%chk=000282002.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282002

0 1
O -0.668821 2.926853 -0.128488
O 0.716992 -3.343622 0.873929
O -1.234230 -3.612772 -0.307293
N -4.074882 0.796017 -0.760611
C 3.109708 0.218378 0.011634
C 2.230465 -0.997852 0.437485
C 2.184166 1.434026 0.339366
C 0.793231 -0.548947 0.196728
C 0.769734 0.890409 0.127589
C 3.375742 0.162916 -1.516134
C 4.446583 0.274787 0.779355
C -0.374046 -1.338130 0.037858
C -0.445087 1.552260 -0.086496
C -1.626184 -0.658028 -0.247458
C -1.656417 0.783655 -0.298544
C -0.373257 -2.817656 0.145597
C -2.874175 -1.326611 -0.469281
C -2.906032 1.440269 -0.555815
C -4.032680 -0.584904 -0.713129
C 0.394256 3.910592 0.106947
H 2.367192 -1.223335 1.513835
H 2.489625 -1.922534 -0.100641
H 2.435232 2.304538 -0.288317
H 2.327860 1.733323 1.398573
H 3.967921 -0.733713 -1.777417
H 2.429814 0.123196 -2.087308
H 3.942000 1.052473 -1.851152
H 4.280882 0.325100 1.872258
H 5.057752 -0.623327 0.571377
H 5.041897 1.159354 0.483112
H -2.911192 -2.417260 -0.465308
H -2.934617 2.532027 -0.592463
H -4.989724 -1.089133 -0.885251
H 1.089985 3.954111 -0.749328
H 0.944610 3.700179 1.039797
H -0.136041 4.870349 0.198492
H 0.608539 -4.334090 0.884200


%chk=000282002-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282002

0 1
O -0.676898 2.930671 -0.135687
O 0.780656 -3.304786 0.837189
O -1.203417 -3.632008 -0.283642
N -4.083196 0.808119 -0.744629
C 3.106177 0.205454 0.013945
C 2.217321 -1.007792 0.427420
C 2.183748 1.427646 0.329659
C 0.785606 -0.547515 0.186648
C 0.766216 0.890236 0.119092
C 3.391521 0.149482 -1.510403
C 4.433719 0.255711 0.798561
C -0.375924 -1.333813 0.032080
C -0.450188 1.555320 -0.091067
C -1.634458 -0.654874 -0.245995
C -1.663038 0.788036 -0.296497
C -0.346390 -2.811482 0.141462
C -2.887683 -1.319318 -0.462138
C -2.912129 1.448070 -0.546097
C -4.044814 -0.572756 -0.698866
C 0.380144 3.921989 0.097191
H 2.349316 -1.246755 1.501733
H 2.470070 -1.930144 -0.119175
H 2.439431 2.290146 -0.306682
H 2.327415 1.737769 1.385592
H 3.977325 -0.753025 -1.765678
H 2.452455 0.120618 -2.093593
H 3.971329 1.033520 -1.836703
H 4.254451 0.295124 1.889737
H 5.048688 -0.639484 0.589254
H 5.031295 1.144009 0.518442
H -2.928534 -2.408849 -0.458769
H -2.937997 2.540046 -0.581708
H -5.004596 -1.073290 -0.866411
H 1.074811 3.968579 -0.759581
H 0.932476 3.717142 1.029795
H -0.156366 4.878426 0.187401
H 0.698259 -4.297325 0.855815


