%chk=000219956.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219956

0 1
O -0.025971 2.156161 0.267550
O -2.685901 -1.884386 -0.360423
N -1.796876 0.205832 0.024695
N 3.731059 -0.983539 0.360002
C -0.410094 -0.147466 0.080986
C 0.549000 0.900672 0.214962
C 0.058641 -1.465692 0.016632
C 1.914800 0.646899 0.274713
C 2.355268 -0.695804 0.211763
C 1.424741 -1.743140 0.077088
C -2.852921 -0.688144 -0.200538
C -4.208877 -0.032297 -0.221131
C 0.845243 3.294181 0.472012
H -0.659063 -2.292183 -0.086602
H 2.632907 1.449729 0.385508
H 1.758354 -2.776182 0.033615
H -1.990874 1.202889 0.147065
H 4.042738 -1.884345 0.027489
H 4.378051 -0.243896 0.133634
H -4.455827 0.449635 0.733269
H -4.983615 -0.795413 -0.405470
H -4.301442 0.716517 -1.017691
H 1.533558 3.397690 -0.371890
H 1.376352 3.198684 1.423988
H 0.127549 4.123896 0.500875


%chk=000219956-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219956

0 1
O -0.089325 2.133229 0.287325
O -2.812047 -1.955524 -0.288248
N -1.794255 0.141290 -0.014336
N 3.775395 -0.947104 0.245876
C -0.418074 -0.214211 0.042441
C 0.512423 0.855900 0.204731
C 0.088940 -1.531360 -0.048942
C 1.898320 0.626245 0.273423
C 2.398347 -0.705458 0.179189
C 1.475825 -1.774145 0.018131
C -2.893851 -0.693666 -0.169847
C -4.233551 0.048021 -0.185046
C 0.783729 3.292232 0.458311
H -0.620108 -2.352025 -0.172646
H 2.598267 1.458814 0.398891
H 1.844909 -2.803750 -0.055789
H -1.961492 1.148220 0.072954
H 4.134738 -1.894496 0.183451
H 4.438653 -0.186940 0.357336
H -4.406815 0.584229 0.766672
H -5.038082 -0.687757 -0.327869
H -4.276392 0.786914 -1.006910
H 1.478903 3.397663 -0.397067
H 1.360740 3.221686 1.400739
H 0.111603 4.162290 0.499330


