%chk=000147701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147701

0 1
 P  -1.8999999E-02  0.1512000     -0.4602000    
 O  -0.1109000      0.4875000      -1.937100    
 O   -2.327200       3.163300      0.5599000    
 N    1.567800      8.3300002E-02  7.5300001E-02
 N  -0.6949000      -1.369500     -0.1577000    
 N  -0.8489000       1.251200      0.5015000    
 C    2.506500     -0.8095000     -0.6025000    
 C    2.274100       1.269900      0.5503000    
 C  -0.6260000      -1.858000       1.226500    
 C   -2.056500      -1.606500     -0.6553000    
 C   -2.081900       1.874800      5.5999998E-03
 C  -0.9660000       1.056600       1.948400    
 C    3.617200      -1.252300      0.3349000    
 C    2.913000       2.026400     -0.6019000    
 C  -0.9384000      -3.342900       1.300600    
 C   -2.208800      -1.125600      -2.088400    
 H    2.899100     -0.3966000      -1.537200    
 H    1.965000      -1.716800     -0.8966000    
 H    3.017500       1.033900       1.318800    
 H    1.576200       1.944900       1.054700    
 H   0.3815000      -1.710600       1.627500    
 H   -1.335800      -1.366500       1.889100    
 H   -2.282100      -2.676800     -0.6835000    
 H   -2.810100      -1.120000     -2.6300000E-02
 H   -1.998100       2.036300      -1.072400    
 H   -2.959700       1.240900      0.1697000    
 H  -0.1053000      0.5202000       2.357000    
 H   -1.891500      0.5474000       2.232100    
 H  -0.9591000       2.027100       2.457900    
 H    4.153900      -2.097900     -0.1097000    
 H    3.222900      -1.590400       1.299600    
 H    4.359600     -0.4682000      0.5102000    
 H    3.252700       3.006400     -0.2482000    
 H    2.202400       2.206300      -1.415500    
 H    3.793900       1.519600      -1.006600    
 H  -0.6296000      -3.730600       2.278300    
 H  -0.3920000      -3.911900      0.5406000    
 H   -2.007800      -3.557200       1.209400    
 H   -3.124400      -1.562400      -2.506900    
 H   -1.391200      -1.464600      -2.733100    
 H   -2.350100     -4.5899998E-02  -2.164500    
 H   -2.646700       3.034400       1.468400    


%chk=000147701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147701

0 1
P -0.414818 0.285825 -0.367031
O -0.742762 0.708081 -1.881088
O -0.579044 3.832142 0.617784
N 1.263905 0.198977 0.164972
N -1.018663 -1.306978 0.006821
N -1.202431 1.441601 0.718839
C 2.122547 -0.788253 -0.551021
C 1.929280 1.465710 0.584762
C -0.570541 -2.132322 1.149044
C -2.237881 -1.732704 -0.733803
C -1.537226 2.763788 0.226438
C -1.359946 1.172138 2.155164
C 3.182062 -1.424534 0.369298
C 2.506079 2.323043 -0.565000
C -0.142749 -3.564086 0.760638
C -1.944493 -2.413710 -2.087787
H 2.618319 -0.315236 -1.423858
H 1.461046 -1.574732 -0.956809
H 2.727243 1.199378 1.304152
H 1.185806 2.076177 1.126101
H 0.276965 -1.609294 1.627675
H -1.387520 -2.202763 1.903726
H -2.805034 -2.413035 -0.067474
H -2.880279 -0.848629 -0.913659
H -1.507191 2.739729 -0.873360
H -2.551484 3.039656 0.584783
H -1.490974 0.091778 2.330058
H -2.272346 1.682727 2.521879
H -0.498138 1.516423 2.765815
H 3.762976 -2.180863 -0.190766
H 2.706698 -1.920067 1.234459
H 3.896376 -0.674486 0.752977
H 2.941714 3.250493 -0.150140
H 1.707320 2.609488 -1.270675
H 3.300570 1.798061 -1.125892
H 0.177851 -4.118633 1.662971
H 0.696698 -3.547982 0.043820
H -0.977011 -4.123084 0.300882
H -2.888581 -2.732807 -2.570191
H -1.301340 -3.301956 -1.959544
H -1.435498 -1.697134 -2.754471
H -0.776205 4.128974 1.542211


