754 -1.064190


%chk=000287067-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287067

0 1
O 4.041949 -2.023870 -0.388927
O 5.350577 0.434727 0.535854
N -1.063167 1.221511 0.105851
N -3.413940 3.080577 1.716106
C -2.532755 1.389753 -0.172432
C -3.305124 0.041334 -0.082730
C -0.268347 0.407160 -0.845928
C -2.738274 2.120439 -1.529411
C 1.203489 0.400299 -0.444641
C -3.817928 -0.411769 1.161036
C -3.418521 -0.810735 -1.211792
C 1.964273 -0.786859 -0.561989
C -3.026985 2.318675 0.884617
C 1.835915 1.576449 0.033425
C 3.336898 -0.805663 -0.235059
C -4.428653 -1.679257 1.274426
C -4.027858 -2.080788 -1.099160
C 3.211407 1.568568 0.346418
C 3.977274 0.392128 0.195660
C -4.534355 -2.521954 0.143944
C 4.613338 -2.568289 0.865649
C 6.273563 0.150758 -0.588104
H -0.912434 0.905460 1.074972
H -0.368725 0.863546 -1.849651
H -0.630082 -0.643389 -0.933143
H -2.394208 1.508503 -2.378269
H -2.163700 3.060753 -1.525767
H -3.806143 2.346651 -1.682556
H -3.755789 0.236567 2.043390
H -3.048588 -0.488867 -2.191047
H 1.505163 -1.724223 -0.896373
H 1.241460 2.487633 0.151962
H 3.720251 2.471285 0.699963
H -4.827341 -2.004691 2.241626
H -4.109481 -2.722384 -1.983656
H -5.010305 -3.504925 0.229480
H 5.294305 -1.839301 1.340512
H 5.161815 -3.474992 0.568161
H 3.800194 -2.833222 1.567889
H 6.070579 -0.842584 -1.027348
H 7.283760 0.182336 -0.152252
H 6.174591 0.931344 -1.366102


