%chk=000259646.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259646

0 1
O -0.093225 0.411561 -2.274882
O -0.894158 -4.170102 1.949387
N 0.104168 -3.678290 1.527277
C -1.253298 -1.123041 -0.909758
C 1.225896 -1.072352 -0.866860
C -2.545883 -0.583421 -1.452010
C 2.517201 -0.486900 -1.363705
C -0.013099 -0.595705 -1.347023
C -1.227339 -2.137402 0.042443
C 1.219571 -2.090150 0.090213
C -3.083779 0.513882 -0.568335
C 3.107448 0.509725 -0.396899
C -0.000461 -2.623614 0.539934
C -2.498101 1.789201 -0.610031
C -4.163774 0.271573 0.291633
C 4.453774 0.404073 -0.019693
C 2.323262 1.557387 0.110097
C -2.994378 2.812746 0.199153
C -4.656331 1.301081 1.099866
C 5.010334 1.341862 0.855429
C 2.884565 2.489897 0.985449
C -4.075192 2.571544 1.054967
C 4.228988 2.386065 1.358443
H -3.287118 -1.401810 -1.567203
H -2.389398 -0.189329 -2.483911
H 2.366308 0.014151 -2.350132
H 3.238914 -1.306898 -1.575696
H -2.159282 -2.567898 0.421060
H 2.161800 -2.470247 0.494950
H -1.652179 1.969864 -1.274448
H -4.620135 -0.714690 0.335494
H 5.070136 -0.406978 -0.401786
H 1.271939 1.637362 -0.163823
H 0.817330 0.717805 -2.561988
H -2.539771 3.801140 0.164392
H -5.495255 1.110005 1.767085
H 6.056174 1.255458 1.146976
H 2.271346 3.298562 1.381275
H -4.460853 3.370441 1.684185
H 4.663453 3.113841 2.040774


%chk=000259646-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259646

0 1
O 0.461869 0.419129 -1.600858
O -1.880203 -4.955365 0.809019
N -0.660275 -4.531571 0.839077
C -1.155890 -1.242213 -1.009000
C 1.248465 -1.565698 -0.370582
C -2.226640 -0.361564 -1.641008
C 2.700954 -1.102189 -0.434705
C 0.204717 -0.797390 -0.974678
C -1.460087 -2.479456 -0.425165
C 0.898306 -2.790210 0.224325
C -2.664824 0.794302 -0.733582
C 2.951569 0.339147 0.022147
C -0.441880 -3.252513 0.198827
C -2.385233 2.138381 -1.083307
C -3.368585 0.535864 0.471000
C 3.736377 1.219919 -0.768643
C 2.438580 0.809882 1.260956
C -2.803105 3.203042 -0.251946
C -3.788609 1.596622 1.303656
C 4.008066 2.537894 -0.331871
C 2.708101 2.124402 1.697341
C -3.507357 2.935934 0.944356
C 3.494800 2.993078 0.903160
H -3.101351 -0.996169 -1.876729
H -1.849343 0.053129 -2.592202
H 3.076127 -1.215663 -1.472363
H 3.306923 -1.788706 0.186265
H -2.482579 -2.874630 -0.432288
H 1.652477 -3.422584 0.707492
H -1.830195 2.347067 -2.005031
H -3.589946 -0.499556 0.758919
H 4.147402 0.868309 -1.723485
H 1.823270 0.143270 1.876839
H 1.357137 0.778602 -1.345622
H -2.580724 4.237536 -0.537977
H -4.336269 1.380385 2.228120
H 4.616972 3.203323 -0.953612
H 2.303682 2.473254 2.653804
H -3.835202 3.760017 1.588117
H 3.702102 4.013388 1.243533


