%chk=000187840.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187840

0 1
O 4.423686 0.190820 -0.042008
N -0.274661 1.456413 0.001264
C 0.847793 0.610609 -0.008990
C 0.391740 -0.761669 -0.004696
C -1.058404 -0.728357 0.008714
C -1.449914 0.657232 0.012255
C 2.209543 0.933048 -0.021578
C 1.320894 -1.800589 -0.013232
C -2.041090 -1.717301 0.017870
C -2.793862 1.042157 0.024702
C -0.261239 2.922844 0.001259
C 3.091764 -0.150970 -0.029678
C 2.682564 -1.502826 -0.025831
C -3.383091 -1.330524 0.030283
C -3.750685 0.026497 0.033625
H 2.580176 1.950367 -0.025041
H 0.982257 -2.836347 -0.010050
H -1.763035 -2.768461 0.015348
H -3.082662 2.087323 0.027335
H -0.762388 3.318058 0.903946
H 0.773741 3.307349 -0.009884
H -0.781739 3.318174 -0.890351
H 3.418131 -2.297974 -0.032594
H -4.161090 -2.091133 0.037527
H -4.807815 0.289761 0.043421
H 5.012187 -0.603000 -0.047319


%chk=000187840-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187840

0 1
O 4.496687 0.223569 -0.042445
N -0.279603 1.444741 0.001351
C 0.842570 0.597154 -0.008912
C 0.389328 -0.771929 -0.004729
C -1.067424 -0.736219 0.008856
C -1.445639 0.652154 0.012279
C 2.211891 0.930258 -0.021416
C 1.342884 -1.813038 -0.013619
C -2.075269 -1.727718 0.018288
C -2.795638 1.059935 0.024751
C -0.276345 2.905648 0.001297
C 3.136270 -0.135943 -0.029988
C 2.717369 -1.498584 -0.026279
C -3.430919 -1.328552 0.030778
C -3.784550 0.049276 0.033919
H 2.586074 1.957515 -0.024635
H 1.023302 -2.860940 -0.010784
H -1.812374 -2.791861 0.015961
H -3.077350 2.118530 0.027387
H -0.775552 3.303676 0.904931
H 0.760230 3.274758 -0.010033
H -0.794964 3.303453 -0.891420
H 3.467560 -2.299878 -0.033255
H -4.221853 -2.086600 0.038164
H -4.842963 0.333891 0.043711
H 5.069080 -0.581794 -0.047861


