%chk=000190424.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190424

0 1
O 1.435752 1.022665 0.338652
N 0.818675 -1.203244 0.083661
N -1.178113 0.130582 -0.234584
N -3.325363 -0.984634 -0.176280
N -1.264263 -2.283966 0.129717
N -3.381048 -3.341028 0.079489
C 4.186873 0.532263 0.176716
C 3.191785 -0.631827 0.075646
C 5.635763 0.041003 0.072942
C -3.250688 1.442526 -0.543166
C -2.760230 2.542958 0.410886
C 1.767554 -0.120363 0.179679
C 6.623367 1.200780 0.173118
C -2.551435 0.135578 -0.299386
C -0.579422 -1.085490 -0.004436
C -3.497168 3.855562 0.167033
C -2.641989 -2.182120 0.019104
H 3.974248 1.276927 -0.617817
H 4.031417 1.077198 1.130345
H 3.336080 -1.167972 -0.886113
H 3.398362 -1.373389 0.874728
H 5.787570 -0.495770 -0.884232
H 5.845542 -0.696949 0.872052
H -3.070116 1.748575 -1.598278
H -4.351371 1.309305 -0.447929
H -2.895552 2.217893 1.460839
H -1.664481 2.686644 0.279883
H 7.658255 0.848116 0.097565
H 6.527619 1.733629 1.126637
H 6.468522 1.935107 -0.626403
H 1.160274 -2.173924 0.125661
H -3.342398 4.223579 -0.853886
H -4.577048 3.753176 0.322032
H -3.140476 4.635815 0.850217
H -2.934747 -4.210212 0.326546
H -4.388150 -3.290193 0.109561


%chk=000190424-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190424

0 1
O 1.575423 1.210874 -0.339259
N 0.824677 -1.006771 0.000716
N -1.203642 0.242293 -0.329610
N -3.304014 -0.962567 -0.113231
N -1.182615 -2.139043 0.188188
N -3.237726 -3.255917 0.370041
C 4.313958 0.485004 0.152320
C 3.238946 -0.590678 -0.097643
C 5.748812 -0.080245 0.062435
C -3.317684 1.454612 -0.617871
C -3.099459 2.499635 0.512962
C 1.815936 -0.005504 -0.155706
C 6.824695 0.998960 0.311309
C -2.578798 0.169555 -0.344159
C -0.573624 -0.931299 -0.054095
C -3.797185 3.839338 0.200801
C -2.551231 -2.093803 0.143656
H 4.179081 1.300607 -0.582017
H 4.152659 0.941727 1.148442
H 3.436796 -1.093665 -1.068148
H 3.295730 -1.380371 0.679338
H 5.902795 -0.531556 -0.939592
H 5.873260 -0.902540 0.797043
H -2.936404 1.882635 -1.564876
H -4.390933 1.228566 -0.737387
H -3.484967 2.087781 1.466445
H -2.011780 2.651973 0.639217
H 7.844505 0.578334 0.240934
H 6.711171 1.446757 1.316449
H 6.742403 1.815979 -0.429616
H 1.149353 -1.960537 0.188281
H -3.402224 4.282136 -0.732835
H -4.888543 3.705849 0.076709
H -3.636162 4.569409 1.014930
H -2.725417 -4.112194 0.565048
H -4.254191 -3.236533 0.340980


