%chk=000103998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103998

0 1
 P  -0.6926000     -0.1946000     -0.6172000    
 O   -2.114200     -0.9703000     -0.5888000    
 O  -0.9292000       1.105400      0.3214000    
 O  -0.2040000      0.1341000      -2.000000    
 N    1.622000     -0.3396000      0.3950000    
 C    2.702000     -0.9456000       1.173200    
 C    2.197000     -9.7599998E-02 -0.9278000    
 C    3.915300     -0.1178000      0.7758000    
 C    3.581900      0.4424000     -0.6035000    
 C   0.4364000      -1.181800      0.3400000    
 C   -2.782500      -1.227200      0.6338000    
 C   -1.797000       2.125800     -0.1415000    
 C   -4.075000      -1.960500      0.3445000    
 C   -1.860100       3.227200      0.8952000    
 H    2.862300      -1.995200      0.8951000    
 H    2.514000     -0.8945000       2.250200    
 H    1.734000      0.7119000      -1.488900    
 H    2.274200      -1.006200      -1.536800    
 H    4.826600     -0.7240000      0.7580000    
 H    4.072800      0.7057000       1.482300    
 H    3.582800       1.538600     -0.5652000    
 H    4.317700      0.1333000      -1.353100    
 H   0.6210000      -2.150800     -0.1360000    
 H   5.0600000E-02  -1.353000       1.348800    
 H   -2.150100      -1.845700       1.275900    
 H   -2.994500     -0.2861000       1.148700    
 H   -1.412500       2.521900      -1.086700    
 H   -2.794400       1.711300     -0.3154000    
 H   -4.616100      -2.179000       1.269400    
 H   -4.719100      -1.362500     -0.3087000    
 H   -3.876000      -2.901200     -0.1793000    
 H   -2.519200       4.035700      0.5668000    
 H   -2.228000       2.836500       1.849600    
 H  -0.8626000       3.638000       1.082700    


%chk=000103998-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103998

0 1
P -0.876369 -0.368109 -0.037476
O -2.240511 -1.341571 0.501925
O -0.710144 0.956693 1.117576
O -1.049928 0.166925 -1.542320
N 1.926354 -1.004372 0.283814
C 2.478599 0.093982 1.136301
C 2.416211 -0.889544 -1.116780
C 3.372540 0.917406 0.171260
C 3.724877 -0.087572 -0.958180
C 0.626573 -1.516025 0.528010
C -3.568596 -1.159199 -0.147242
C -1.461100 2.217831 0.864972
C -4.251570 -2.525722 -0.190162
C -0.723305 3.338906 1.595775
H 3.069969 -0.338606 1.967447
H 1.663033 0.706236 1.566275
H 1.690772 -0.341276 -1.759527
H 2.575545 -1.891940 -1.556348
H 4.264819 1.328751 0.672723
H 2.795662 1.761760 -0.249167
H 4.027297 0.408586 -1.895756
H 4.543824 -0.757178 -0.637322
H 0.433497 -2.453065 -0.021220
H 0.425230 -1.670083 1.600423
H -4.149063 -0.439385 0.462100
H -3.423942 -0.740215 -1.162242
H -1.507642 2.399730 -0.226225
H -2.490288 2.096040 1.256637
H -5.268860 -2.429097 -0.614553
H -3.676179 -3.229031 -0.816207
H -4.335946 -2.949988 0.825148
H -1.265257 4.295199 1.470812
H -0.649690 3.118223 2.674643
H 0.297089 3.460312 1.192387


