%chk=000259596.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259596

0 1
O -2.377375 0.147160 1.303071
O 3.505393 2.505190 -1.308823
O 1.820767 -0.409334 1.553017
O 4.295534 3.027961 0.724959
O 5.671611 -2.006261 -1.449243
O 5.393598 -1.968732 0.775612
O -1.636998 0.736197 -0.791747
N 2.769941 0.049870 -0.474590
N -0.667105 -1.027065 0.411811
C 3.971465 0.650335 0.126077
C 5.251140 0.110421 -0.532817
C 1.737676 -0.438166 0.341807
C 0.554442 -1.048646 -0.412880
C 3.956473 2.176549 -0.053077
C 5.423512 -1.356420 -0.260567
C -4.664037 0.299805 0.498706
C -3.540008 1.031890 1.172312
C -1.553849 0.045026 0.203961
C -4.704946 0.221239 -0.901664
C -5.673213 -0.302940 1.262511
C -5.756320 -0.447837 -1.532134
C -6.724642 -0.969758 0.626448
C -6.768215 -1.041274 -0.769446
H 3.979855 0.430204 1.243776
H 6.145403 0.650247 -0.138437
H 5.250994 0.304037 -1.632519
H 2.659813 0.172444 -1.480527
H 0.791438 -2.116044 -0.655116
H 0.359187 -0.538491 -1.390531
H -0.550110 -1.370792 1.374458
H -3.235828 1.946157 0.627155
H -3.733483 1.266268 2.236833
H -3.904235 0.675064 -1.493499
H -5.638827 -0.258388 2.349919
H -5.786423 -0.508252 -2.618870
H -7.508754 -1.436242 1.220320
H 3.448323 3.490239 -1.454731
H -7.587924 -1.560835 -1.262692
H 5.822529 -2.983826 -1.331644


%chk=000259596-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259596

0 1
O -2.791017 1.155620 0.966014
O 4.262669 2.745951 0.323088
O 1.750395 0.375485 1.507335
O 6.226080 1.618613 0.839722
O 5.020799 -2.778855 -1.759477
O 3.973238 -2.597229 0.307978
O -2.175283 1.456550 -1.301567
N 2.953993 0.541588 -0.479631
N -0.615262 0.917540 0.354265
C 4.247389 0.307774 0.158014
C 5.144349 -0.646713 -0.660755
C 1.785445 0.591125 0.260655
C 0.523550 0.918884 -0.550370
C 5.031925 1.594644 0.472197
C 4.630996 -2.074089 -0.614349
C -4.929997 0.075100 0.262541
C -4.227073 1.376031 0.587698
C -1.876655 1.192906 -0.102019
C -4.880449 -0.458152 -1.052233
C -5.647255 -0.625102 1.265223
C -5.534343 -1.673097 -1.353674
C -6.302724 -1.840200 0.964523
C -6.247481 -2.366517 -0.347109
H 4.022608 -0.164031 1.137131
H 6.161703 -0.632204 -0.224815
H 5.244699 -0.324376 -1.712032
H 2.936345 0.832839 -1.459192
H 0.389523 0.174377 -1.361170
H 0.638236 1.906321 -1.042737
H -0.432431 0.701073 1.339708
H -4.246595 2.073049 -0.268014
H -4.647824 1.854460 1.486233
H -4.316043 0.080000 -1.822250
H -5.688410 -0.218728 2.283446
H -5.491507 -2.077614 -2.371266
H -6.855209 -2.372884 1.746706
H 4.798732 3.539317 0.597308
H -6.756923 -3.307852 -0.582973
H 4.716609 -3.724604 -1.686955


