%chk=000203090.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203090

0 1
O 3.243514 0.107945 0.908983
O 1.681419 0.938116 2.273203
O -1.066305 2.681307 -0.140102
O 0.343953 -1.729434 -0.338271
N -0.021264 0.589175 -0.224914
C 3.477755 -0.139772 -0.540589
C 2.273160 0.505943 -1.274343
C 1.359218 1.093169 -0.191220
C 2.042680 0.725625 1.149769
C 4.802672 0.543403 -0.836973
C 3.525047 -1.650168 -0.675691
C -1.161493 1.484458 -0.138973
C -0.413601 -0.800709 -0.242411
C -2.354021 0.578381 -0.091601
C -1.912525 -0.773219 -0.152897
C -3.693107 0.889894 0.002535
C -2.808809 -1.819333 -0.119902
C -4.616422 -0.183018 0.035804
C -4.185577 -1.502878 -0.023776
H 1.746389 -0.246549 -1.894029
H 2.600319 1.285995 -1.983470
H 1.315967 2.218805 -0.264734
H 5.592525 0.163421 -0.171580
H 5.128503 0.372820 -1.868314
H 4.753690 1.625793 -0.665557
H 3.817921 -1.968547 -1.680185
H 4.233744 -2.088904 0.040342
H 2.541990 -2.101758 -0.449793
H -4.035473 1.924690 0.052909
H -2.474837 -2.857149 -0.163013
H -5.682085 0.040980 0.112114
H -4.912544 -2.316681 0.005778


%chk=000203090-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000203090

0 1
O 3.323244 -0.291274 0.923925
O 1.524520 0.155573 2.328791
O -0.804845 2.562769 -0.394275
O -0.002072 -2.052193 0.088339
N -0.064799 0.313637 -0.170718
C 3.630351 -0.195982 -0.571773
C 2.222636 -0.079359 -1.228508
C 1.362758 0.596617 -0.137306
C 2.021997 0.137965 1.194313
C 4.490926 1.064458 -0.767543
C 4.372662 -1.483959 -0.935488
C -1.057137 1.341249 -0.257321
C -0.648021 -0.980490 -0.011753
C -2.371700 0.635661 -0.161908
C -2.127390 -0.752290 -0.014036
C -3.676027 1.150537 -0.195523
C -3.179887 -1.671325 0.105924
C -4.748112 0.228481 -0.074417
C -4.503744 -1.160462 0.074105
H 1.823179 -1.084078 -1.443485
H 2.256114 0.505663 -2.161685
H 1.444476 1.700846 -0.186069
H 5.381184 1.020597 -0.117693
H 4.827658 1.136622 -1.817611
H 3.930638 1.983988 -0.520310
H 4.570285 -1.512224 -2.022765
H 5.337744 -1.541849 -0.403809
H 3.769825 -2.366874 -0.663971
H -3.852302 2.224767 -0.307365
H -2.979520 -2.740693 0.223832
H -5.780710 0.592758 -0.092843
H -5.351528 -1.847336 0.168045


