%chk=000198895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198895

1 1
O 3.395201 -0.952265 -0.607943
O 4.521870 0.965895 -1.136736
N -2.160068 -0.098690 0.677765
N 1.554597 -0.058744 0.341192
N 2.097401 -1.248733 -0.187697
C -3.037264 1.109344 0.504345
C -3.037001 -1.280475 0.371763
C -4.161894 0.736301 -0.482201
C -4.161701 -0.800730 -0.567374
C -0.919303 -0.053974 -0.136499
C 0.200918 -0.077361 0.950485
C 2.281449 0.982364 -0.010201
C 3.547538 0.509184 -0.664478
H -2.474788 2.003357 0.184850
H -3.456796 1.332477 1.512592
H -3.456014 -1.614403 1.349030
H -2.473885 -2.133182 -0.045525
H -3.998903 1.190146 -1.474639
H -5.138233 1.118535 -0.132775
H -5.137918 -1.219628 -0.262495
H -3.998403 -1.142249 -1.603896
H -0.809376 -0.922559 -0.822110
H -0.830687 0.858419 -0.763415
H 0.085944 0.804361 1.634000
H 0.073493 -0.981598 1.599627
H 2.049813 2.047657 0.121439
H 2.155413 -2.074348 0.450598


%chk=000198895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198895

1 1
O 3.441708 -1.081692 -0.143780
O 4.604025 0.925595 -0.772065
N -2.139192 -0.054067 -0.307911
N 1.518078 -0.055427 0.623942
N 2.097451 -1.332483 0.314566
C -2.951980 1.182839 -0.166776
C -2.954787 -1.285246 -0.170232
C -4.362256 0.660902 0.207517
C -4.398279 -0.774028 -0.384737
C -0.739348 -0.050648 -0.507030
C 0.088854 -0.021173 0.893641
C 2.311402 0.941404 0.181496
C 3.583415 0.435915 -0.307040
H -2.957634 1.733811 -1.129811
H -2.534248 1.862011 0.603370
H -2.842860 -1.731195 0.842759
H -2.639990 -2.041963 -0.912328
H -5.158118 1.304716 -0.198007
H -4.480766 0.627990 1.305201
H -5.144417 -1.416077 0.108931
H -4.630385 -0.743639 -1.463544
H -0.403081 -0.959822 -1.040093
H -0.415184 0.845462 -1.072402
H -0.144000 0.902324 1.446761
H -0.193600 -0.901345 1.494495
H 2.017424 1.987315 0.211472
H 2.139170 -1.962380 1.141308


