%chk=000268962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268962

0 1
O -4.165864 2.196073 -0.268192
O -5.585809 0.531327 0.289920
N -1.929376 -1.935757 0.248715
C 2.003810 -0.376222 0.073522
C -0.614086 -1.365567 0.176646
C 3.383965 0.150933 0.014135
C 1.655982 -1.530674 -0.646847
C 1.031068 0.273344 0.850347
C 0.354446 -2.027798 -0.602824
C -0.272384 -0.218004 0.912633
C 4.466675 -0.663505 0.382641
C 3.616340 1.468688 -0.411384
C -3.139041 -1.229234 0.237822
C 5.769046 -0.160763 0.326184
C 4.921556 1.963753 -0.468126
C 5.998956 1.151582 -0.099386
C -4.327454 -2.103578 0.480728
C -3.213574 0.110609 0.002325
C -4.442407 0.870568 0.039645
C -5.299636 3.100149 -0.275732
H 2.407977 -2.035832 -1.254383
H 1.299115 1.165326 1.418927
H 0.093688 -2.913610 -1.177879
H -1.016653 0.283133 1.533778
H -1.969952 -2.955117 0.230184
H 4.289276 -1.683321 0.719420
H 2.779027 2.100717 -0.703614
H 6.606942 -0.793135 0.615440
H 5.099443 2.985201 -0.801182
H -4.213191 -2.764268 1.349105
H -5.240943 -1.493431 0.676570
H -4.572871 -2.719156 -0.396062
H 7.014405 1.540273 -0.143401
H -2.328501 0.699141 -0.255988
H -5.766494 3.114273 0.714059
H -6.020118 2.779091 -1.034400
H -4.838765 4.060193 -0.527044


%chk=000268962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268962

0 1
O -4.431639 2.239909 -0.318904
O -5.799870 0.459866 0.324924
N -1.941150 -1.800218 0.201926
C 2.098736 -0.350561 0.060506
C -0.626373 -1.261709 0.140501
C 3.508826 0.126751 0.015880
C 1.726032 -1.611340 -0.482780
C 1.069559 0.430757 0.654621
C 0.393618 -2.057974 -0.449265
C -0.266844 -0.007412 0.702741
C 4.595532 -0.790618 0.073829
C 3.810738 1.514020 -0.084601
C -3.190072 -1.170449 0.241103
C 5.931597 -0.339530 0.031497
C 5.146439 1.966932 -0.122976
C 6.215523 1.042677 -0.066094
C -4.319756 -2.133080 0.556529
C -3.364544 0.180845 -0.003881
C -4.643074 0.883545 0.035913
C -5.647271 3.077814 -0.334417
H 2.481161 -2.233942 -0.974954
H 1.324145 1.384779 1.129434
H 0.132816 -3.022705 -0.902359
H -1.014699 0.601912 1.215868
H -1.982249 -2.822125 0.179524
H 4.393766 -1.862070 0.185686
H 2.993914 2.240236 -0.165361
H 6.751406 -1.064742 0.085824
H 5.353287 3.039663 -0.208465
H -4.215684 -2.524411 1.586460
H -5.290862 -1.625784 0.474568
H -4.301012 -2.997010 -0.136934
H 7.252852 1.393684 -0.097234
H -2.517135 0.802994 -0.297797
H -6.122915 3.091483 0.661489
H -6.375623 2.692933 -1.069072
H -5.294579 4.080280 -0.617425


