%chk=000179341.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179341

0 1
O 2.188701 1.826024 0.411502
N -0.021144 1.230194 0.282079
N 0.830607 -1.482489 -0.089179
N 3.078816 -0.718391 -0.211235
C -0.992317 0.200027 0.120787
C -0.438402 2.659534 0.421886
C -0.535400 -1.140147 -0.040829
C 1.355045 0.951627 0.234386
C 1.718154 -0.507935 0.003331
C -2.379860 0.462617 0.142039
C -0.754626 3.281418 -0.933513
C -1.477192 -2.187842 -0.166587
C -3.283163 -0.583582 0.013951
C -2.834834 -1.908860 -0.138722
C 3.610400 -2.097506 -0.191909
H -1.311903 2.716352 1.107843
H 0.400314 3.215620 0.913398
H -2.745101 1.481463 0.260378
H 0.133829 3.303990 -1.580695
H -1.531176 2.728233 -1.476148
H -1.098819 4.316213 -0.819429
H -1.109694 -3.209031 -0.286630
H -4.353528 -0.379673 0.031577
H -3.561023 -2.714327 -0.236160
H 3.707519 0.003587 0.153172
H 3.610026 -2.545506 0.816129
H 4.638219 -2.091918 -0.588945
H 2.994351 -2.751994 -0.840876


%chk=000179341-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179341

0 1
O 2.241141 1.849939 0.263449
N -0.024950 1.209662 0.234770
N 0.829480 -1.505809 -0.073661
N 3.058356 -0.725839 -0.011210
C -0.998213 0.181068 0.112864
C -0.421220 2.635099 0.394631
C -0.530494 -1.173031 -0.032919
C 1.346545 0.940743 0.180150
C 1.707652 -0.504361 0.024623
C -2.392380 0.446846 0.134809
C -0.756011 3.307972 -0.952082
C -1.486835 -2.219804 -0.140777
C -3.315929 -0.610202 0.025698
C -2.864441 -1.948684 -0.111087
C 3.634234 -2.061382 -0.154165
H -1.271181 2.684564 1.096569
H 0.440144 3.143910 0.857226
H -2.764713 1.470491 0.231027
H 0.128817 3.305423 -1.611122
H -1.582193 2.795562 -1.474977
H -1.052594 4.358619 -0.781389
H -1.100968 -3.238203 -0.247087
H -4.388773 -0.390832 0.044476
H -3.587657 -2.766491 -0.195440
H 3.640549 0.112154 0.073500
H 3.329899 -2.715927 0.683661
H 4.733148 -1.981827 -0.172850
H 3.286385 -2.541961 -1.087085


