%chk=000145889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145889

0 1
 O   -1.782200       2.311400      0.3627000    
 O   -1.832400      -2.264600      0.4810000    
 O    4.729600     -1.8600000E-02 -0.1230000    
 N   -1.758600       1.163500      -1.620600    
 N   -1.801200      -1.214200      -1.556700    
 C  -0.9280000      1.2300000E-02  0.3986000    
 C   -1.247500      4.8500001E-02   1.909200    
 C   0.6090000      3.8000001E-03  0.2571000    
 C   -1.537800       1.278500     -0.2598000    
 C   -1.572800      -1.268100     -0.1929000    
 C   -1.452100     -5.0999999E-02  -2.331300    
 C   -2.741700      2.6200000E-02   2.152700    
 C    1.298700       1.207800      0.2065000    
 C    1.283100      -1.208000      0.1820000    
 C    2.687500       1.200000      7.8400001E-02
 C    2.672100      -1.215800      5.4000001E-02
 C    3.374400     -1.1700000E-02  2.2000000E-03
 H  -0.7918000     -0.8047000       2.429000    
 H  -0.8267000      0.9493000       2.375800    
 H   -2.023400     -6.5800004E-02  -3.263100    
 H  -0.3819000     -7.5999998E-02  -2.555700    
 H   -2.112400       1.965400      -2.132900    
 H   -2.179300      -2.030900      -2.026400    
 H   -3.276100      0.8480000       1.669900    
 H   -3.222600     -0.9077000       1.853600    
 H   -2.925400      0.1288000       3.228900    
 H   0.8020000       2.169100      0.2811000    
 H   0.7740000      -2.164200      0.2349000    
 H    3.223700       2.144700      4.3000001E-02
 H    3.202200      -2.162800     -1.5000000E-03
 H    5.049000      0.8999000     -0.1427000    


%chk=000145889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145889

0 1
O -1.812829 2.356492 0.323063
O -1.827385 -2.336224 0.439564
O 4.788007 -0.062321 -0.104039
N -1.768303 1.153908 -1.654111
N -1.772420 -1.234932 -1.595075
C -0.991176 0.007932 0.408758
C -1.300254 0.046287 1.937245
C 0.552778 0.005811 0.203296
C -1.567482 1.276368 -0.287723
C -1.572026 -1.290620 -0.224131
C -1.407014 -0.060243 -2.391632
C -2.799247 0.058369 2.303136
C 1.275477 1.225402 0.178557
C 1.281279 -1.212384 0.141471
C 2.682588 1.233993 0.074644
C 2.685639 -1.216241 0.036759
C 3.387914 0.009392 0.001802
H -0.813011 -0.836523 2.388969
H -0.809775 0.948788 2.344340
H -1.955142 -0.082853 -3.348297
H -0.317935 -0.067592 -2.611165
H -2.125915 1.972868 -2.149806
H -2.133011 -2.076159 -2.049665
H -3.303509 0.949028 1.890703
H -3.304920 -0.852560 1.940135
H -2.913384 0.088834 3.402181
H 0.739432 2.178007 0.253148
H 0.749901 -2.169108 0.191170
H 3.223475 2.189339 0.058310
H 3.250502 -2.151944 -0.008792
H 5.189145 0.841987 -0.098816


