%chk=000269215.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269215

0 1
O -6.404791 0.776299 1.900567
O 6.403219 0.777077 1.903621
N -4.723243 -0.453533 1.031657
N 4.722694 -0.453130 1.033267
C 0.000276 -1.006412 -2.153708
C -1.241699 -0.847713 -1.315309
C 1.241940 -0.847613 -1.314851
C -3.025177 0.541565 -0.400689
C 3.024260 0.542080 -0.398566
C -3.561853 -0.593310 0.255471
C 3.561575 -0.593013 0.256692
C -1.855011 0.386477 -1.183683
C 1.854385 0.386889 -1.181973
C -2.924315 -1.872742 0.125464
C 2.924956 -1.872766 0.125394
C -1.784676 -1.976393 -0.651185
C 1.785546 -1.976511 -0.651592
C -3.696007 1.830766 -0.246779
C 3.694154 1.831608 -0.243340
C -3.480663 -3.074154 0.817688
C 3.481978 -3.074415 0.816665
C -4.817760 1.931046 0.511570
C 4.815676 1.931981 0.515336
C -5.407386 0.794863 1.201695
C 5.405935 0.795585 1.204574
C -3.135586 3.033710 -0.931076
C 3.133033 3.034774 -0.926666
H 0.000381 -1.996184 -2.659676
H 0.000408 -0.274170 -2.989400
H -1.434180 1.256325 -1.686610
H 1.433062 1.256900 -1.684201
H -1.285306 -2.939809 -0.758090
H 1.286876 -2.940177 -0.759462
H -5.112400 -1.270472 1.507944
H 5.112300 -1.270226 1.508915
H -3.496961 -2.942177 1.910007
H -4.504851 -3.298429 0.484360
H -2.887274 -3.979214 0.624780
H 4.506636 -3.297323 0.483871
H 3.497321 -2.943628 1.909143
H 2.889637 -3.979845 0.622280
H -5.349603 2.872940 0.653134
H 5.346839 2.874113 0.657859
H -2.111572 3.247916 -0.590502
H -3.727841 3.941391 -0.741727
H -3.105747 2.898087 -2.022539
H 3.103484 2.900110 -2.018254
H 3.724625 3.942694 -0.736393
H 2.108808 3.247964 -0.586082


%chk=000269215-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269215

0 1
O -6.508827 0.792880 1.967430
O 6.507175 0.793290 1.970725
N -4.764599 -0.444829 1.036098
N 4.764126 -0.444749 1.037626
C 0.000281 -1.016588 -2.171827
C -1.278602 -0.862754 -1.345110
C 1.278901 -0.862719 -1.344705
C -3.079270 0.549590 -0.414094
C 3.078247 0.549998 -0.411705
C -3.616273 -0.598288 0.256253
C 3.616073 -0.598232 0.257382
C -1.910499 0.385635 -1.209054
C 1.909753 0.386027 -1.207056
C -2.996937 -1.881275 0.128366
C 2.997831 -1.881574 0.127850
C -1.843752 -1.982471 -0.670723
C 1.844868 -1.982774 -0.671572
C -3.759753 1.836842 -0.254141
C 3.757646 1.837619 -0.250110
C -3.578848 -3.092715 0.833135
C 3.580628 -3.093375 0.831266
C -4.892933 1.916932 0.533663
C 4.890622 1.917705 0.537985
C -5.470513 0.767689 1.234063
C 5.469014 0.768110 1.237141
C -3.218035 3.069956 -0.948976
C 3.215038 3.071115 -0.943572
H 0.000391 -2.010674 -2.657629
H 0.000376 -0.262999 -2.981129
H -1.494577 1.256060 -1.728489
H 1.493176 1.256737 -1.725487
H -1.366644 -2.965148 -0.779318
H 1.368644 -2.965734 -0.781492
H -5.159744 -1.254847 1.522550
H 5.159839 -1.255016 1.523200
H -3.597930 -2.962348 1.933668
H -4.616038 -3.305719 0.505385
H -2.979084 -3.993068 0.622483
H 4.618136 -3.304991 0.503619
H 3.599195 -2.964405 1.931975
H 2.981789 -3.994021 0.619233
H -5.422950 2.863536 0.674193
H 5.419839 2.864576 0.679723
H -2.185198 3.293373 -0.620559
H -3.843628 3.950495 -0.731110
H -3.189383 2.932649 -2.046589
H 3.186668 2.935092 -2.041353
H 3.839890 3.951898 -0.724564
H 2.181972 3.293313 -0.615047


