%chk=000064987.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064987

0 1
 P   -3.187300       1.372400     -0.4069000    
 O   -1.750000     -0.6774000      6.1099999E-02
 O   -3.459500       1.543800       1.177000    
 O   -4.639100       1.640900      -1.064600    
 O   -2.074800       2.212900     -0.9590000    
 N    1.022000      -1.586300      0.1039000    
 N    2.744300      -1.139700      -1.208500    
 N   0.9270000      0.4501000       1.418000    
 N    2.683000       2.003400      0.7402000    
 N    4.244000       1.497300      -1.001700    
 C   -1.422100      -2.056500     -3.3599999E-02
 C  -9.6699998E-02  -2.328700      0.6838000    
 C    1.435700     -0.3496000      0.4687000    
 C   -2.558000      -2.838800      0.6107000    
 C    2.513000     -8.4899999E-02 -0.3617000    
 C    1.824300      -2.029200     -0.8986000    
 C   -2.968600     -0.3832000     -0.6082000    
 C    3.143800       1.144800     -0.2009000    
 C    1.618900       1.608600       1.480300    
 H   -1.322100      -2.335500      -1.090300    
 H  -0.1536000      -2.035300       1.739000    
 H   0.1663000      -3.392000      0.6423000    
 H   -3.430700      -2.912000     -4.6399999E-02
 H   -2.250000      -3.870500      0.8143000    
 H   -2.880900      -2.385700       1.554600    
 H    1.701900      -2.995300      -1.369100    
 H   -2.901700     -0.6452000      -1.668600    
 H   -3.833000     -0.8680000     -0.1490000    
 H    1.276100       2.320900       2.223100    
 H    4.589400      0.8584000      -1.705000    
 H    4.685200       2.396700     -0.8661000    
 H   -3.582600       2.445500       1.542900    
 H   -4.978000       2.560300      -1.107900    


%chk=000064987-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064987

0 1
P -3.174184 1.028097 0.069778
O -2.953892 -1.714939 0.738972
O -1.972703 1.195284 1.242923
O -4.553083 1.883149 0.698037
O -2.725308 1.439733 -1.414277
N 0.730582 -1.310657 0.581030
N 2.870205 -1.443482 -0.257574
N 0.447725 1.169666 0.469256
N 2.416197 2.306207 -0.415938
N 4.361322 1.148341 -1.078020
C -1.671212 -1.827386 0.000214
C -0.584333 -1.724934 1.107886
C 1.129289 -0.004031 0.302273
C -1.640574 -3.144412 -0.783032
C 2.448648 -0.102856 -0.212143
C 1.816528 -2.129636 0.221316
C -3.894057 -0.733673 0.234925
C 3.094736 1.115637 -0.575788
C 1.154813 2.276246 0.083043
H -1.558075 -0.970895 -0.698027
H -0.925976 -0.974661 1.840153
H -0.465270 -2.694839 1.621186
H -2.416742 -3.148971 -1.567458
H -0.660834 -3.288428 -1.276411
H -1.828575 -3.995866 -0.105113
H 1.779916 -3.210114 0.344196
H -4.284040 -0.990934 -0.769374
H -4.713494 -0.690835 0.966831
H 0.642309 3.235915 0.184946
H 4.879959 0.281484 -1.207675
H 4.771315 2.046709 -1.327774
H -0.925481 1.249950 0.898519
H -4.509507 2.867333 0.596919


