%chk=000200621.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200621

0 1
O -0.138813 2.190313 1.227215
N -2.284550 0.162964 0.094181
N 0.511796 1.782031 -0.919242
C -3.663837 -0.174407 -0.400085
C -1.294283 -0.872513 -0.358783
C -4.098242 -1.544108 0.145117
C -1.700367 -2.258123 0.172348
C -3.114176 -2.640205 -0.278235
C -1.896017 1.545008 -0.363592
C -2.796598 2.594970 0.295469
C -0.453303 1.840546 0.106926
C 1.950131 1.911244 -0.579324
C 2.561258 0.566542 -0.259267
C 2.259317 -0.054491 0.962593
C 3.418725 -0.063630 -1.169905
C 2.814114 -1.298502 1.268485
C 3.973872 -1.309052 -0.857510
C 3.672450 -1.927640 0.359197
H -3.732490 -0.168785 -1.509140
H -4.363255 0.605664 -0.023847
H -0.299218 -0.617086 0.072400
H -1.182444 -0.908809 -1.462702
H -5.118845 -1.777745 -0.207194
H -4.149910 -1.497549 1.252343
H -1.654039 -2.248752 1.281030
H -0.965793 -3.011547 -0.165240
H -3.407426 -3.609907 0.164666
H -3.143895 -2.781245 -1.374718
H -1.965579 1.653717 -1.478204
H -3.846508 2.478981 0.007400
H -2.479873 3.611242 0.035817
H -2.743584 2.507518 1.394484
H 0.315926 1.297859 -1.789151
H 2.052562 2.596784 0.301516
H 2.468257 2.409505 -1.428185
H 1.588847 0.443463 1.670593
H 3.659838 0.412223 -2.117880
H 2.580155 -1.777696 2.218125
H 4.643390 -1.795975 -1.564263
H 4.106303 -2.895804 0.600964


%chk=000200621-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200621

0 1
O -0.333357 1.865609 1.395860
N -2.467166 0.118789 0.062570
N 0.571537 1.620904 -0.733487
C -3.866663 -0.120917 -0.376562
C -1.604238 -1.056461 -0.230238
C -4.458179 -1.372413 0.305298
C -2.131272 -2.333533 0.453187
C -3.589548 -2.619707 0.033677
C -1.879437 1.373503 -0.479294
C -2.742902 2.622831 -0.192040
C -0.489123 1.622975 0.162358
C 1.962625 1.872564 -0.306154
C 2.798046 0.600201 -0.191559
C 2.468234 -0.378560 0.783284
C 3.907475 0.376343 -1.042574
C 3.233310 -1.558979 0.897471
C 4.675644 -0.806611 -0.929707
C 4.338924 -1.777879 0.039896
H -3.923671 -0.248900 -1.492696
H -4.481658 0.755036 -0.111755
H -0.581557 -0.844609 0.128737
H -1.536523 -1.234264 -1.339574
H -5.493133 -1.526179 -0.057003
H -4.507537 -1.187813 1.395786
H -2.081555 -2.192749 1.549932
H -1.471493 -3.183537 0.192616
H -3.987468 -3.497712 0.576580
H -3.621825 -2.864272 -1.048686
H -1.739012 1.289127 -1.595364
H -3.694544 2.607558 -0.749318
H -2.195813 3.534502 -0.491850
H -2.947742 2.683829 0.889819
H 0.400046 1.324080 -1.696363
H 1.881978 2.368590 0.678350
H 2.433555 2.578710 -1.015040
H 1.621101 -0.197499 1.456034
H 4.175411 1.130563 -1.793775
H 2.974732 -2.304610 1.657862
H 5.533081 -0.967714 -1.592962
H 4.933613 -2.693792 0.131086


