%chk=000268782.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268782

0 1
O 6.780713 -2.243409 -0.086101
O -8.069438 -1.139339 0.449895
O -6.460994 -2.584137 0.420543
N 6.744567 0.063996 -0.061778
N -6.893968 -1.446618 0.331719
C 2.593934 0.847526 0.311922
C 5.337475 0.284808 0.066751
C -3.645095 0.357076 -0.323032
C 3.052151 -0.480887 0.270956
C 3.532217 1.893834 0.237671
C 4.410101 -0.768212 0.150779
C 4.892008 1.624525 0.111290
C 1.167150 1.166729 0.441483
C -4.565970 -0.673108 -0.071145
C -5.924069 -0.359225 0.060203
C -2.219773 0.028971 -0.463336
C -4.108372 1.679897 -0.448872
C 0.180558 0.427591 -0.094253
C -1.231223 0.775380 0.056596
C -6.389915 0.958428 -0.060447
C -5.468708 1.974773 -0.318351
C 7.389229 -1.194993 -0.131102
C 8.883659 -1.097957 -0.264289
H 2.339145 -1.303574 0.343552
H 3.193204 2.929354 0.271759
H 4.749904 -1.810298 0.122624
H 5.598671 2.448125 0.048770
H 0.948751 2.074942 1.011140
H -4.234214 -1.712409 0.029483
H -2.010818 -0.888553 -1.020915
H -3.398638 2.482017 -0.659018
H 7.319766 0.907245 -0.106847
H 0.397981 -0.471515 -0.677094
H -1.447261 1.681461 0.630251
H -7.457844 1.173570 0.045894
H -5.814070 3.004511 -0.419594
H 9.194174 -0.576644 -1.179330
H 9.317844 -2.112062 -0.314110
H 9.352867 -0.595819 0.592036


%chk=000268782-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268782

0 1
O 6.979861 -2.325056 -0.088495
O -8.348308 -1.098752 -0.028365
O -6.677983 -2.649531 -0.050792
N 6.846974 0.020394 -0.028108
N -7.099839 -1.429129 -0.033198
C 2.639910 0.845895 -0.003411
C 5.444530 0.245030 -0.020362
C -3.735297 0.340491 -0.008382
C 3.114985 -0.499587 -0.033744
C 3.619475 1.882636 0.018450
C 4.484827 -0.807612 -0.042385
C 4.992598 1.593228 0.010502
C 1.221512 1.205573 0.005475
C -4.724687 -0.682413 -0.022820
C -6.089531 -0.338618 -0.017559
C -2.320449 -0.045960 -0.014934
C -4.183659 1.698319 0.011141
C 0.141084 0.348580 -0.009313
C -1.232825 0.800184 -0.000145
C -6.535904 1.000353 0.001798
C -5.555693 2.017073 0.016143
C 7.545328 -1.194751 -0.060991
C 9.065040 -1.026432 -0.060285
H 2.399677 -1.328941 -0.051619
H 3.290820 2.928793 0.042009
H 4.831724 -1.841887 -0.066404
H 5.721149 2.414396 0.027790
H 1.008015 2.285605 0.026309
H -4.442569 -1.739707 -0.038118
H -2.124490 -1.128029 -0.033884
H -3.450901 2.511814 0.022057
H 7.423616 0.865601 -0.008338
H 0.302229 -0.738557 -0.029340
H -1.386152 1.889443 0.019538
H -7.606609 1.217519 0.005079
H -5.868740 3.066191 0.031111
H 9.406922 -0.448480 -0.939068
H 9.527184 -2.023164 -0.092641
H 9.411876 -0.504514 0.851003


