%chk=000128406.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128406

0 1
 O  -0.8662000      -1.304600      0.3726000    
 O   -3.531900      -1.915500      -1.511500    
 O   -4.164300      -2.292700      0.6329000    
 O    1.582500      0.9085000       2.016100    
 O    4.824000     -0.8892000     -0.4160000    
 O    2.747000      -1.647800      0.4110000    
 N   0.7441000      0.8492000     -0.1743000    
 N    3.493100     -0.6659000      8.6099997E-02
 C  -0.6623000       1.084400      0.1135000    
 C   -1.474900     -0.1749000     -0.2834000    
 C   -1.120900       2.420500     -0.5186000    
 C   -2.973000     -0.2303000      9.5399998E-02
 C   -1.113400       2.403000      -2.050500    
 C  -0.2708000       3.596700     -1.7500000E-02
 C   -3.250800      0.2014000       1.536300    
 C   -3.615700      -1.580200     -0.1975000    
 C    1.696800      0.7892000      0.8073000    
 C    3.054000      0.5527000      0.2486000    
 C    4.902800      -2.104600      -1.150500    
 H  -0.7360000       1.192500       1.202900    
 H   -1.367700     -0.3667000      -1.357700    
 H   -2.153800       2.607700     -0.1994000    
 H   -3.506300      0.4906000     -0.5397000    
 H    1.018400      0.7149000      -1.143300    
 H   -1.460300       3.364300      -2.445800    
 H  -0.1112000       2.222900      -2.451800    
 H   -1.784000       1.632800      -2.442800    
 H  -0.6893000       4.546800     -0.3674000    
 H   0.7619000       3.539100     -0.3769000    
 H  -0.2536000       3.626100       1.077100    
 H   -2.976800       1.246800       1.705400    
 H   -2.699500     -0.4196000       2.250500    
 H   -4.316500      0.1067000       1.774200    
 H   5.4600000E-02  -1.356400      6.4599998E-02
 H    3.672200       1.419700     -1.7700000E-02
 H   -3.953700      -2.781900      -1.695000    
 H    4.801900      -2.963300     -0.4803000    
 H    5.886000      -2.152600      -1.626300    
 H    4.137300      -2.134200      -1.932000    


%chk=000128406-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128406

0 1
O -1.371995 -1.404255 1.026995
O -3.681197 -1.736150 -1.386291
O -4.866178 -1.772535 0.607037
O 1.456113 1.141629 2.214830
O 4.906484 -0.723643 -0.404106
O 2.747861 -0.660453 -1.459303
N 0.693273 0.376657 0.123649
N 3.434253 -0.395495 -0.391434
C -0.694088 0.867012 0.285003
C -1.648669 -0.339106 0.051876
C -0.980449 2.104876 -0.624933
C -3.155366 -0.002770 0.218885
C -0.911834 1.787426 -2.139711
C -0.036283 3.275997 -0.265146
C -3.516307 0.549607 1.611350
C -3.987984 -1.243711 -0.102414
C 1.672575 0.594730 1.084745
C 3.052416 0.144271 0.767003
C 5.301220 -1.332803 -1.690851
H -0.772253 1.180436 1.342194
H -1.492917 -0.734626 -0.973551
H -2.014632 2.428569 -0.386254
H -3.412442 0.735890 -0.567466
H 0.994674 -0.002817 -0.783870
H -1.123814 2.699220 -2.727136
H 0.098132 1.441070 -2.433016
H -1.641103 1.016083 -2.447528
H -0.325307 4.189514 -0.816362
H 1.010422 3.039266 -0.531587
H -0.062725 3.498616 0.816684
H -3.064525 1.543844 1.774729
H -3.154745 -0.136139 2.393924
H -4.609609 0.645000 1.718598
H -0.389153 -1.534257 1.065066
H 3.820651 0.275778 1.527862
H -4.230867 -2.547238 -1.559200
H 4.775239 -2.286270 -1.863975
H 6.379663 -1.502547 -1.543752
H 5.125164 -0.644575 -2.533946


