%chk=000268863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268863

0 1
O 1.471195 -0.234787 1.474721
O 1.762155 1.703355 -1.134064
O 2.410231 -1.762126 -1.277434
O 4.216670 1.346600 0.474607
O -1.042467 1.980565 -1.041244
N -0.640117 -0.428763 0.527251
N -2.167196 -2.025831 1.027842
N -4.097098 -1.218273 -0.269217
N -3.022355 1.234508 -1.839045
C 1.304703 0.383995 -0.862025
C 0.598388 0.391113 0.528255
C 2.568871 -0.491618 -0.672880
C 2.748374 -0.601891 0.856129
C 3.799606 0.368630 1.423127
C -1.834773 -0.074430 -0.156358
C -0.882965 -1.611865 1.215698
C -2.767962 -1.079994 0.190138
C -1.910838 1.104345 -1.017643
H 0.659211 0.026973 -1.691967
H 0.368389 1.420796 0.905202
H 3.465281 -0.062981 -1.193560
H 2.916919 -1.644724 1.197072
H 4.745243 -0.154609 1.667524
H 3.404153 0.869557 2.329491
H 0.974100 2.283756 -1.358440
H 1.635801 -2.247040 -0.916354
H -0.143553 -2.109168 1.835597
H 3.447285 1.901856 0.176193
H -4.684134 -0.417931 -0.039756
H -4.540982 -2.077823 0.061503
H -3.660081 0.472591 -2.017755
H -3.066354 2.017213 -2.477509


%chk=000268863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268863

0 1
O 1.532800 -0.770745 1.369894
O 1.746808 1.570614 -1.140439
O 2.555049 -2.028899 -1.124713
O 4.015627 1.665286 0.339085
O -0.868529 2.024736 -1.014320
N -0.641133 -0.593438 0.446029
N -2.306158 -2.092643 0.814483
N -4.182697 -0.929284 -0.210314
N -3.015146 1.408718 -1.637434
C 1.428129 0.171550 -0.878694
C 0.681332 0.054511 0.502674
C 2.731970 -0.646027 -0.668461
C 2.940167 -0.582560 0.859228
C 3.566281 0.753746 1.380097
C -1.809843 -0.041313 -0.141813
C -0.987946 -1.815045 0.983853
C -2.824867 -0.995137 0.133865
C -1.842266 1.186386 -0.937008
H 0.839174 -0.261954 -1.706693
H 0.558479 1.067661 0.929512
H 3.573038 -0.242758 -1.246380
H 3.485892 -1.463518 1.232240
H 4.467967 0.529517 1.973464
H 2.824927 1.229008 2.060603
H 0.854367 2.039926 -1.178214
H 1.915618 -2.483983 -0.516192
H -0.276153 -2.438358 1.514601
H 3.231689 1.906239 -0.248115
H -4.690475 -0.072457 0.022951
H -4.695970 -1.793877 -0.023122
H -3.712480 0.665563 -1.740471
H -3.059950 2.240533 -2.225097


