%chk=000179798.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179798

0 1
P -2.852563 -0.316984 -1.072003
O 2.540109 -0.258277 0.358244
O -1.210246 0.066065 -1.027675
O -3.167842 -0.953379 0.377534
O -2.573990 -1.594732 -2.067543
O 0.670657 -1.502598 0.167391
O -3.767927 0.739531 -1.484148
C 3.376230 -1.483183 0.368924
C 0.529405 0.920929 0.293963
C -0.723376 1.130536 -0.321857
C 4.729888 -0.958141 -0.076579
C 3.357476 -2.043964 1.780175
C 1.179778 -0.402492 0.256376
C 1.140640 2.006998 0.947188
C -1.370759 2.375882 -0.272863
C 0.505841 3.244848 1.006579
C -0.747048 3.424087 0.399384
C -2.372995 -2.113882 0.809856
C -2.782547 -2.283288 2.258033
H 2.931001 -2.191658 -0.365041
H 5.470188 -1.763759 -0.135332
H 4.664998 -0.482133 -1.064450
H 5.115649 -0.196112 0.613645
H 4.061909 -2.875996 1.891736
H 2.357495 -2.418765 2.041175
H 3.623635 -1.282170 2.523364
H 2.122716 1.859803 1.407125
H -2.339140 2.532037 -0.761610
H 0.981864 4.077762 1.520823
H -1.238029 4.398677 0.448438
H -2.665190 -2.977633 0.183644
H -1.288846 -1.888405 0.697712
H -2.317147 -3.169954 2.703372
H -2.498432 -1.408486 2.858844
H -3.873798 -2.383741 2.351341
H -1.618303 -1.767225 -2.313467


%chk=000179798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179798

0 1
P -3.022256 -0.219170 -0.859443
O 2.637977 -0.163348 0.381668
O -1.306644 0.185690 -0.969406
O -3.262029 -1.149666 0.540067
O -2.954944 -1.396847 -2.108589
O 0.647839 -1.373220 0.335670
O -4.029854 0.989390 -0.997739
C 3.411703 -1.446722 0.562782
C 0.616615 1.085439 0.214203
C -0.686917 1.281108 -0.327464
C 4.793395 -1.168714 -0.032551
C 3.432087 -1.805040 2.055790
C 1.245075 -0.267117 0.302239
C 1.304780 2.218157 0.729610
C -1.298136 2.556382 -0.318193
C 0.703434 3.490883 0.745906
C -0.604124 3.654409 0.230750
C -2.486289 -2.433974 0.744928
C -2.819587 -2.877060 2.163895
H 2.875130 -2.228369 -0.006428
H 5.421163 -2.075483 0.036436
H 4.712879 -0.879228 -1.094024
H 5.298822 -0.353246 0.514291
H 4.019057 -2.728694 2.211598
H 2.410514 -1.979788 2.432872
H 3.899194 -0.994853 2.643507
H 2.313064 2.070924 1.125158
H -2.302973 2.675154 -0.735752
H 1.245962 4.347408 1.158202
H -1.083518 4.639122 0.243363
H -2.834261 -3.154090 -0.016063
H -1.411557 -2.220684 0.607417
H -2.305701 -3.832888 2.378222
H -2.482406 -2.126899 2.898671
H -3.905414 -3.028195 2.286381
H -2.240778 -1.230576 -2.775675


