%chk=000129701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000129701

1 1
O -1.204814 2.698479 0.243894
O 2.861662 1.286986 -1.828826
O -0.744742 -1.515326 -1.022355
N -2.597705 -0.750057 -0.167547
N -1.800709 -1.760944 -0.491682
N 3.816942 -1.027792 -0.219596
N 4.779045 -1.577835 -0.358818
C -1.324037 1.305468 0.562354
C -2.303015 0.675863 -0.461394
C 0.083908 0.764522 0.384610
C -3.908901 -1.084709 0.475934
C 0.907255 1.276222 -0.603145
C 0.548533 -0.290278 1.235935
C 2.178563 0.712169 -0.831456
C 1.774014 -0.856812 1.037642
C -3.952359 -0.639799 1.930817
C 2.640029 -0.383880 -0.026278
H -1.687805 1.183616 1.609162
H -1.873736 0.763861 -1.491594
H -3.243431 1.271309 -0.479447
H -4.726215 -0.608429 -0.113973
H -4.071460 -2.189718 0.404769
H 0.576630 2.125693 -1.227291
H -0.105978 -0.658027 2.035115
H 2.125557 -1.680057 1.668964
H -3.146826 -1.086623 2.526903
H -3.902628 0.448025 2.046862
H -4.897803 -0.960648 2.398910
H -1.948391 3.215268 0.632142
H 3.757318 0.910451 -2.040214


%chk=000129701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129701

1 1
O -1.122168 2.738923 0.124845
O 3.023497 1.276132 -1.855597
O -0.829398 -1.336570 -1.133491
N -2.719729 -0.714408 -0.120233
N -1.921122 -1.732393 -0.561567
N 3.910613 -0.943219 -0.175869
N 4.959642 -1.443895 -0.312181
C -1.262281 1.336464 0.513501
C -2.377413 0.698176 -0.390898
C 0.113798 0.711296 0.316707
C -3.997639 -1.119043 0.522745
C 0.980271 1.245993 -0.660110
C 0.561787 -0.343147 1.182380
C 2.260783 0.710074 -0.860369
C 1.823406 -0.896267 1.032344
C -4.091188 -0.695413 2.000147
C 2.683973 -0.386064 -0.006229
H -1.561769 1.235833 1.577501
H -2.043447 0.784562 -1.441783
H -3.302837 1.282883 -0.251825
H -4.830021 -0.683738 -0.061300
H -4.049560 -2.215849 0.422554
H 0.667400 2.095419 -1.271599
H -0.096647 -0.723677 1.968789
H 2.176136 -1.707986 1.674537
H -3.293764 -1.163052 2.603521
H -4.038986 0.401724 2.124952
H -5.061715 -1.024311 2.409677
H -1.880402 3.281590 0.457721
H 3.927683 0.896962 -1.998472


