%chk=000280802.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280802

0 1
P 2.345774 -0.209931 -0.378993
O 1.183018 0.654838 0.504633
O 3.601212 0.548580 0.383662
O 2.479740 -1.708108 0.242330
O 2.270257 -0.149952 -1.841626
N 0.013165 0.033091 0.057291
C -1.084802 0.668193 0.355680
C -1.175465 1.978296 1.100313
C -2.349333 0.032940 -0.103896
C -0.783641 1.809492 2.565727
C -3.419659 -0.118596 0.791954
C -2.473223 -0.410193 -1.429721
C 4.225138 1.665924 -0.301782
C 2.765256 -1.845191 1.664214
C -4.610421 -0.704079 0.356493
C -3.669905 -0.992339 -1.857687
C -4.738120 -1.138499 -0.967769
C 5.030854 1.211267 -1.503558
C 1.497353 -1.701307 2.483905
H -0.491584 2.709780 0.612434
H -2.192433 2.410881 1.016026
H -1.420344 1.080817 3.079163
H 0.257234 1.462404 2.653802
H -0.860292 2.759581 3.106638
H -3.320513 0.213959 1.824070
H -1.632415 -0.308633 -2.120114
H 3.459271 2.420177 -0.561639
H 4.873461 2.065445 0.506059
H 3.159362 -2.883127 1.688149
H 3.562432 -1.141051 1.970933
H -5.440850 -0.824209 1.050276
H -3.765389 -1.336161 -2.887008
H -5.668725 -1.593078 -1.303705
H 4.388727 0.900075 -2.346929
H 5.667995 0.350332 -1.260788
H 5.681292 2.011677 -1.873290
H 0.652175 -2.203909 1.987517
H 1.200985 -0.651519 2.619602
H 1.611013 -2.147268 3.477836


%chk=000280802-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280802

0 1
P 2.416677 0.436265 -0.690798
O 1.011212 1.100757 0.147889
O 3.539757 1.368618 0.232838
O 2.563654 -1.180999 -0.151378
O 2.508819 0.578647 -2.262922
N -0.184809 0.246437 -0.134770
C -1.274357 0.842524 0.321691
C -1.267678 2.183464 1.034300
C -2.538937 0.075672 0.114713
C -0.950660 2.040437 2.549011
C -3.720253 0.421200 0.826277
C -2.584421 -1.021711 -0.794034
C 4.693109 1.987277 -0.494156
C 2.394614 -1.537951 1.294915
C -4.912879 -0.311592 0.639202
C -3.776138 -1.747937 -0.979509
C -4.947144 -1.397895 -0.263345
C 5.797686 0.966372 -0.776465
C 1.493975 -2.768669 1.352956
H -0.490824 2.817632 0.572957
H -2.240330 2.684711 0.891975
H -1.679473 1.385405 3.059446
H 0.057847 1.616333 2.690706
H -0.977121 3.030938 3.037253
H -3.714659 1.255426 1.535221
H -1.680074 -1.282321 -1.352132
H 4.325425 2.450643 -1.428343
H 5.024381 2.773377 0.203694
H 3.408457 -1.740390 1.682801
H 1.958281 -0.685293 1.847424
H -5.813650 -0.033347 1.197307
H -3.797025 -2.583630 -1.687625
H -5.874354 -1.962202 -0.412250
H 5.458104 0.202410 -1.497795
H 6.115748 0.464758 0.153736
H 6.675998 1.479024 -1.212232
H 1.922342 -3.590009 0.753757
H 0.492551 -2.528986 0.958584
H 1.394750 -3.114796 2.399304


