%chk=000219878.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219878

0 1
O 6.871504 1.207300 -0.000488
O 7.187056 -0.931569 0.032487
N -3.871300 -0.534175 0.028228
N 0.842499 -0.783464 0.032131
N 0.330600 -2.079065 0.053561
N -2.625880 1.481483 -0.004758
N -0.179765 1.513527 -0.005844
N 6.467086 0.054935 0.017446
C -5.151591 0.226844 0.016569
C -6.339743 -0.739108 -0.029276
C -1.431853 -0.628547 0.030207
C -2.657959 0.098236 0.018083
C -0.221381 0.149376 0.017034
C -7.664133 0.038680 -0.041770
C 2.257078 -0.564476 0.028291
C -1.008144 -2.004199 0.052665
C -1.411783 2.121394 -0.015609
C -8.864492 -0.902254 -0.087468
C 2.768778 0.748066 0.008807
C 3.129511 -1.676574 0.044279
C -1.436676 3.611432 -0.036799
C 4.145546 0.946950 0.005244
C 4.502968 -1.471515 0.040725
C 5.010329 -0.159842 0.021193
H -5.194910 0.879946 0.920812
H -5.157495 0.917270 -0.861078
H -6.320359 -1.423120 0.842465
H -6.281336 -1.385564 -0.927688
H -3.913464 -1.546603 0.047695
H -7.692738 0.723327 -0.913241
H -7.731167 0.686550 0.855294
H -1.639212 -2.880304 0.067219
H -8.893772 -1.568643 0.782467
H -9.806132 -0.339711 -0.097039
H -8.854498 -1.532805 -0.984177
H 2.098978 1.618242 -0.003664
H 2.726931 -2.694621 0.059417
H -0.426363 4.041722 -0.131133
H -2.046748 3.987499 -0.874434
H -1.887015 4.009847 0.887467
H 4.562078 1.961452 -0.009931
H 5.196668 -2.320720 0.053009


%chk=000219878-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219878

0 1
O 6.918662 1.264647 0.029160
O 7.239173 -0.993895 0.052266
N -3.878324 -0.497699 -0.000586
N 0.838427 -0.774562 0.021700
N 0.355934 -2.104634 0.034273
N -2.607841 1.478353 -0.018454
N -0.158926 1.504265 -0.007891
N 6.475628 0.049888 0.038624
C -5.151275 0.251400 -0.011831
C -6.348164 -0.717496 -0.028179
C -1.421855 -0.636325 0.010443
C -2.651219 0.107520 -0.002754
C -0.223808 0.139790 0.007616
C -7.699690 0.032502 -0.037832
C 2.244409 -0.553321 0.025545
C -0.992869 -2.004907 0.027124
C -1.387183 2.109639 -0.019588
C -8.909994 -0.924675 -0.051411
C 2.765012 0.769293 0.014825
C 3.116201 -1.675437 0.040523
C -1.417189 3.616708 -0.033851
C 4.156011 0.964051 0.019166
C 4.504959 -1.477140 0.044764
C 5.013777 -0.158078 0.034055
H -5.194197 0.911421 0.875940
H -5.173044 0.916533 -0.896054
H -6.306349 -1.379779 0.861629
H -6.288067 -1.371472 -0.922832
H -3.920791 -1.516921 0.016815
H -7.741330 0.697605 -0.923597
H -7.757160 0.692040 0.851240
H -1.579743 -2.922567 0.034030
H -8.910034 -1.579415 0.840039
H -9.862849 -0.365725 -0.058511
H -8.894028 -1.574664 -0.946194
H 2.073568 1.615202 0.003261
H 2.688206 -2.679354 0.048614
H -0.396453 4.019133 -0.109699
H -2.026090 3.979582 -0.880247
H -1.891963 3.996823 0.888837
H 4.587077 1.968382 0.011235
H 5.201094 -2.319514 0.056188


