%chk=000267955.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267955

0 1
O 0.960305 1.483032 -0.754627
O -5.283375 1.236338 0.064184
O -3.653045 2.551693 -0.473279
N 0.448559 -0.702665 -0.263448
N 2.685631 -0.061847 -0.915261
N 0.817401 -2.005525 -0.010497
N -4.104774 1.465665 -0.154293
C 4.522611 1.208853 0.236379
C 3.753580 0.962188 -1.067483
C -0.956941 -0.551706 -0.111252
C 5.439300 0.040388 0.620364
C -1.455334 -1.844810 0.256070
C 1.394012 0.353017 -0.642095
C -1.800501 0.562311 -0.254697
C -0.284799 -2.704066 0.300367
C -2.829266 -2.028608 0.483440
C 6.245489 0.352479 1.878472
C -3.150628 0.333457 -0.020713
C -3.670797 -0.938733 0.343621
H 3.815404 1.424158 1.062812
H 5.124253 2.134533 0.124560
H 4.434866 0.607853 -1.875035
H 3.295610 1.916860 -1.426420
H 6.128639 -0.191033 -0.215801
H 4.839867 -0.876565 0.784355
H 2.988418 -1.012756 -0.689326
H -1.402085 1.549320 -0.533796
H -0.267532 -3.756657 0.545348
H -3.213564 -3.009183 0.762666
H 5.595233 0.556093 2.737558
H 6.893053 -0.488726 2.152714
H 6.890094 1.228670 1.742106
H -4.749786 -1.034630 0.510706


%chk=000267955-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267955

0 1
O 0.987730 1.610370 -0.826508
O -5.358731 1.181435 0.293295
O -3.670076 2.621295 -0.229233
N 0.444838 -0.630009 -0.367056
N 2.664381 -0.045644 -0.838627
N 0.884080 -1.956989 -0.215945
N -4.118481 1.443088 0.042256
C 4.628419 1.221995 0.110319
C 3.790794 0.855258 -1.137606
C -0.934608 -0.519085 -0.159339
C 5.320466 0.012705 0.779704
C -1.395406 -1.848979 0.139885
C 1.387604 0.421355 -0.696802
C -1.800891 0.593264 -0.202245
C -0.217228 -2.679085 0.085637
C -2.771667 -2.078254 0.406143
C 6.175069 0.422335 1.998733
C -3.151608 0.311987 0.069623
C -3.652829 -0.989772 0.370443
H 3.975468 1.735103 0.843117
H 5.397131 1.958195 -0.200891
H 4.432915 0.365609 -1.894799
H 3.364853 1.768618 -1.587474
H 5.960886 -0.502466 0.033881
H 4.554250 -0.721279 1.101911
H 2.809239 -1.048505 -0.683642
H -1.452964 1.602011 -0.429186
H -0.127584 -3.751327 0.250971
H -3.138554 -3.083247 0.634974
H 5.552646 0.912157 2.770693
H 6.663119 -0.453783 2.463084
H 6.967892 1.135725 1.705199
H -4.721255 -1.104685 0.567182


