%chk=000226547.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226547

0 1
 P   1.4000000E-03  6.0000003E-04 -0.8387000    
 O   -1.175000      0.8730000     -0.1468000    
 O    1.343300      0.5784000     -0.1459000    
 O  -0.1691000      -1.450400     -0.1460000    
 O   1.3000000E-03  6.0000003E-04  -2.341800    
 O   -3.921000       3.236400       1.727300    
 O    4.762600       1.773700       1.729700    
 O  -0.8431000      -5.009700       1.729100    
 O   -1.818800       2.739700       1.336200    
 O    3.280400      0.2024000       1.338700    
 O   -1.463100      -2.940400       1.338500    
 N   -3.044400       2.534000       1.170500    
 N    3.716100       1.366100       1.172400    
 N  -0.6730000      -3.899400       1.172100    
 C   -2.511400      0.6620000     -0.3157000    
 C    1.831500       1.845400     -0.3159000    
 C   0.6842000      -2.506700     -0.3162000    
 C   -3.454000       1.468100      0.3228000    
 C    2.998900       2.253700      0.3238000    
 C   0.4542000      -3.722000      0.3233000    
 C   -2.930800     -0.3796000      -1.143400    
 C    1.138400       2.724700      -1.144000    
 C    1.792100      -2.346000      -1.144300    
 C   -4.815800       1.232500      0.1335000    
 C    3.476700       3.550400      0.1338000    
 C    1.338400      -4.784000      0.1332000    
 C   -4.292500     -0.6150000      -1.332700    
 C    1.616400       4.021200      -1.333900    
 C    2.676100      -3.408100      -1.334400    
 C   -5.235000      0.1909000     -0.6943000    
 C    2.785400       4.434200     -0.6949000    
 C    2.449300      -4.627000     -0.6956000    
 H   -2.242300      -1.036800      -1.661500    
 H   0.2252000       2.457400      -1.661900    
 H    2.017200      -1.421500      -1.662400    
 H   -5.580500       1.838100      0.6133000    
 H    4.383400       3.909700      0.6139000    
 H    1.196300      -5.748900      0.6132000    
 H   -4.619700      -1.426200      -1.976500    
 H    1.078200       4.710200      -1.978400    
 H    3.541800      -3.286400      -1.979000    
 H   -6.295200      7.0000002E-03 -0.8419000    
 H    3.157000       5.444000     -0.8429000    
 H    3.138100      -5.453600     -0.8437000    


%chk=000226547-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226547

0 1
P 0.021605 0.005200 -0.752367
O -1.293708 0.811706 0.047967
O 1.359572 0.734320 0.077709
O -0.040974 -1.513648 0.082896
O 0.032328 -0.005406 -2.329606
O -4.038694 3.687210 1.041577
O 5.354823 1.465597 0.498710
O -1.333964 -5.227021 1.075313
O -2.095878 3.474245 -0.120400
O 3.983030 0.088856 -0.684067
O -1.967369 -3.517022 -0.285864
N -3.209842 3.001042 0.329614
N 4.239793 1.210431 -0.097478
N -1.065914 -4.223740 0.310341
C -2.660274 0.576461 -0.245550
C 1.834762 2.048017 -0.171428
C 0.840172 -2.598786 -0.148502
C -3.599066 1.623141 -0.031858
C 3.235046 2.290346 -0.160474
C 0.356624 -3.918916 0.056942
C -3.124010 -0.699403 -0.623851
C 0.944635 3.133499 -0.284672
C 2.201492 -2.399364 -0.449395
C -4.985849 1.378226 -0.174728
C 3.731675 3.613578 -0.227926
C 1.241437 -5.021195 0.003443
C -4.504365 -0.927901 -0.797457
C 1.446165 4.447504 -0.392648
C 3.071708 -3.505591 -0.542044
C -5.440613 0.108266 -0.570328
C 2.839324 4.692989 -0.356717
C 2.598116 -4.818086 -0.307189
H -2.421275 -1.529883 -0.736210
H -0.135423 2.962027 -0.256813
H 2.595843 -1.387270 -0.579604
H -5.678530 2.200902 0.022676
H 4.814067 3.763862 -0.188484
H 0.839113 -6.019479 0.196859
H -4.840760 -1.927739 -1.088084
H 0.737436 5.276442 -0.483007
H 4.125233 -3.328494 -0.779150
H -6.511918 -0.073794 -0.694421
H 3.225174 5.714125 -0.426134
H 3.278455 -5.672551 -0.364992


