%chk=000198194.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198194

0 1
O 2.783252 -0.657146 -0.769210
N 1.319017 0.021098 0.909526
N 2.954830 1.510490 -0.024976
C -1.818749 -0.097007 0.390946
C -0.714222 -0.958366 -0.231547
C -2.998621 0.083666 -0.575220
C 0.470096 -1.186712 0.718267
C -4.104571 0.939010 0.038126
C 2.370513 0.216789 -0.023496
H -2.174355 -0.559510 1.332187
H -1.417976 0.894424 0.674521
H -0.355532 -0.500982 -1.176132
H -1.128365 -1.943209 -0.528122
H -2.646086 0.547479 -1.517680
H -3.406623 -0.905857 -0.861016
H 1.112224 -2.013786 0.326023
H 0.119629 -1.499718 1.727105
H -4.942918 1.058842 -0.657878
H -4.503045 0.489535 0.954804
H -3.746396 1.942717 0.293287
H 0.796521 0.843502 1.214293
H 2.910064 2.087320 0.800444
H 3.839714 1.583621 -0.516350


%chk=000198194-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198194

0 1
O 2.954640 -0.620133 -0.770818
N 1.282687 0.041975 0.734503
N 3.080708 1.481064 0.232689
C -1.814649 -0.073675 0.317850
C -0.767343 -1.043202 -0.274023
C -3.099237 0.026128 -0.537304
C 0.506548 -1.199301 0.590555
C -4.140779 1.004290 0.047216
C 2.462708 0.244673 0.018183
H -2.084721 -0.401836 1.344558
H -1.372811 0.940807 0.414678
H -0.470795 -0.706421 -1.286511
H -1.225852 -2.046909 -0.391603
H -2.826375 0.342272 -1.564536
H -3.549280 -0.983001 -0.632988
H 1.187036 -1.933513 0.125946
H 0.232291 -1.572912 1.597974
H -5.049653 1.050164 -0.580460
H -4.447984 0.695720 1.064490
H -3.727938 2.028598 0.117758
H 0.900210 0.789277 1.313760
H 2.743988 2.180854 0.889985
H 3.945003 1.651281 -0.273998


