%chk=000121897.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121897

0 1
 P    3.873400      -1.285700       1.180300    
 O  -0.2849000      -2.328200      0.6036000    
 O   -1.935000      -2.620200      -2.576500    
 O  -0.7900000      -4.696800      -1.249100    
 O    2.483000      -2.104200       1.036100    
 O    3.665100      4.7800001E-02  0.2888000    
 O    4.929800      -2.154400      0.3153000    
 O    4.297900      -1.040600       2.599700    
 O    2.021700       1.031300       1.541500    
 O    1.355800       5.483300     -0.9361000    
 O    2.794800       4.281100      -2.220200    
 N   -1.772500     -0.6214000     -0.1064000    
 N   -1.630500       1.603300     -8.2500003E-02
 N   -4.057100     -0.9016000      0.6696000    
 N   -5.116500       1.253800       1.103400    
 N   -3.978200       3.333600      0.7775000    
 C  -0.8714000      -2.335200      -1.691000    
 C   1.8500000E-02  -3.533800      -1.426700    
 C   -1.370000      -2.013900     -0.2903000    
 C   0.6615000      -3.173200     -9.1100000E-02
 C    1.965800      -2.404200     -0.2488000    
 C   -2.986900     -0.1695000      0.3254000    
 C  -0.9920000      0.4804000     -0.3379000    
 C   -2.878400       1.211800      0.3329000    
 C   -3.999000       1.928600      0.7409000    
 C   -5.076700     -9.9399999E-02   1.046000    
 C    2.774500       1.035600      0.5789000    
 C    2.862800       2.115500     -0.4746000    
 C    1.946200       3.297100     -0.1831000    
 C    2.088200       4.378900      -1.225400    
 H  -0.2711000      -1.523400      -2.116800    
 H   0.7253000      -3.737700      -2.236100    
 H   -2.225800      -2.642600     -1.7100001E-02
 H   0.8223000      -4.051300      0.5444000    
 H    2.695900      -3.004600     -0.8005000    
 H    1.802600      -1.464400     -0.7843000    
 H   -2.495600      -1.827400      -2.626000    
 H  -0.1935000      -5.434600      -1.035200    
 H   2.7700000E-02  0.4082000     -0.6887000    
 H   -5.988400     -0.6066000       1.343000    
 H   -3.145500       3.839300      0.5074000    
 H   -4.805100       3.831800       1.077400    
 H    5.883700      -1.932800      0.3710000    
 H    2.599100       1.668900      -1.440500    
 H    3.903200       2.458100     -0.5227000    
 H   0.9013000       2.972800     -0.1648000    
 H    2.194500       3.726900      0.7940000    
 H    1.460700       6.181000      -1.617600    


%chk=000121897-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000121897

0 1
P 4.165037 -1.182433 0.039215
O 0.153175 -2.589336 1.026161
O -2.554261 -3.202978 -1.357487
O -0.910760 -5.131702 -0.375641
O 2.925182 -2.301823 0.377839
O 3.373496 0.354743 -0.435565
O 4.566068 -1.675353 -1.559454
O 5.319072 -1.065503 1.102937
O 2.612648 0.921984 1.706896
O -0.179962 5.142023 0.378753
O 1.825593 5.339719 -0.768002
N -1.386053 -0.824225 0.609014
N -1.051167 1.384879 1.086072
N -3.387032 -0.627295 -0.862128
N -4.076714 1.710040 -1.154298
N -2.897984 3.531909 -0.216794
C -1.239484 -2.769335 -0.953800
C -0.253551 -3.959463 -0.936098
C -1.179665 -2.284141 0.526356
C 0.844533 -3.481613 0.041489
C 1.958737 -2.714013 -0.676703
C -2.396279 -0.127764 -0.055271
C -0.610510 0.125794 1.287155
C -2.170557 1.240208 0.247819
C -3.047107 2.184574 -0.364676
C -4.192039 0.367970 -1.355289
C 2.774160 1.230445 0.514994
C 2.380635 2.522711 -0.174638
C 1.460480 3.386864 0.711227
C 1.114130 4.685264 0.023453
H -0.849449 -1.964467 -1.612749
H 0.143410 -4.178606 -1.947915
H -1.943536 -2.804277 1.135332
H 1.260855 -4.323993 0.616767
H 2.483067 -3.365897 -1.398302
H 1.570732 -1.819306 -1.199693
H -3.148228 -2.370035 -1.296507
H -1.857455 -5.097640 -0.687885
H 0.252897 -0.158853 1.883211
H -5.020608 0.048080 -1.993157
H -2.096540 3.922494 0.287165
H -3.565236 4.144354 -0.683628
H 5.335021 -1.212296 -1.976915
H 1.892219 2.269195 -1.133025
H 3.302789 3.070894 -0.446819
H 0.537509 2.841861 0.982148
H 1.970210 3.630517 1.664323
H -0.316277 6.037224 -0.038789


