%chk=000243031.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243031

0 1
O 3.006987 -0.746883 -1.351436
N 1.153153 0.154350 0.478830
N 2.450407 0.733233 0.435417
N 4.695798 0.344984 -0.246443
C -1.171149 0.254159 -0.312406
C 0.260499 0.558347 -0.665542
C -1.549806 -1.062963 -0.009505
C -2.129684 1.277307 -0.292625
C -2.878238 -1.351477 0.310774
C -3.458919 0.981519 0.024491
C -3.834933 -0.330634 0.327247
C 3.341760 0.015432 -0.469399
H 0.579325 -0.061891 -1.545279
H 0.385225 1.617968 -0.973134
H -0.798966 -1.855528 -0.023070
H -1.847050 2.300861 -0.527965
H 0.727980 0.435260 1.381677
H -3.169205 -2.374203 0.545897
H -4.202565 1.776488 0.035171
H -4.869975 -0.558111 0.574090
H 2.488240 1.760387 0.306930
H 5.379305 -0.257510 -0.691396
H 4.987612 0.699904 0.652876


%chk=000243031-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243031

0 1
O 2.295798 -1.275731 -0.259684
N 1.089603 1.115472 0.608649
N 2.475622 0.976701 0.345395
N 4.387291 -0.230781 -0.330532
C -1.123824 0.545899 -0.348912
C 0.239459 1.150882 -0.638064
C -1.241229 -0.864495 -0.215464
C -2.276837 1.352338 -0.188968
C -2.493758 -1.451986 0.067412
C -3.532389 0.764143 0.091224
C -3.643182 -0.639399 0.219823
C 3.014419 -0.240092 -0.096144
H 0.737349 0.572118 -1.442248
H 0.143619 2.200469 -0.970328
H -0.344491 -1.485370 -0.339718
H -2.190047 2.441827 -0.281855
H 0.782132 0.344327 1.222775
H -2.576187 -2.540586 0.164307
H -4.418935 1.397602 0.209402
H -4.615626 -1.096564 0.435902
H 3.055716 1.783716 0.574389
H 4.811330 -1.108150 -0.619859
H 4.969969 0.598660 -0.242301


