%chk=000055375.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055375

0 1
 P  -6.9999998E-04  8.9999996E-03  0.7861000    
 O  -1.8000000E-03 -9.0700001E-02   2.291800    
 N   -2.572400     -0.1719000      0.5315000    
 N    2.571400     -0.1690000      0.5353000    
 C   -1.403200     -0.9109000      0.1168000    
 C    1.403800     -0.9092000      0.1186000    
 C  -1.0000000E-03   1.641700      0.1093000    
 C   9.7599998E-02   1.823300      -1.269400    
 C  -9.9200003E-02   2.745700      0.9550000    
 C   -3.868600     -0.5715000      0.2442000    
 C    3.868400     -0.5669000      0.2496000    
 C   9.7900003E-02   3.111900      -1.803500    
 C  -9.9100001E-02   4.034200      0.4209000    
 C  -6.0000003E-04   4.217300     -0.9585000    
 C   -4.115100      -1.748800     -0.4857000    
 C    4.117400      -1.743800     -0.4802000    
 C   -4.970800      0.1905000      0.6736000    
 C    4.969100      0.1948000      0.6832000    
 C   -6.498800      -1.381600     -0.3413000    
 C    6.500500      -1.376100     -0.3285000    
 C   -5.419000      -2.150300     -0.7761000    
 C    5.422200      -2.144900     -0.7668000    
 C   -6.274600     -0.2111000      0.3835000    
 C    6.273900     -0.2063000      0.3966000    
 C   -7.893000      -1.810700     -0.6513000    
 C    7.895700      -1.804700     -0.6348000    
 H   -1.395800      -1.922600      0.5348000    
 H   -1.329100     -0.9630000     -0.9741000    
 H    1.396900      -1.919600      0.5404000    
 H    1.333700     -0.9687000     -0.9718000    
 H   -2.455500      0.6697000       1.084500    
 H    2.452300      0.6750000       1.084400    
 H   0.1707000      0.9704000      -1.937200    
 H  -0.1773000       2.614400       2.030100    
 H   0.1736000       3.254500      -2.877500    
 H  -0.1761000       4.894900       1.078700    
 H  -8.9999998E-04   5.220500      -1.374500    
 H   -3.303900      -2.376700     -0.8447000    
 H    3.307600      -2.372200     -0.8410000    
 H   -4.813500       1.106400       1.239100    
 H    4.810100       1.109600       1.250100    
 H   -5.581300      -3.063000      -1.343400    
 H    5.586500      -3.059200      -1.330900    
 H   -7.107400      0.3974000      0.7259000    
 H    7.105800      0.4000000      0.7451000    
 H   -8.216200      -1.378200      -1.603400    
 H   -7.965000      -2.901600     -0.7190000    
 H   -8.588100      -1.492200      0.1330000    
 H    8.560900     -0.9406000     -0.7375000    
 H    8.275700      -2.447000      0.1659000    
 H    7.941100      -2.357500      -1.579400    


%chk=000055375-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055375

0 1
P -0.180155 1.430037 -0.025655
O -0.124652 1.730657 1.574857
N -2.385167 0.025063 0.590465
N 2.032145 0.045230 0.612042
C -1.900829 0.806144 -0.530029
C 1.040671 0.029917 -0.444252
C 0.205886 2.922705 -1.067456
C 0.249347 2.859458 -2.480079
C 0.454795 4.137742 -0.388992
C -3.498019 -0.828711 0.514162
C 3.206158 -0.717540 0.576179
C 0.543493 4.026843 -3.219939
C 0.750434 5.301101 -1.134698
C 0.794494 5.246174 -2.547329
C -4.231131 -1.017856 -0.689742
C 3.525207 -1.568685 -0.518781
C -3.912450 -1.544133 1.676345
C 4.126608 -0.645690 1.664321
C -5.746401 -2.624680 0.423025
C 5.650585 -2.240906 0.552008
C -5.329339 -1.907156 -0.723014
C 4.729764 -2.307674 -0.520462
C -5.013212 -2.416882 1.623805
C 5.316109 -1.394445 1.644959
C -6.930239 -3.576634 0.382850
C 6.944352 -3.038385 0.545639
H -1.794379 0.188260 -1.443794
H -2.523193 1.692390 -0.784864
H 0.455292 -0.915377 -0.504021
H 1.486141 0.232931 -1.438802
H -2.033947 0.306932 1.513254
H 1.751183 0.516434 1.481834
H 0.059543 1.916747 -3.009465
H 0.416882 4.153408 0.706391
H 0.579589 3.985620 -4.313794
H 0.947706 6.245193 -0.615806
H 1.025491 6.149110 -3.123251
H -3.962894 -0.466686 -1.597541
H 2.835438 -1.668185 -1.363859
H -3.359537 -1.413183 2.614949
H 3.900206 0.004715 2.518453
H -5.877461 -2.035881 -1.664877
H 4.951224 -2.956433 -1.377432
H -5.309312 -2.953878 2.534081
H 6.004671 -1.319231 2.496576
H -7.720975 -3.273536 1.095606
H -7.384051 -3.611223 -0.623038
H -6.631690 -4.608511 0.650074
H 7.831117 -2.376547 0.582977
H 7.009462 -3.716399 1.418150
H 7.029841 -3.657664 -0.364528


