%chk=000004795.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004795

0 1
 P    3.990200     -0.1679000     -0.9620000    
 P    3.066200       2.080500      0.7074000    
 P   0.3847000       2.647300      0.3788000    
 O   0.6184000      -1.265000     -0.2939000    
 O   -1.440200      -3.112400       1.955200    
 O   0.7085000      -4.773400      0.4489000    
 O    3.255700      -1.577800      -1.264300    
 O    2.932500      0.6553000     -5.7500001E-02
 O    5.162800     -0.5417000      8.7800004E-02
 O    4.463100      0.5687000      -2.181700    
 O    4.120900       1.703900       1.883600    
 O    3.593100       3.162700     -0.1969000    
 O  -0.9973000       2.630100       1.230800    
 O   0.5068000       4.228300      2.7200000E-02
 O   0.3065000       1.797600     -0.8612000    
 N   -1.704500     -0.8178000     -0.3247000    
 N   -2.909000     -0.1807000      -2.089000    
 N   -3.113200      2.2399999E-02   1.467100    
 N   -5.104300       1.124900      0.5862000    
 N   -5.538800       1.309700      -1.759900    
 N    1.607900       2.330400       1.445700    
 C  -0.7958000      -2.904100      0.7107000    
 C   0.6369000      -3.390300      0.7377000    
 C  -0.6122000      -1.416300      0.4398000    
 C    1.267100      -2.546500     -0.3581000    
 C    2.765300      -2.365100     -0.1929000    
 C   -2.805100     -0.1838000      0.1778000    
 C   -1.812100     -0.7899000      -1.689900    
 C   -3.539100      0.2031000     -0.9320000    
 C   -4.730200      0.8813000     -0.6930000    
 C   -4.284700      0.6867000       1.572200    
 H   -1.383400      -3.408300     -6.4999998E-02
 H    1.099100      -3.216100       1.716200    
 H  -0.5136000     -0.8316000       1.362400    
 H    1.060800      -2.959600      -1.353800    
 H    3.278900      -3.331000     -0.2182000    
 H    2.990600      -1.882300      0.7644000    
 H  -0.9176000      -2.675300       2.648800    
 H   0.3095000      -4.925600     -0.4245000    
 H   -1.071200      -1.229800      -2.343500    
 H   -4.614800      0.8996000       2.583300    
 H    5.824100      0.1434000      0.3233000    
 H   -5.261700       1.129100      -2.715400    
 H   -6.399700       1.800600      -1.560600    
 H    1.624300       2.911100       2.283200    
 H    3.774500       1.356600       2.733100    
 H   -1.846100       2.750400      0.7539000    
 H  -9.7000003E-02   4.608800     -0.6457000    


%chk=000004795-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004795

0 1
P 3.146357 -0.468334 -1.166786
P 2.061765 2.268169 0.098628
P 0.158267 2.471060 2.561192
O 0.725465 -2.069108 -0.803879
O 0.126614 -1.413812 2.449806
O -0.613788 -4.479238 0.571190
O 3.537850 -1.872454 -0.256344
O 2.220731 0.467712 -0.079517
O 4.617027 0.499248 -1.001186
O 2.785601 -0.644318 -2.692679
O 3.692786 2.731625 0.027477
O 0.974154 2.792388 -0.919890
O -0.541710 1.087144 1.984592
O 0.853209 2.135795 4.116464
O -0.752522 3.775793 2.531363
N -1.403835 -1.026724 -0.853171
N -2.931929 -1.196617 -2.560698
N -2.329504 1.032274 0.230161
N -4.276818 1.923450 -0.892025
N -5.204870 0.895579 -2.796270
N 1.733107 2.497224 1.754755
C -0.488692 -2.076654 1.322481
C 0.253850 -3.428211 1.106567
C -0.218957 -1.275493 -0.004555
C 1.379180 -3.056695 0.114607
C 2.605228 -2.406849 0.777064
C -2.291357 0.025478 -0.697331
C -1.830540 -1.728343 -2.000360
C -3.233968 -0.091784 -1.748595
C -4.253481 0.902691 -1.827852
C -3.336506 1.952641 0.070845
H -1.572907 -2.256670 1.473561
H 0.616049 -3.814355 2.069872
H 0.240680 -0.301849 0.230690
H 1.676904 -3.900914 -0.527746
H 3.212465 -3.163797 1.299364
H 2.307870 -1.607490 1.477691
H -0.115557 -0.417313 2.431391
H -0.900123 -4.237668 -0.347421
H -1.261176 -2.564536 -2.394767
H -3.350679 2.776624 0.788749
H 5.331118 0.294590 -1.653559
H -5.199871 0.168033 -3.510231
H -5.896809 1.643819 -2.817910
H 2.545205 2.656613 2.361071
H 4.287025 2.014106 -0.396909
H -1.545127 1.128680 1.074370
H 0.319018 2.498692 4.867529


