%chk=000000625.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000625

0 1
 P   -2.745500       1.942800      -1.160800    
 P   -4.078900     -0.6723000     -0.9404000    
 P   -2.852700      -2.606300      0.9196000    
 O   0.9067000      0.7993000      0.1816000    
 O    1.140000       2.931800       3.052800    
 O   -1.306900       2.396700     -0.5753000    
 O   -2.861600      0.3765000     -0.7827000    
 O    3.575300      -2.157100       1.142600    
 O   -3.819700       2.642200     -0.1738000    
 O   -2.956100       2.241200      -2.616800    
 O   -3.419300      -2.079600     -0.4992000    
 O   -4.254500     -0.8239000      -2.540200    
 O   -5.333400     -0.3116000     -0.2007000    
 O   -2.210800      -4.042200      0.5470000    
 O   -1.560000      -1.672600       1.182300    
 O   -3.863900      -2.628200       2.027800    
 N    3.039900     -0.1684000      0.1016000    
 N    4.910000      -1.529700     -0.5826000    
 N    6.275000     -0.8802000      -2.349900    
 C   0.9545000       1.719500       2.353400    
 C   0.5054000       1.963600      0.9223000    
 C    2.251900      0.9782000       2.133200    
 C    1.909400      0.1036000      0.9404000    
 C  -0.9928000       2.167000      0.7876000    
 C    3.361300      0.7387000     -0.8957000    
 C    3.833100      -1.331700      0.2645000    
 C    4.393300      0.5672000      -1.719500    
 C    5.200200     -0.6647000      -1.518800    
 H   0.2484000       1.084900       2.902400    
 H    1.026300       2.824100      0.4829000    
 H    2.570000      0.3991000       3.006000    
 H    3.062500       1.684800       1.913400    
 H    1.462800     -0.8385000       1.279200    
 H   -1.325800       3.033100       1.367500    
 H   -1.528100       1.281800       1.145600    
 H   0.2782000       3.378800       3.101900    
 H    2.755900       1.632600     -0.9888000    
 H    4.656100       1.275200      -2.494100    
 H   -4.037200       3.589700     -0.3048000    
 H    6.853100      -1.707500      -2.249400    
 H    6.525200     -0.2280000      -3.085800    
 H   -4.724000     -0.1189000      -3.034900    
 H   -1.875100      -4.614300       1.269700    
 H   -1.083600      -1.747800       2.036400    


%chk=000000625-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000000625

0 1
P -3.212358 2.349373 -0.931468
P -4.093041 -0.654176 -0.714073
P -1.815710 -2.438411 0.620429
O 1.141609 1.606452 -0.316443
O 2.554953 2.716403 2.037512
O -1.607689 2.768737 -0.512052
O -3.029422 0.582859 -1.255678
O 1.775961 -2.348218 -0.742527
O -4.034819 2.350738 0.557504
O -3.767311 3.164065 -2.155025
O -3.133511 -2.032013 -0.524311
O -5.045347 -1.144129 -2.026568
O -4.956243 -0.120831 0.523028
O -0.495003 -1.949799 -0.162801
O -2.012739 -1.119730 1.755892
O -2.045572 -3.889475 1.200532
N 2.665891 -0.219327 -0.131764
N 3.975882 -1.920484 -1.214183
N 6.212271 -1.585720 -1.711530
C 1.191326 2.153671 1.996807
C 0.482276 2.497552 0.659243
C 1.353638 0.623520 1.905497
C 1.373516 0.318330 0.374396
C -1.030747 2.257073 0.753221
C 3.778332 0.607106 -0.056650
C 2.778685 -1.520497 -0.708113
C 5.001712 0.205264 -0.548646
C 5.059163 -1.101277 -1.159048
H 0.616590 2.476372 2.885742
H 0.670966 3.526151 0.306618
H 0.494536 0.109925 2.368450
H 2.274207 0.303180 2.417560
H 0.577263 -0.385268 0.096492
H -1.466479 2.831765 1.592720
H -1.269695 1.185130 0.886152
H 2.507870 3.705481 2.063558
H 3.605697 1.574737 0.426745
H 5.871180 0.861329 -0.481140
H -4.583644 1.493975 0.735915
H 6.188775 -2.516069 -2.128987
H 7.071634 -1.042454 -1.729017
H -4.648346 -1.869325 -2.576544
H 0.635139 -2.225979 -0.439862
H -2.746796 -1.257104 2.409917


