%chk=000065103.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065103

0 1
 P    2.441200      -1.915700       1.130000    
 P    3.614400      0.5967000      0.1414000    
 P    2.209000       1.514000      -2.284900    
 O   -1.852000      -2.002300      0.7031000    
 O   -2.937000      -4.421500     -0.8783000    
 O   0.8951000      -2.392100       1.095200    
 O    2.445700     -0.4957000      0.3596000    
 O    2.699200      -1.500700       2.672200    
 O    3.420700      -2.914100      0.5849000    
 O   -2.428400       4.321200      0.5000000    
 O    2.936300       1.676300     -0.8509000    
 O    4.683400     -0.1635000     -0.8031000    
 O    4.187900       1.178900       1.399600    
 O   0.8849000      0.6580000      -1.928700    
 O    1.631500       2.992700      -2.587200    
 O    3.074400      0.9305000      -3.362700    
 N   -2.977900     -0.1150000     -0.1904000    
 N   -1.164200      0.5451000       1.290600    
 N   -3.728900       1.947700     -0.6700000    
 N  -0.9477000       2.916900       1.598600    
 N   0.4961000       1.386400       2.661000    
 C   -1.908900      -3.476900      -1.168200    
 C   -2.885500      -1.570400     -0.1989000    
 C   -1.162300      -3.125000      0.1142000    
 C   -2.558100      -2.169100      -1.559300    
 C   0.2803000      -2.711000     -0.1414000    
 C   -2.200700      0.7701000      0.4791000    
 C   -3.894800      0.6522000     -0.8769000    
 C   -2.663300       2.018800      0.1825000    
 C   -2.030100       3.190800      0.7533000    
 C  -0.5605000       1.676700       1.835500    
 H   -1.276600      -3.903100      -1.951400    
 H   -3.842000      -1.941700      0.1880000    
 H   -1.192700      -3.937700      0.8488000    
 H   -3.453100      -2.284200      -2.178400    
 H   -1.838700      -1.539500      -2.097000    
 H   0.3257000      -1.824900     -0.7817000    
 H   0.8384000      -3.523500     -0.6172000    
 H   -3.424600      -4.125800     -9.1499999E-02
 H   -4.654800      0.2094000      -1.506200    
 H  -0.8155000     -0.3815000       1.512800    
 H    2.878200      -2.206400       3.329700    
 H   0.7903000      0.4302000       2.827400    
 H    1.021400       2.122700       3.119900    
 H    5.292600     -0.8177000     -0.3991000    
 H   0.3105000      0.3429000      -2.658700    
 H    1.206600       3.168700      -3.453600    


%chk=000065103-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065103

0 1
P 2.154912 -2.081061 0.415005
P 3.464014 0.508385 -0.698544
P 2.483798 3.563103 -0.342652
O -2.308353 -2.217745 1.237688
O -3.466863 -5.046760 0.856502
O 0.454692 -2.151742 0.723039
O 2.256939 -0.780919 -0.773185
O 2.648748 -1.363757 1.863025
O 2.766384 -3.447399 -0.094342
O -0.817887 3.348673 -1.783034
O 2.620386 1.858129 -1.124659
O 4.443363 0.272197 -2.069515
O 4.209030 0.349343 0.719153
O 4.012719 4.197103 -0.793408
O 1.414746 4.278448 -1.317990
O 2.464981 3.353771 1.233067
N -2.947763 -0.607859 -0.446557
N -1.078035 0.255911 0.969914
N -3.025972 1.108093 -1.974736
N -0.140656 2.301599 0.150802
N 0.830566 1.274454 1.986158
C -2.691246 -4.191371 -0.040255
C -3.361521 -1.841965 0.278597
C -1.583689 -3.425678 0.719884
C -3.550761 -3.056446 -0.672330
C -0.372176 -3.038826 -0.131238
C -1.983367 0.315583 -0.068694
C -3.563109 -0.059237 -1.608509
C -2.022692 1.362305 -1.022197
C -1.003849 2.379382 -0.904436
C -0.133351 1.284344 1.035042
H -2.295551 -4.884601 -0.798284
H -4.255184 -1.606832 0.882757
H -1.250820 -3.970251 1.617589
H -4.600263 -3.380936 -0.745838
H -3.185651 -2.812684 -1.684449
H -0.652155 -2.485523 -1.046813
H 0.202843 -3.944187 -0.406538
H -3.768573 -4.518602 1.640866
H -4.386780 -0.558924 -2.112977
H -0.983461 -0.622611 1.497410
H 3.404628 -0.662424 1.680587
H 1.001159 0.468892 2.589061
H 1.514458 2.070592 1.922895
H 5.083776 -0.483296 -2.002370
H 3.994745 4.627044 -1.688459
H 0.168341 3.852184 -1.575331


