%chk=000241316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241316

0 1
O 0.000059 0.975906 0.007045
N 2.377772 -0.390827 -0.000828
N -2.377712 -0.390722 -0.001123
N 1.178706 -1.052519 -0.005005
N -1.178676 -1.052466 -0.005428
C 4.775747 -0.366966 0.000075
C -4.775686 -0.366754 -0.001127
C 5.962021 -1.123811 -0.002372
C -5.961993 -1.123537 -0.005749
C 4.847392 1.036341 0.006592
C -4.847271 1.036541 0.007962
C 7.200757 -0.479879 0.001664
C -7.200701 -0.479555 -0.001300
C 6.091379 1.672030 0.010590
C -6.091231 1.672281 0.012359
C 7.268508 0.917669 0.008141
C -7.268392 0.917981 0.007751
C 3.484190 -1.084179 -0.004379
C -3.484160 -1.084018 -0.006086
C 0.000033 -0.223018 -0.000182
H 5.920686 -2.210947 -0.007389
H -5.920704 -2.210663 -0.012782
H 3.927935 1.628512 0.008548
H -3.927788 1.628665 0.011587
H 8.116972 -1.068015 -0.000237
H -8.116942 -1.067643 -0.004887
H 6.141202 2.760291 0.015641
H -6.141007 2.760533 0.019409
H 8.235981 1.416229 0.011267
H -8.235845 1.416580 0.011200
H 3.559006 -2.181473 -0.010399
H -3.559022 -2.181299 -0.013693
H 1.125573 -2.074516 -0.010309
H -1.125588 -2.074452 -0.012754


%chk=000241316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241316

0 1
O 0.000063 1.344973 0.007970
N 2.405666 -0.122775 0.000717
N -2.405598 -0.122677 0.000337
N 1.163074 -0.716379 -0.002311
N -1.163030 -0.716328 -0.003344
C 4.821899 -0.355389 0.000304
C -4.821839 -0.355182 -0.001019
C 5.933925 -1.242239 -0.003730
C -5.933907 -1.241971 -0.006732
C 5.056281 1.050357 0.007240
C -5.056155 1.050563 0.008141
C 7.252497 -0.738995 -0.000896
C -7.252455 -0.738669 -0.003358
C 6.373191 1.547182 0.010059
C -6.373042 1.547446 0.011490
C 7.477246 0.657108 0.006018
C -7.477138 0.657432 0.005777
C 3.462629 -0.909345 -0.002652
C -3.462594 -0.909195 -0.004560
C 0.000038 0.099919 0.001441
H 5.762629 -2.326669 -0.009069
H -5.762661 -2.326399 -0.013793
H 4.193981 1.724818 0.010329
H -4.193824 1.724977 0.012491
H 8.101572 -1.431538 -0.004048
H -8.101563 -1.431165 -0.007817
H 6.545184 2.629334 0.015423
H -6.544985 2.629596 0.018569
H 8.500382 1.049249 0.008237
H -8.500256 1.049619 0.008414
H 3.376402 -2.017091 -0.007834
H -3.376414 -2.016935 -0.011564
H 1.076387 -1.745695 -0.006809
H -1.076384 -1.745638 -0.009618


