%chk=000137846.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137846

0 1
 P  -0.1746000     -0.1857000      0.5778000    
 O   -1.252700     -0.9673000     -0.3595000    
 O  -0.8405000       1.294900      0.7023000    
 O  -3.6400001E-02 -0.8541000       1.922700    
 N    1.231100     -1.0400000E-02 -0.3022000    
 C    2.305200      0.7773000      0.3062000    
 C    1.802000      -1.226000     -0.8870000    
 C    3.348200       1.172500     -0.7253000    
 C    2.492000      -2.071900      0.1697000    
 C   -2.550600      -1.258000      0.1323000    
 C   -1.198000       1.984800     -0.4833000    
 C   -3.333700      -1.983400     -0.9411000    
 C   -1.791900       3.327100     -0.1127000    
 H    1.862600       1.708600      0.6813000    
 H    2.756900      0.3005000       1.182000    
 H   0.9937000      -1.815900      -1.335200    
 H    2.477800      -1.013700      -1.721700    
 H    4.007600      0.3436000     -0.9989000    
 H    2.887800       1.575300      -1.634100    
 H    3.989600       1.958900     -0.3118000    
 H    3.429800      -1.634100      0.5235000    
 H    1.852600      -2.283200       1.030200    
 H    2.755000      -3.041700     -0.2688000    
 H   -2.463300      -1.886800       1.023600    
 H   -3.055500     -0.3274000      0.4077000    
 H  -0.3098000       2.133100      -1.104700    
 H   -1.929900       1.403100      -1.050700    
 H   -4.341000      -2.227500     -0.5925000    
 H   -3.411100      -1.367800      -1.843400    
 H   -2.825200      -2.909100      -1.230200    
 H   -2.077000       3.888800      -1.006600    
 H   -2.676500       3.195700      0.5193000    
 H   -1.074200       3.920300      0.4635000    


%chk=000137846-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137846

0 1
P -0.337867 -0.068515 0.779771
O -1.344713 -0.887617 -0.380775
O -0.811050 1.601634 0.773983
O -0.441327 -0.657228 2.255559
N 1.158899 -0.058506 -0.109594
C 2.238558 0.836315 0.398499
C 1.581543 -1.292808 -0.827266
C 2.864845 1.690595 -0.721282
C 2.102808 -2.422707 0.090956
C -2.530023 -1.630710 0.141530
C -1.105393 2.267703 -0.528127
C -2.938267 -2.619472 -0.946902
C -1.033693 3.770957 -0.271235
H 1.807310 1.501343 1.168514
H 3.023714 0.234263 0.900594
H 0.721109 -1.648060 -1.418382
H 2.366938 -0.990203 -1.544697
H 3.299410 1.063119 -1.520154
H 2.108332 2.352053 -1.178402
H 3.676527 2.319123 -0.309513
H 2.975554 -2.097968 0.685741
H 1.316840 -2.748405 0.795641
H 2.410930 -3.294935 -0.515305
H -2.252725 -2.134294 1.086334
H -3.335409 -0.901593 0.352813
H -0.367983 1.939795 -1.286620
H -2.114464 1.956036 -0.856730
H -3.836159 -3.180520 -0.627233
H -3.173486 -2.092099 -1.887304
H -2.126971 -3.341225 -1.143909
H -1.297980 4.326026 -1.190867
H -1.738456 4.060234 0.526686
H -0.017351 4.068167 0.040077


