%chk=000000846.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000846

0 1
 O  -0.5058000     -0.8919000      -1.448800    
 O   -3.281200      -1.590900      9.8700002E-02
 O   -2.546100     -0.3014000       1.812300    
 N   -3.525900       1.730400     -0.1146000    
 N    1.426500      -2.250300     -0.2149000    
 C   -1.172900       1.166200     -0.4350000    
 C   -2.607900      0.6367000     -0.4418000    
 C  -0.1660000      8.1000000E-02 -0.7766000    
 C    1.242100      0.1833000     -0.2922000    
 C    1.968600     -0.9580000     -3.5599999E-02
 C    1.762800       1.447800     -0.1196000    
 C   -2.788700     -0.4366000      0.6199000    
 C    3.282200     -0.8296000      0.4160000    
 C    3.076300       1.576000      0.3321000    
 C    3.835900      0.4374000      0.6000000    
 H  -0.9314000       1.569600      0.5564000    
 H   -1.064300       1.968300      -1.174700    
 H   -2.866100      0.2328000      -1.427000    
 H    1.199800       2.350100     -0.3351000    
 H   -3.311900       2.105100      0.8088000    
 H   -4.481800       1.379300     -7.3299997E-02
 H    3.885700      -1.708500      0.6284000    
 H    3.509000       2.562300      0.4719000    
 H    4.858900      0.5373000      0.9509000    
 H   0.4698000      -2.374900     -0.5146000    
 H    1.992900      -3.063300     -1.0500000E-02
 H   -3.404500      -2.279000      0.7868000    


%chk=000000846-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000846

0 1
O -0.653160 -1.335490 -0.503845
O -4.094348 -1.249632 0.139197
O -2.814946 -0.370621 1.868995
N -3.478288 1.778165 -0.489670
N 1.788849 -2.306158 -0.417969
C -1.160683 1.004367 -0.137732
C -2.609579 0.581268 -0.426069
C -0.179378 -0.165721 -0.245460
C 1.260348 0.069776 -0.055277
C 2.209439 -1.024029 -0.146989
C 1.757808 1.379124 0.229412
C -3.115222 -0.388389 0.653037
C 3.601413 -0.747426 0.050061
C 3.122257 1.631776 0.419253
C 4.044940 0.550893 0.326515
H -1.097757 1.437854 0.880795
H -0.895138 1.804370 -0.852964
H -2.661844 0.058587 -1.393953
H 1.049768 2.210576 0.303205
H -3.512960 2.311680 0.386449
H -4.412620 1.589453 -0.866672
H 4.319289 -1.573886 -0.018781
H 3.476438 2.643895 0.636812
H 5.115596 0.734487 0.473251
H 0.775437 -2.449266 -0.544955
H 2.459909 -3.068918 -0.471755
H -4.439570 -1.827534 0.873008


