%chk=000281228.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281228

0 1
P -1.654255 0.087293 0.578926
O -3.231836 -0.235968 0.255783
O -0.940601 -1.364977 0.233805
O -1.442608 0.650574 1.922802
O 1.871517 0.792853 1.496858
N -2.884519 2.870830 -1.399396
C -1.042333 1.110109 -0.900759
C 0.304587 1.750689 -0.529911
C 1.469569 0.840903 -0.802655
C 2.294640 0.376235 0.254894
C 1.802822 0.458209 -2.103160
C -2.065457 2.087365 -1.169202
C -3.535495 -1.099209 -0.881332
C -0.134644 -1.945407 1.306566
C 3.411268 -0.433194 0.018715
C 2.912578 -0.360543 -2.354476
C 3.711448 -0.798565 -1.298408
C -4.971083 -1.518176 -0.626263
C 0.802490 -2.892873 0.582550
C 2.693965 0.479067 2.646142
H -0.910513 0.426579 -1.783589
H 0.315943 2.091300 0.536721
H 0.439320 2.689845 -1.114328
H 1.195316 0.807287 -2.938958
H -3.440220 -0.490515 -1.800665
H -2.846531 -1.966352 -0.907722
H 0.411557 -1.151236 1.857280
H -0.830555 -2.475777 1.984409
H 4.042835 -0.774015 0.832103
H 3.151324 -0.646142 -3.376184
H 4.579074 -1.428179 -1.494921
H -5.605893 -0.636565 -0.445144
H -5.051552 -2.142580 0.273702
H -5.389454 -2.072704 -1.472311
H 1.490217 -2.344363 -0.078838
H 0.242438 -3.587444 -0.058510
H 1.399748 -3.483804 1.284339
H 2.103053 0.925323 3.460316
H 2.782046 -0.602573 2.774179
H 3.670294 0.963201 2.557142


%chk=000281228-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281228

0 1
P -1.172940 -0.223069 0.387428
O -2.884645 -0.393051 0.608747
O -0.668541 -1.667385 -0.449038
O -0.455298 0.071090 1.772895
O 2.011788 1.898065 1.417504
N -2.992586 2.596852 -1.469067
C -0.896717 1.009933 -1.078697
C 0.415081 1.840215 -0.877688
C 1.654023 0.966302 -0.757083
C 2.411262 0.970850 0.451526
C 2.074450 0.123288 -1.810920
C -2.060626 1.873283 -1.286308
C -3.750529 -0.992627 -0.453124
C -0.027202 -2.763527 0.338439
C 3.517750 0.099367 0.611165
C 3.193994 -0.728025 -1.674182
C 3.904610 -0.745019 -0.452600
C -5.155890 -1.040372 0.138404
C 0.476093 -3.780533 -0.681337
C 2.314030 1.603661 2.823156
H -0.792309 0.328985 -1.944841
H 0.314808 2.461712 0.025602
H 0.497501 2.516341 -1.750072
H 1.509276 0.123920 -2.752079
H -3.721987 -0.354402 -1.357854
H -3.366548 -1.998932 -0.704375
H 0.798057 -2.333978 0.935496
H -0.777053 -3.200914 1.025264
H 4.083212 0.088859 1.548028
H 3.505427 -1.368693 -2.505745
H 4.768767 -1.407316 -0.327495
H -5.502789 -0.024160 0.388767
H -5.170602 -1.652167 1.056134
H -5.857668 -1.482195 -0.593408
H 1.217814 -3.313894 -1.351074
H -0.356146 -4.172882 -1.290712
H 0.957596 -4.628219 -0.159257
H 1.769639 2.367629 3.396958
H 1.936982 0.600404 3.090568
H 3.398415 1.687105 3.031376


