%chk=000209998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209998

0 1
O -0.649303 -1.588238 -0.561350
O -0.800906 -0.913206 1.595864
O 4.070066 2.757965 -1.021757
N 2.341841 -3.689631 -0.602612
C 1.621942 -2.406874 -0.280633
C 2.181191 -1.865184 1.057273
C 3.049514 -2.984225 1.654165
C 2.906668 -4.185842 0.696558
C 0.127956 -2.772404 -0.197579
C 3.399635 -3.486764 -1.634163
C -1.827476 0.409541 -0.220831
C -1.053613 -0.730846 0.426573
C -1.329145 1.757211 0.343671
C -3.308104 0.239663 0.034972
C 0.089836 2.041625 -0.060587
C -4.210907 0.348681 -1.032316
C -3.787205 -0.005184 1.331039
C 1.151699 1.630633 0.770165
C 0.368638 2.713391 -1.255782
C -5.583535 0.216853 -0.801515
C -5.159220 -0.137048 1.555067
C 2.468935 1.890165 0.416709
C 1.687535 2.985845 -1.636896
C -6.059996 -0.024744 0.490431
C 2.723325 2.570670 -0.793525
C 4.460334 3.462478 -2.224384
H 1.747407 -1.647774 -1.090881
H 2.770750 -0.949026 0.886965
H 1.363200 -1.576866 1.746358
H 2.722462 -3.246416 2.673514
H 4.101697 -2.665812 1.737393
H 2.175163 -4.921454 1.094993
H 3.860459 -4.724431 0.558252
H -0.173488 -3.488872 -0.985032
H -0.181566 -3.135019 0.795506
H 3.872147 -4.457482 -1.854273
H 4.186875 -2.771847 -1.353333
H 2.927997 -3.138926 -2.567391
H -1.624189 0.382486 -1.326775
H -1.426664 1.755950 1.451619
H -2.005983 2.565338 -0.004429
H -3.848672 0.532435 -2.042150
H -3.083653 -0.103062 2.161689
H 0.932738 1.096789 1.698990
H -0.446806 3.032749 -1.904576
H -6.282190 0.300968 -1.632404
H -5.527180 -0.329636 2.561937
H 3.302400 1.589701 1.047212
H 1.884319 3.508040 -2.566248
H -7.128729 -0.127833 0.667499
H 4.062521 4.481228 -2.214662
H 5.554686 3.467581 -2.136105
H 4.141296 2.907360 -3.110923


%chk=000209998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209998

0 1
O -0.581276 -1.634758 -0.488465
O -0.774500 -0.795698 1.685456
O 4.099038 3.366002 -0.573620
N 2.255592 -4.098719 -0.027628
C 1.625920 -2.770281 -0.271234
C 2.381374 -1.819531 0.686202
C 3.826322 -2.373307 0.658346
C 3.626980 -3.909565 0.545190
C 0.114174 -2.866917 0.003280
C 2.164795 -5.065648 -1.131403
C -1.758461 0.443911 -0.221298
C -0.986061 -0.693012 0.453412
C -1.377786 1.822467 0.416615
C -3.266779 0.179515 -0.110076
C 0.055783 2.249343 0.139892
C -4.073026 0.161654 -1.275074
C -3.882037 -0.012834 1.154392
C 1.106470 1.941984 1.047513
C 0.387028 2.956341 -1.040963
C -5.469763 -0.035606 -1.182227
C -5.276701 -0.212104 1.247672
C 2.434564 2.324303 0.782829
C 1.715159 3.348650 -1.326995
C -6.076664 -0.221634 0.080809
C 2.744297 3.028724 -0.407476
C 4.464306 4.114537 -1.777349
H 1.768990 -2.433177 -1.328835
H 2.316322 -0.766105 0.367892
H 1.949388 -1.897144 1.700797
H 4.408332 -2.086636 1.550984
H 4.361726 -1.989480 -0.230052
H 3.699986 -4.402777 1.534627
H 4.396959 -4.366451 -0.112703
H -0.349085 -3.683534 -0.574307
H -0.081200 -2.998547 1.080733
H 2.516047 -6.057378 -0.794379
H 2.767700 -4.772309 -2.028531
H 1.114939 -5.183742 -1.455212
H -1.476947 0.448230 -1.288672
H -1.557122 1.755208 1.504889
H -2.084017 2.570895 0.010997
H -3.604846 0.299053 -2.257593
H -3.264720 -0.022948 2.060352
H 0.875051 1.396095 1.969463
H -0.407364 3.218190 -1.751783
H -6.080719 -0.047135 -2.092027
H -5.739773 -0.363186 2.229443
H 3.244552 2.096501 1.482833
H 1.928853 3.900020 -2.247747
H -7.158982 -0.376272 0.154975
H 3.946818 5.093194 -1.816839
H 5.550029 4.272959 -1.699243
H 4.237040 3.539358 -2.696557


