%chk=000181545.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181545

0 1
P 4.438731 0.419867 0.549193
O 3.330259 -0.801403 0.255716
O 5.723340 -0.504347 0.882882
O 4.741945 0.899872 -0.990890
O 4.066053 1.445521 1.528421
O -6.927770 0.741161 -1.468699
O -7.129491 0.224669 0.621567
N -6.466337 0.420833 -0.384469
C -0.772352 -0.207671 0.006106
C -2.236898 -0.045854 -0.094283
C 1.983035 -0.513399 0.201353
C -0.052731 0.481933 0.996527
C -0.094520 -1.057229 -0.886856
C 1.330197 0.338595 1.103854
C 1.285504 -1.215209 -0.797874
C -3.049238 -0.263369 1.033816
C -2.823281 0.325788 -1.318344
C -4.430989 -0.113239 0.944068
C -4.203778 0.480471 -1.417543
C -5.002253 0.259264 -0.283624
C 6.081662 -1.517947 -0.123590
C 4.306495 2.234841 -1.372946
C 7.401582 -2.052865 0.391937
C 2.803095 2.290282 -1.563789
H -0.577655 1.141717 1.690323
H -0.653409 -1.602098 -1.649285
H 1.880176 0.878989 1.884012
H 1.830794 -1.874124 -1.471140
H -2.595140 -0.560670 1.980396
H -2.193103 0.502056 -2.190625
H -5.075235 -0.282485 1.814277
H -4.673116 0.772268 -2.363697
H 5.285406 -2.287923 -0.130949
H 6.178090 -1.035875 -1.115664
H 4.854277 2.360067 -2.330403
H 4.671475 2.976852 -0.636145
H 7.757772 -2.896927 -0.209017
H 8.178495 -1.275774 0.389309
H 7.307679 -2.391324 1.435043
H 2.517597 3.146338 -2.189226
H 2.424817 1.386581 -2.063180
H 2.255116 2.398764 -0.616265


%chk=000181545-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181545

0 1
P 4.503407 0.358671 0.581696
O 3.299683 -0.877884 0.258465
O 5.847363 -0.652063 0.812750
O 4.741843 1.056004 -0.981333
O 4.211173 1.378899 1.758125
O -7.206158 0.202626 -1.531628
O -7.297097 0.678938 0.698717
N -6.648928 0.370899 -0.376840
C -0.904688 -0.290973 -0.001621
C -2.379064 -0.122302 -0.097575
C 1.910323 -0.614011 0.184671
C -0.141830 0.440506 0.951134
C -0.211799 -1.193736 -0.857461
C 1.254628 0.288266 1.055688
C 1.183077 -1.355716 -0.772262
C -3.156084 0.208317 1.051096
C -3.056951 -0.286162 -1.341066
C -4.549253 0.372062 0.970030
C -4.449541 -0.128539 -1.442076
C -5.183195 0.201085 -0.280780
C 6.272432 -1.623909 -0.254350
C 4.519300 2.530875 -1.157047
C 7.543543 -2.277566 0.273596
C 3.072585 2.821313 -1.555247
H -0.638964 1.162595 1.607938
H -0.770234 -1.800318 -1.578343
H 1.828084 0.853879 1.797321
H 1.716509 -2.054496 -1.422922
H -2.666577 0.304823 2.025342
H -2.481747 -0.507266 -2.245837
H -5.152378 0.616558 1.848236
H -4.975144 -0.243720 -2.393529
H 5.454792 -2.351825 -0.401272
H 6.444507 -1.061818 -1.190329
H 5.229170 2.793870 -1.958286
H 4.799887 3.054047 -0.224532
H 7.912921 -3.017364 -0.460797
H 8.331457 -1.524247 0.440219
H 7.347341 -2.797342 1.226162
H 2.960133 3.897311 -1.786598
H 2.789212 2.242969 -2.451243
H 2.372559 2.573740 -0.737915


