%chk=000249111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249111

0 1
O -2.260892 -2.927480 -0.436767
O 0.381416 -3.560703 0.867217
N -1.078084 -1.058604 -1.128503
C 0.206942 -0.367389 -0.806360
C -2.198364 -0.292206 -1.712810
C 0.967754 -1.357463 0.043123
C -1.253609 -2.261101 -0.433188
C 0.108139 -2.560939 0.267386
C -2.844330 0.625688 -0.700617
C 2.209164 -1.226597 0.521183
C 3.066816 -0.048017 0.305422
C -3.638886 0.080780 0.319331
C -2.655402 2.011690 -0.775354
C -4.241965 0.921540 1.257078
C -3.263903 2.849350 0.165017
C 4.263924 -0.188595 -0.414573
C 2.707140 1.202114 0.831964
C -4.056052 2.306615 1.181019
C 5.088779 0.921226 -0.613739
C 3.542118 2.305246 0.635221
C 4.730401 2.167708 -0.089366
H 0.029792 0.590365 -0.268028
H 0.752049 -0.130342 -1.747221
H -2.951288 -1.027209 -2.099275
H -1.823254 0.269740 -2.597582
H 2.663309 -2.031878 1.117406
H -3.781165 -1.001927 0.376765
H -2.042774 2.441881 -1.564669
H -4.859382 0.497156 2.047958
H -3.120746 3.926824 0.103656
H 4.546834 -1.159125 -0.820164
H 1.785966 1.309013 1.402997
H -4.529433 2.960073 1.911550
H 6.015518 0.813541 -1.176526
H 3.265988 3.274418 1.049160
H 5.377978 3.029607 -0.242909


%chk=000249111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249111

0 1
O -2.107084 -3.224439 -1.063213
O 0.750725 -3.781783 -0.180191
N -1.269137 -1.010362 -1.098682
C -0.028433 -0.257934 -0.818723
C -2.503499 -0.346492 -1.537340
C 0.962622 -1.332847 -0.407332
C -1.179468 -2.387152 -0.902353
C 0.272069 -2.650341 -0.452632
C -3.040658 0.653320 -0.515748
C 2.282272 -1.238240 -0.043273
C 3.164704 -0.076070 0.072474
C -3.276480 0.248325 0.823368
C -3.326976 1.988179 -0.890958
C -3.790589 1.163108 1.767423
C -3.845130 2.905881 0.052528
C 4.519888 -0.312503 0.458541
C 2.764078 1.273843 -0.172417
C -4.076975 2.495798 1.384863
C 5.437826 0.746637 0.592684
C 3.683060 2.332259 -0.036652
C 5.022362 2.076339 0.344836
H -0.206092 0.486413 -0.016023
H 0.301848 0.292810 -1.724493
H -3.230503 -1.163473 -1.710576
H -2.326711 0.162346 -2.506185
H 2.745280 -2.209026 0.197828
H -3.063602 -0.786075 1.119354
H -3.149490 2.311165 -1.924775
H -3.973485 0.838045 2.797723
H -4.065952 3.935406 -0.251003
H 4.843491 -1.342400 0.651935
H 1.736802 1.504308 -0.463950
H -4.478380 3.204718 2.117509
H 6.471647 0.540224 0.889180
H 3.358058 3.361051 -0.226615
H 5.732411 2.903962 0.448687


