%chk=000257138.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257138

0 1
O -0.837496 -1.706953 0.155534
O -2.458806 2.613082 -0.112834
O 2.015194 2.094928 0.401160
N -1.703694 0.409376 0.036144
N -0.203229 2.298415 0.096487
C 0.770057 0.043596 0.140632
C -3.071954 -0.112093 -0.006083
C -0.611828 -0.515313 0.122187
C -1.540779 1.831362 -0.009219
C 0.971964 1.500491 0.229346
C 1.772981 -0.865092 0.036862
C 3.219841 -0.658626 -0.001418
C -3.402480 -1.099434 -0.946430
C -4.025050 0.385665 0.895542
C -4.709342 -1.592773 -0.974840
C -5.327481 -0.116964 0.845437
C 3.965760 -1.415901 -0.930963
C 3.887878 0.216314 0.869019
C -5.670874 -1.104009 -0.084418
C 5.349847 -1.275286 -0.998585
C 5.280399 0.339777 0.806434
C 6.010240 -0.397658 -0.127280
H 1.477561 -1.934020 -0.058111
H -0.079390 3.325220 0.097018
H -2.649584 -1.491787 -1.629072
H -3.763046 1.166106 1.609430
H -4.977119 -2.363544 -1.697074
H -6.078138 0.265784 1.536565
H 3.457984 -2.103496 -1.607615
H 3.323726 0.808973 1.594610
H -6.687699 -1.491760 -0.115219
H 5.921226 -1.849340 -1.727123
H 5.790788 1.023565 1.484728
H 7.093939 -0.292804 -0.180852


%chk=000257138-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257138

0 1
O -0.752937 -1.544040 -0.276507
O -2.720223 2.647465 0.458635
O 1.885114 2.493571 0.430890
N -1.757341 0.524860 0.084374
N -0.408391 2.452019 0.427810
C 0.752031 0.339825 0.064399
C -3.079010 -0.088755 -0.028801
C -0.604864 -0.308886 -0.058446
C -1.704544 1.919683 0.332093
C 0.833707 1.794809 0.313007
C 1.809338 -0.555310 -0.075612
C 3.267063 -0.515906 -0.050861
C -3.478848 -0.657280 -1.256541
C -3.936732 -0.102628 1.091144
C -4.755391 -1.250471 -1.361413
C -5.214761 -0.691593 0.977090
C 3.908071 -1.784944 -0.256104
C 4.097443 0.632466 0.152267
C -5.625728 -1.267239 -0.247063
C 5.308096 -1.906245 -0.258974
C 5.499558 0.502214 0.148534
C 6.111888 -0.757840 -0.055589
H 1.419205 -1.571934 -0.252120
H -0.366479 3.461401 0.601338
H -2.796566 -0.646833 -2.111756
H -3.613622 0.350429 2.033391
H -5.068716 -1.696762 -2.311176
H -5.886448 -0.699775 1.842039
H 3.286610 -2.675202 -0.412820
H 3.621805 1.603437 0.307888
H -6.617256 -1.725229 -0.332242
H 5.773856 -2.884405 -0.417714
H 6.121215 1.390277 0.305574
H 7.204252 -0.845376 -0.056733


