%chk=000161086.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161086

0 1
 P    4.149000      4.4300001E-02 -0.1900000    
 O   -4.104700       1.554100      0.8310000    
 O    4.255100       1.556000     -0.7737000    
 O    5.351100      4.1200001E-02  0.9020000    
 O   -4.147900      0.9481000      -1.352400    
 O    4.355600     -0.9918000      -1.262500    
 N    2.734100     -4.6799999E-02  0.6627000    
 N   -3.573300      -1.604700     -0.8941000    
 C   -1.028900     -0.3110000      0.1429000    
 C   0.3185000     -0.4174000      0.8614000    
 C   -2.219300     -0.7622000       1.000100    
 C   -3.574400     -0.7334000      0.2818000    
 C    1.458200      6.8700001E-02 -3.3799998E-02
 C   -3.973200      0.6546000     -0.1752000    
 H   -1.183500      0.7275000     -0.1741000    
 H  -0.9738000     -0.9164000     -0.7690000    
 H   0.4931000      -1.459600       1.156700    
 H   0.2862000      0.1788000       1.782000    
 H   -2.268800     -0.1256000       1.892500    
 H   -2.030400      -1.782400       1.359000    
 H   -4.353800      -1.090800      0.9644000    
 H    1.296800       1.110700     -0.3309000    
 H    1.485200     -0.5370000     -0.9466000    
 H    2.690000      0.4971000       1.524200    
 H   -2.950600      -1.234900      -1.610600    
 H   -4.504200      -1.622000      -1.309500    
 H   -4.354200       2.442300      0.4979000    
 H    5.003100       1.780400      -1.367400    
 H    6.278100      1.8999999E-02  0.5819000    


%chk=000161086-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161086

0 1
P 4.272928 0.004708 -0.094640
O -4.358763 1.284789 1.237191
O 4.349587 1.290576 -1.259542
O 5.221866 0.496484 1.266902
O -4.035636 1.325743 -1.063021
O 4.714551 -1.381670 -0.745916
N 2.754361 0.247013 0.619738
N -3.601277 -1.544235 -1.045803
C -1.026211 -0.244686 0.000151
C 0.336558 -0.310666 0.725354
C -2.164125 -0.818848 0.872452
C -3.572019 -0.775943 0.203024
C 1.482088 0.269746 -0.127868
C -4.005104 0.692437 0.015213
H -1.246217 0.807110 -0.274915
H -0.960718 -0.819201 -0.945347
H 0.579897 -1.357137 0.991351
H 0.269675 0.255581 1.678700
H -2.213810 -0.273953 1.835035
H -1.956161 -1.882067 1.093778
H -4.282522 -1.232413 0.916052
H 1.234250 1.302378 -0.449256
H 1.603885 -0.336184 -1.045484
H 2.754881 0.565746 1.590029
H -3.108898 -1.080159 -1.816866
H -4.542902 -1.828484 -1.333298
H -4.613170 2.236109 1.086060
H 4.945921 1.084134 -2.024760
H 6.080185 0.009891 1.346386


