%chk=000133418.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133418

0 1
 P    4.490600      0.4060000     -0.8791000    
 O   0.2254000       1.184600     -0.7104000    
 O   -1.422000       3.820000      8.6099997E-02
 O   0.7117000       3.727800       1.780600    
 O    3.042900       1.122200     -0.8949000    
 O    5.420100       1.315100      7.5700000E-02
 O    5.068100      1.2100000E-02  -2.204800    
 O   -4.721900      -3.128600      0.8697000    
 N   -1.815300      0.2347000      4.3099999E-02
 N   -4.090100      0.5337000     -0.7650000    
 N   -2.095600      -1.791800      0.9682000    
 N    4.259100      -1.035500     -5.1100001E-02
 N   -5.562500      -1.300700     -0.2811000    
 N   -6.298100      0.6132000      -1.443800    
 N    3.505600      -3.101400      0.4580000    
 C   -1.148800       2.559900      0.6967000    
 C   0.2698000       2.504800       1.231700    
 C   -1.149900       1.469400     -0.3760000    
 C    1.064500       2.110800     -1.2000001E-03
 C    2.395800       1.455700      0.3207000    
 C   -3.105300     -0.1272000     -0.1509000    
 C   -1.240100     -0.8123000      0.7291000    
 C   -3.267100      -1.358500      0.4137000    
 C   -4.554500      -2.022700      0.3700000    
 C   -5.324800     -0.1112000     -0.8031000    
 C    3.467200      -2.119300     -0.4149000    
 C    4.830200      -1.402000       1.161100    
 C    4.353100      -2.660500       1.443200    
 C    2.692100      -2.098400      -1.671000    
 H   -1.893700       2.416700       1.486100    
 H   0.3343000       1.723600       1.999300    
 H   -1.641600       1.794700      -1.299800    
 H    1.233800       2.971600     -0.6609000    
 H    2.235900      0.5387000      0.8961000    
 H    3.033600       2.133300      0.8959000    
 H   -2.325400       3.778900     -0.2717000    
 H    1.635700       3.610900       2.059000    
 H  -0.2013000     -0.8068000       1.030500    
 H   -3.975000       1.451300      -1.182600    
 H    5.505100     -0.7450000       1.690400    
 H    5.758500       2.170800     -0.2636000    
 H   -6.103800       1.526400      -1.839800    
 H   -7.242100      0.2547000      -1.538600    
 H    4.577300      -3.271400       2.305400    
 H    2.011400      -1.243100      -1.705200    
 H    3.352800      -2.062500      -2.541900    
 H    2.083700      -3.004900      -1.756100    


%chk=000133418-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133418

0 1
P 1.644821 -0.596452 -1.550298
O 0.053052 1.776688 0.027970
O 0.446095 4.343317 1.569359
O 1.310040 2.472416 3.336182
O 0.743875 -0.802375 -0.055127
O 1.899924 1.080002 -1.679581
O 0.801897 -1.374646 -2.639742
O -6.173005 -0.382938 -0.369459
N -2.293135 2.088761 0.536730
N -2.041573 -0.058749 -0.766008
N -4.581064 2.039127 0.740145
N 3.288337 -1.140004 -1.283985
N -4.149323 -1.152630 -1.290645
N -2.110540 -1.985295 -2.116382
N 5.060831 -2.516933 -1.005292
C -0.496874 3.267268 1.818039
C 0.257264 2.036628 2.415447
C -0.979538 2.752616 0.448004
C 0.929594 1.397262 1.181406
C 1.073516 -0.149416 1.229227
C -2.749925 0.929658 -0.108454
C -3.477836 2.732914 1.019371
C -4.148208 0.899624 0.033179
C -4.930782 -0.229841 -0.524858
C -2.827457 -1.065500 -1.385997
C 3.747507 -2.492340 -1.264580
C 4.412328 -0.304502 -1.022833
C 5.477331 -1.174148 -0.860072
C 2.860428 -3.673490 -1.507426
H -1.329723 3.597851 2.467017
H -0.457654 1.344628 2.899900
H -0.983004 3.554791 -0.309429
H 1.907323 1.883767 1.016452
H 0.342273 -0.602376 1.919435
H 2.094923 -0.425151 1.549266
H 1.136039 4.305680 2.288015
H 0.999653 2.426820 4.274278
H -3.444651 3.691371 1.532694
H -1.029790 -0.185602 -0.639871
H 4.327008 0.777516 -1.031727
H 1.117686 1.619121 -1.307228
H -1.122614 -1.850360 -2.363578
H -2.655082 -2.726152 -2.551817
H 6.518012 -0.933457 -0.657025
H 2.024317 -3.723901 -0.785151
H 2.417633 -3.650082 -2.518830
H 3.469472 -4.583686 -1.403922


