%chk=000191037.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191037

0 1
O 0.856733 -1.669270 0.191134
O -1.821547 2.337088 0.737407
O 4.249662 -0.419079 -0.182561
O -1.717461 -2.333445 -0.135539
N -1.853307 -0.065472 -0.432440
N 2.139381 0.657871 1.331557
C -0.600741 0.290866 0.288932
C 0.635608 -0.376930 -0.377814
C -0.517457 1.845954 0.347153
C 1.982775 0.339768 -0.111953
C -0.254186 2.525827 -0.988250
C 3.139292 -0.529577 -0.646838
C -2.362114 -1.358374 -0.509140
C -3.729414 -1.476245 -1.117813
H -0.657562 -0.105651 1.341780
H 0.468881 -0.493787 -1.473648
H 0.226799 2.154980 1.120491
H 2.000557 1.315863 -0.679155
H -2.445045 0.738939 -0.672957
H -0.834543 2.091348 -1.809564
H -0.539822 3.587990 -0.930353
H 0.810325 2.478960 -1.256247
H 0.016198 -2.232643 0.165424
H 3.109590 0.928203 1.515553
H 1.965251 -0.185656 1.883552
H 2.894286 -1.229831 -1.457067
H -1.985700 2.167527 1.685051
H -4.022821 -2.539103 -1.175948
H -4.499017 -0.965270 -0.523415
H -3.772705 -1.077049 -2.140132


%chk=000191037-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191037

0 1
O 0.837676 -1.713142 0.206157
O -1.783952 2.473303 0.663576
O 4.274574 -0.674493 0.062736
O -1.568525 -2.382351 -0.498729
N -1.855748 -0.065918 -0.297107
N 2.094251 0.457004 1.562701
C -0.553146 0.362118 0.282055
C 0.695258 -0.358784 -0.313345
C -0.508621 1.913505 0.134892
C 2.022277 0.320872 0.096288
C -0.423160 2.427463 -1.306981
C 3.182572 -0.491430 -0.520855
C -2.298161 -1.330797 -0.581933
C -3.749882 -1.446990 -1.027424
H -0.543952 0.127523 1.367775
H 0.612896 -0.360276 -1.424075
H 0.339410 2.273332 0.746279
H 2.080439 1.329869 -0.367324
H -2.545135 0.697077 -0.282905
H -1.284164 2.079482 -1.904057
H -0.429629 3.529914 -1.305439
H 0.500181 2.084262 -1.804526
H -0.026889 -2.208336 -0.022245
H 3.019300 0.793155 1.862594
H 1.909526 -0.462602 1.990742
H 3.005559 -0.874178 -1.558622
H -1.775957 2.418516 1.653204
H -3.784774 -1.938280 -2.014546
H -4.290933 -2.099879 -0.320960
H -4.269395 -0.476138 -1.090724


