%chk=000103632.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103632

0 1
 P  -1.3000000E-03 -1.0000000E-03 -0.9217000    
 O    1.349000     -0.5617000     -0.2292000    
 O   -1.161900     -0.8885000     -0.2289000    
 O  -0.1896000       1.448000     -0.2292000    
 O  -1.2000001E-03 -1.1000000E-03  -2.424800    
 N    3.669100      -1.319600       1.044500    
 N   -2.980600      -2.516000       1.045100    
 N  -0.6899000       3.837000       1.044400    
 C    1.853500      -1.820700     -0.3989000    
 C   -2.505700     -0.6941000     -0.3992000    
 C   0.6508000       2.514500     -0.3994000    
 C    3.027400      -2.195900      0.2487000    
 C   -3.417300      -1.521900      0.2488000    
 C   0.3896000       3.717900      0.2484000    
 C    3.509300      -3.505600      4.2900000E-02
 C   -4.792200      -1.282800      4.2599998E-02
 C    1.284300       4.788900      4.2300001E-02
 C    1.161900      -2.704100      -1.231500    
 C   -2.921900      0.3465000      -1.232100    
 C    1.760300       2.354400      -1.232100    
 C    2.813800      -4.394300     -0.7944000    
 C   -5.212500     -0.2359000     -0.7952000    
 C    2.401200       4.629300     -0.7952000    
 C    1.642300      -3.992500      -1.429800    
 C   -4.277700      0.5763000      -1.430700    
 C    2.637200       3.413500      -1.430500    
 C    4.690800      -3.883800      0.6947000    
 C   -5.711700      -2.115400      0.6945000    
 C    1.022800       6.001700      0.6940000    
 C    5.354300      -2.983000       1.515300    
 C   -5.264700      -3.140600       1.515600    
 C  -8.8699996E-02   6.127400       1.514800    
 C    4.806200      -1.724200       1.655200    
 C   -3.900800      -3.297100       1.656000    
 C  -0.9064000       5.024500       1.655100    
 H   0.2459000      -2.440000      -1.746000    
 H   -2.234400       1.006700      -1.746800    
 H    1.988300       1.428800      -1.746600    
 H    3.181200      -5.405400     -0.9561000    
 H   -6.271500     -4.7200002E-02 -0.9574000    
 H    3.094100       5.452100     -0.9573000    
 H    1.107900      -4.682800      -2.075300    
 H   -4.607100       1.384400      -2.076700    
 H    3.501900       3.294700      -2.076300    
 H    5.100600      -4.883100      0.5665000    
 H   -6.781800      -1.969400      0.5659000    
 H    1.684400       6.855300      0.5655000    
 H    6.268900      -3.258800       2.026800    
 H   -5.961800      -3.793700       2.027300    
 H  -0.3058000       7.057700       2.026300    
 H    5.280800     -0.9779000       2.283800    
 H   -3.492900      -4.081500       2.284900    
 H   -1.789800       5.063600       2.283700    


%chk=000103632-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103632

0 1
P -0.015795 0.000927 -0.089646
O 1.260856 -0.815266 0.733167
O -1.360687 -0.687313 0.741057
O 0.058127 1.518521 0.726007
O -0.020647 -0.008084 -1.670693
N 3.937399 -1.206297 0.236503
N -3.036430 -2.812067 0.255639
N -0.903426 4.047915 0.236497
C 1.677774 -2.123555 0.386091
C -2.702015 -0.396023 0.393697
C 0.998839 2.521600 0.385643
C 3.089451 -2.304387 0.182150
C -3.564306 -1.529239 0.195990
C 0.468917 3.843149 0.185943
C 3.560871 -3.651103 -0.081572
C -4.966659 -1.266027 -0.067339
C 1.415781 4.912664 -0.069864
C 0.773154 -3.184786 0.306950
C -3.169080 0.917707 0.308750
C 2.366917 2.249710 0.309598
C 2.626298 -4.733159 -0.155878
C -5.436990 0.083934 -0.146804
C 2.816492 4.624873 -0.140734
C 1.262325 -4.497464 0.027801
C -4.550939 1.148539 0.030511
C 3.275010 3.318276 0.038279
C 4.971188 -3.826551 -0.268316
C -5.823377 -2.400945 -0.248371
C 0.881889 6.230341 -0.252836
C 5.819371 -2.720657 -0.201698
C -5.288878 -3.687842 -0.176798
C -0.497424 6.431278 -0.190763
C 5.252680 -1.429339 0.047454
C -3.886895 -3.840814 0.072099
C -1.349239 5.305639 0.050573
H -0.300407 -3.010996 0.461044
H -2.481261 1.761009 0.458215
H 2.739923 1.227450 0.460184
H 2.995772 -5.744289 -0.362705
H -6.497782 0.268425 -0.352730
H 3.519783 5.441571 -0.340997
H 0.546101 -5.323212 -0.035231
H -4.908587 2.181214 -0.036418
H 4.345391 3.095746 -0.021850
H 5.365400 -4.830414 -0.464570
H -6.890094 -2.241628 -0.444319
H 1.567055 7.064673 -0.442905
H 6.900282 -2.820274 -0.339856
H -5.915101 -4.575070 -0.311091
H -0.937135 7.424053 -0.326659
H 5.902565 -0.546965 0.091573
H -3.447161 -4.844391 0.120626
H -2.436691 5.442544 0.090903


