%chk=000216073.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216073

0 1
O -3.283081 -0.353700 0.158086
O -3.504489 2.265896 0.280567
N 2.790457 0.709917 0.049434
C 1.617934 -0.187838 0.340554
C 0.285476 0.541636 0.282005
C 1.590850 -1.329574 -0.703458
C 2.668630 1.999650 0.801587
C 0.205539 1.934981 0.298265
C 1.452568 2.770014 0.269457
C -0.887623 -0.263147 0.220715
C 0.459531 -2.263343 -0.386545
C -0.756370 -1.727972 0.107287
C 4.087466 0.023886 0.379592
C -1.047197 2.584114 0.294982
C -2.126524 0.390057 0.213570
C -2.195788 1.811754 0.261765
C 0.600151 -3.642853 -0.561070
C -1.790817 -2.606104 0.458424
C 5.243574 0.731489 -0.327511
C -0.450346 -4.504314 -0.225818
C -1.638463 -3.986749 0.292401
C -3.715755 3.679951 0.054505
H 1.698354 -0.639229 1.370088
H 2.566413 -1.854512 -0.728069
H 1.461831 -0.901709 -1.722202
H 3.591316 2.595360 0.627627
H 2.577961 1.854256 1.900037
H 1.642291 3.073693 -0.785593
H 1.324447 3.706595 0.845140
H 4.280121 -0.031652 1.472698
H 4.029654 -1.028652 0.013740
H -1.094946 3.667847 0.317742
H 1.527369 -4.051363 -0.956369
H -2.728372 -2.213703 0.863213
H 5.014322 0.884518 -1.391737
H 5.446623 1.719399 0.099944
H 6.163591 0.141813 -0.262931
H -0.336294 -5.577439 -0.365621
H -2.452321 -4.655013 0.565607
H -4.078917 0.241922 0.057937
H -3.301477 4.256481 0.886946
H -4.811301 3.743736 0.037313
H -3.286089 3.981901 -0.905100


%chk=000216073-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216073

0 1
O -3.369632 -0.315924 0.138100
O -3.559568 2.284139 0.178994
N 2.803470 0.713815 0.053385
C 1.634238 -0.188208 0.264356
C 0.284925 0.542808 0.222160
C 1.571164 -1.315738 -0.794568
C 2.650488 1.993099 0.791290
C 0.202302 1.951373 0.223951
C 1.468254 2.790462 0.228358
C -0.901251 -0.273771 0.181434
C 0.464080 -2.284211 -0.417560
C -0.764378 -1.754079 0.090976
C 4.093616 0.052467 0.399647
C -1.065330 2.590154 0.210654
C -2.154977 0.386923 0.182032
C -2.226010 1.808525 0.194643
C 0.631533 -3.680078 -0.544902
C -1.792292 -2.662427 0.467843
C 5.306275 0.708087 -0.288049
C -0.399528 -4.572658 -0.173440
C -1.610482 -4.055818 0.339541
C -3.762220 3.731209 0.149105
H 1.710234 -0.682514 1.272575
H 2.530895 -1.854780 -0.872563
H 1.378144 -0.845815 -1.780083
H 3.581006 2.576091 0.678470
H 2.499350 1.814647 1.887897
H 1.716290 3.104181 -0.805009
H 1.317281 3.711781 0.823988
H 4.247928 0.036174 1.509364
H 4.042958 -1.002370 0.079538
H -1.116532 3.683905 0.214860
H 1.579319 -4.070064 -0.936112
H -2.736132 -2.271112 0.850303
H 5.170174 0.700276 -1.383477
H 5.451331 1.756219 0.029626
H 6.232178 0.155407 -0.042010
H -0.256819 -5.654442 -0.276002
H -2.415903 -4.736100 0.638665
H -4.099932 0.359802 0.085943
H -3.340555 4.207332 1.054966
H -4.852180 3.876911 0.124895
H -3.303415 4.176320 -0.754580


