%chk=000253166.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253166

0 1
O 6.249315 0.401253 1.207254
O -5.066931 -0.056272 0.966291
O 5.638573 0.930099 -0.881226
N -0.745712 -0.936861 -0.583982
N -1.556860 1.467065 -0.595466
N -2.641204 -1.880476 0.296391
N -3.812548 1.721018 0.219457
C 0.643690 -0.810272 -1.051916
C 1.580648 -0.414786 0.101840
C 3.009675 -0.212285 -0.408148
C -1.660157 0.094787 -0.360508
C 3.961470 0.140489 0.738893
C -2.833008 -0.504075 0.174587
C -1.403599 -2.135486 -0.141534
C -4.017071 0.302993 0.509015
C 5.309155 0.534369 0.210868
C -2.728766 2.228639 -0.270374
H 0.960546 -1.784593 -1.495374
H 0.692290 -0.064225 -1.878402
H 1.558235 -1.196445 0.889841
H 1.212918 0.505675 0.598135
H 3.041076 0.590243 -1.176650
H 3.371177 -1.126670 -0.922953
H 4.063386 -0.707522 1.453336
H 3.560309 0.979434 1.351768
H -0.922161 -3.099751 -0.191783
H -0.720773 1.876486 -0.989611
H -2.631683 3.308284 -0.469556
H 7.163807 0.665084 0.915008


%chk=000253166-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253166

0 1
O 6.282550 0.651834 1.297845
O -5.140945 -0.144418 0.950892
O 5.811866 0.344742 -0.956209
N -0.777486 -0.924151 -0.596002
N -1.592460 1.450127 -0.540942
N -2.677277 -1.920370 0.219195
N -3.857305 1.717112 0.266530
C 0.618571 -0.773827 -1.044652
C 1.579440 -0.361927 0.096000
C 3.027959 -0.204070 -0.412908
C -1.701069 0.081944 -0.349397
C 3.996619 0.176333 0.722867
C -2.873268 -0.526866 0.147585
C -1.431228 -2.124118 -0.223339
C -4.051305 0.282991 0.497348
C 5.416302 0.386222 0.228917
C -2.735397 2.204374 -0.204316
H 0.935465 -1.741336 -1.473416
H 0.657252 -0.035173 -1.869935
H 1.533816 -1.128751 0.893283
H 1.232463 0.586649 0.553295
H 3.076681 0.566425 -1.206363
H 3.370266 -1.146201 -0.882624
H 4.018191 -0.598855 1.512550
H 3.675184 1.108214 1.228840
H -0.938094 -3.089890 -0.312070
H -0.755676 1.902528 -0.913275
H -2.630947 3.284994 -0.365650
H 7.205627 0.791665 0.951153


