%chk=000232641.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232641

0 1
O 1.430544 2.800551 0.000065
O -4.043993 -1.746998 -0.000489
O -2.057831 -2.588800 -0.000980
N 0.065487 -1.069838 -0.000412
N -2.831471 -1.628905 -0.000690
C -0.858133 -0.034684 -0.000306
C -0.409676 1.318068 -0.000085
C 1.464250 -0.829867 -0.000250
C 1.957054 0.489899 -0.000055
C 1.038350 1.648808 -0.000042
C -2.265589 -0.288612 -0.000416
C -1.335498 2.364480 0.000060
C 2.347315 -1.932439 -0.000287
C 3.350847 0.696820 0.000107
C -3.169580 0.798626 -0.000250
C -2.713837 2.107826 -0.000007
C 3.717347 -1.696627 -0.000111
C 4.223578 -0.384560 0.000088
H -0.273646 -2.055989 -0.000675
H -0.961573 3.398507 0.000216
H 1.963892 -2.951297 -0.000447
H 3.724617 1.727046 0.000235
H -4.247604 0.581753 -0.000290
H -3.421439 2.936841 0.000128
H 4.410466 -2.540686 -0.000129
H 5.300123 -0.220524 0.000221


%chk=000232641-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232641

0 1
O 1.463108 2.867208 0.000351
O -4.103842 -1.793829 -0.000474
O -1.996185 -2.651816 -0.000790
N 0.074909 -1.051007 -0.000428
N -2.825381 -1.631687 -0.000543
C -0.852946 -0.030947 -0.000344
C -0.407449 1.335730 -0.000098
C 1.457310 -0.831682 -0.000255
C 1.970490 0.501326 -0.000008
C 1.047994 1.660600 0.000040
C -2.273730 -0.276867 -0.000444
C -1.352268 2.385282 0.000002
C 2.344455 -1.942098 -0.000342
C 3.376689 0.698622 0.000164
C -3.195846 0.794227 -0.000321
C -2.738678 2.125044 -0.000111
C 3.731117 -1.720104 -0.000166
C 4.254386 -0.396793 0.000090
H -0.327062 -2.005962 -0.000691
H -0.957429 3.407092 0.000174
H 1.942348 -2.961462 -0.000541
H 3.740964 1.731114 0.000348
H -4.262253 0.553415 -0.000386
H -3.457917 2.948632 -0.000021
H 4.413977 -2.576467 -0.000229
H 5.337238 -0.238173 0.000222


