%chk=000051116.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051116

1 1
 P   8.4799998E-02   2.596400     -0.4158000    
 O    1.313900       1.892400      0.3640000    
 O   -1.015100       1.423400     -0.6091000    
 O   -3.241200     -0.7258000       1.318600    
 O   0.6436000       2.825200      -1.917600    
 O   -2.915000      -2.321700     -0.9253000    
 O  -0.4391000       3.842100      0.2395000    
 N    3.302700      -1.265300      0.3712000    
 C    2.648700     -1.6200000E-02  0.9443000    
 C    4.084400      -1.976800       1.466000    
 C    4.249000     -0.8714000     -0.7537000    
 C    2.228500      -2.196500     -0.1722000    
 C    1.897200      0.7054000     -0.1568000    
 C   -2.640000     -0.1891000      0.1380000    
 C   -1.648400      0.8955000      0.5436000    
 C   -1.948100      -1.329500     -0.5973000    
 C   -4.277600      0.1165000       1.795600    
 C   -2.328300      -3.404600      -1.632800    
 H    3.433000      0.6190000       1.373400    
 H    1.976500     -0.3173000       1.756700    
 H    4.545700      -2.873600       1.041700    
 H    3.388600      -2.248100       2.265500    
 H    4.852700      -1.294000       1.840900    
 H    3.682600     -0.5782000      -1.640900    
 H    4.855700      -1.747500      -1.005500    
 H    4.895200     -6.1099999E-02 -0.4036000    
 H    2.700000      -3.157900     -0.4009000    
 H    1.804200      -1.790600      -1.093600    
 H    1.460000      -2.332500      0.5945000    
 H    2.551100       1.030100     -0.9685000    
 H    1.098800      9.2000000E-02 -0.5771000    
 H   -3.412300      0.2172000     -0.5287000    
 H  -0.8943000      0.4906000       1.228200    
 H   -2.147100       1.716300       1.066700    
 H   -1.470900     -0.9681000      -1.515200    
 H   -1.186600      -1.785700      4.6900000E-02
 H   0.1184000       3.371500      -2.540500    
 H   -3.888300       1.069500       2.161900    
 H   -5.035400      0.2855000       1.024000    
 H   -4.761000     -0.3892000       2.636700    
 H   -1.898200      -3.058000      -2.577500    
 H   -1.559100      -3.889700      -1.024000    
 H   -3.110500      -4.135800      -1.853700    


%chk=000051116-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000051116

1 1
P -0.191479 -0.170057 1.512897
O 1.231594 -0.991766 2.097675
O -1.391351 -1.414822 1.598007
O -4.845232 -0.190452 1.074450
O 0.135706 -0.098388 -0.156668
O -2.086277 -0.218910 -1.370283
O -0.512253 1.161314 2.302734
N 4.293580 -0.705940 -0.184359
C 3.122473 -0.370979 0.769492
C 5.021982 0.602673 -0.500701
C 3.763155 -1.306549 -1.486990
C 5.273968 -1.674230 0.474433
C 2.213353 -1.553773 1.165090
C -3.418866 -0.211922 0.738178
C -2.790766 -0.998750 1.906954
C -3.221813 -0.866460 -0.651773
C -5.554210 1.014399 0.617101
C -2.074049 -0.500950 -2.818223
H 2.506002 0.384674 0.252621
H 3.563043 0.071738 1.678847
H 5.883701 0.389031 -1.151746
H 5.366153 1.058575 0.439997
H 4.325203 1.285349 -1.010017
H 3.380108 -2.319266 -1.296233
H 4.585202 -1.354071 -2.217506
H 2.950449 -0.667540 -1.864286
H 6.118113 -1.849372 -0.210207
H 4.766764 -2.626640 0.684736
H 5.638709 -1.230552 1.413338
H 1.714210 -2.004036 0.289891
H 2.735519 -2.326214 1.753144
H -3.003538 0.820437 0.704061
H -3.320837 -1.951436 2.060271
H -2.814591 -0.398314 2.831321
H -3.025857 -1.952990 -0.575025
H -4.135457 -0.699230 -1.251852
H -0.762088 -0.129494 -0.728006
H -5.122739 1.925712 1.075754
H -5.532467 1.113906 -0.487768
H -6.595156 0.887830 0.949403
H -1.972106 -1.586185 -3.009017
H -3.005955 -0.124895 -3.276055
H -1.213098 0.042946 -3.236079


