%chk=000144105.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144105

0 1
 P   0.4100000      0.4822000     -0.7505000    
 N   -1.029000     -0.3799000     -0.4709000    
 N    1.657600     -0.6940000     -0.7087000    
 N   0.7817000       1.262000      0.7470000    
 C    2.622200     -0.2720000      0.3189000    
 C    1.791600      0.4117000       1.414600    
 C   -2.242600      0.4389000     -0.4635000    
 C   -1.004300      -1.248700      0.7070000    
 C    2.317200      -1.013300      -1.967000    
 C    1.266500       2.635900      0.6090000    
 C   -2.275200       1.347500      -1.689200    
 C   -2.297100       1.254200      0.8247000    
 C   0.2585000      -2.105600      0.7060000    
 C   -2.257000      -2.118800      0.7226000    
 H    3.350500      0.4444000     -8.7700002E-02
 H    3.184200      -1.122600      0.7205000    
 H    1.313900     -0.2372000       2.150600    
 H    2.468500       1.019900       2.031600    
 H   -3.140400     -0.1822000     -0.5490000    
 H  -0.9686000     -0.7134000       1.661900    
 H    3.059900      -1.805400      -1.817500    
 H    2.826900     -0.1475000      -2.406700    
 H    1.597800      -1.395800      -2.700800    
 H    2.202700       2.705500      4.1800000E-02
 H    1.433800       3.078900       1.597700    
 H   0.5203000       3.268400      0.1130000    
 H   -3.277200       1.784700      -1.786100    
 H   -1.586400       2.197700      -1.638200    
 H   -2.091500      0.7902000      -2.615500    
 H   -2.350500      0.6762000       1.749200    
 H   -3.242500       1.816100      0.8148000    
 H   -1.535700       2.028400      0.9167000    
 H  -1.5100000E-02  -3.009600       1.280100    
 H   0.4718000      -2.580100     -0.2609000    
 H    1.125300      -1.854000       1.293700    
 H   -3.162200      -1.565800      0.9917000    
 H   -2.172000      -2.909700       1.477600    
 H   -2.419700      -2.615400     -0.2411000    


%chk=000144105-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000144105

0 1
P 0.601673 1.012440 -0.569140
N -0.752394 -0.124661 -0.234621
N 1.952288 -0.191047 -0.717655
N 1.399356 1.563428 0.966791
C 3.074463 0.047567 0.209200
C 2.438225 0.649009 1.477069
C -2.117853 0.256796 -0.709785
C -0.607995 -1.352399 0.594423
C 2.280779 -0.744050 -2.035219
C 0.662138 2.369319 1.938920
C -2.196571 0.316428 -2.256335
C -2.634929 1.575088 -0.075137
C -1.032392 -2.628773 -0.176199
C -1.341244 -1.250211 1.956550
H 3.823253 0.759583 -0.212122
H 3.593833 -0.907176 0.430060
H 2.023967 -0.155018 2.132285
H 3.185699 1.214085 2.068227
H -2.793792 -0.554023 -0.373470
H 0.480397 -1.439705 0.776808
H 2.764660 -1.733942 -1.919476
H 2.967384 -0.096925 -2.630302
H 1.355264 -0.891287 -2.620387
H 1.362092 2.998070 2.524178
H 0.065514 1.761939 2.661743
H -0.037515 3.043297 1.412147
H -3.229557 0.528863 -2.592696
H -1.536707 1.112996 -2.645866
H -1.874148 -0.644624 -2.695113
H -2.574141 1.526330 1.026796
H -3.687643 1.763059 -0.361483
H -2.029680 2.434644 -0.418855
H -0.829580 -3.530278 0.432507
H -2.112445 -2.627045 -0.416684
H -0.465390 -2.707473 -1.120361
H -0.995498 -0.365590 2.521666
H -1.151378 -2.152156 2.569080
H -2.436235 -1.164756 1.819856


