%chk=000225060.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225060

0 1
O 0.381908 -2.012650 1.318131
O 4.295790 -0.946589 -0.892449
N -0.449974 0.948513 0.934441
N 2.792288 0.770479 -0.599824
N 2.328652 -1.486150 0.205986
N 0.972577 2.426122 -0.128639
N -1.240526 3.270597 0.605636
C 0.706962 0.230880 0.554218
C 1.553346 1.164623 -0.103791
C -1.646708 0.334452 1.541997
C -0.258021 2.257886 0.491933
C 1.039190 -1.155504 0.756367
C 3.215511 -0.590012 -0.461400
C -2.583952 -0.182139 0.475364
C 3.669318 1.749139 -1.287035
C 2.793181 -2.897418 0.310102
C -2.539944 -1.536418 0.115570
C -3.489692 0.684707 -0.151236
C -3.417569 -2.025030 -0.855594
C -4.363845 0.189523 -1.122821
C -4.331764 -1.164570 -1.472571
H -2.155031 1.078402 2.195853
H -1.307085 -0.507749 2.204784
H 4.602877 1.255876 -1.619802
H 3.925042 2.577712 -0.602942
H 3.153249 2.171624 -2.167842
H 2.237554 -3.416506 1.113489
H 3.873720 -2.932391 0.537370
H 2.619805 -3.430118 -0.640257
H -1.811134 -2.203931 0.587356
H -3.502967 1.743882 0.105095
H -1.517423 3.466339 1.564921
H -0.953992 4.135451 0.140109
H -3.385461 -3.077375 -1.133950
H -5.068042 0.861139 -1.610851
H -5.015039 -1.547699 -2.228519


%chk=000225060-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225060

0 1
O 0.754578 -2.173836 1.549148
O 4.879335 -0.802623 -0.299085
N -0.363938 0.546306 0.481875
N 3.052666 0.653304 -0.540904
N 2.820993 -1.453959 0.615698
N 0.989502 2.007684 -0.668013
N -1.318967 2.639206 -0.307689
C 0.926176 -0.037251 0.419089
C 1.712237 0.889582 -0.281522
C -1.524475 0.016134 1.228958
C -0.267591 1.763733 -0.182576
C 1.417074 -1.284377 0.915277
C 3.657745 -0.546915 -0.088224
C -2.781128 -0.112775 0.372979
C 3.857258 1.640859 -1.284478
C 3.477072 -2.697695 1.077563
C -2.738940 -0.787473 -0.874499
C -4.014383 0.415889 0.828664
C -3.910563 -0.932222 -1.647540
C -5.190833 0.267653 0.056507
C -5.140636 -0.405410 -1.184823
H -1.723691 0.668124 2.101907
H -1.204569 -0.972269 1.609494
H 4.879125 1.242625 -1.364793
H 3.863464 2.604642 -0.748242
H 3.428714 1.799785 -2.288344
H 2.710506 -3.299103 1.588026
H 4.303584 -2.457442 1.766469
H 3.893946 -3.248509 0.218462
H -1.788203 -1.199275 -1.232641
H -4.058963 0.932236 1.796200
H -2.279063 2.324201 -0.178593
H -1.138337 3.507776 -0.804562
H -3.868297 -1.458296 -2.607649
H -6.139292 0.675847 0.422755
H -6.049305 -0.521058 -1.785694


