%chk=000075874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075874

0 1
 O    4.070200     -0.6313000      0.7697000    
 O   -2.591800      -3.181500      0.7486000    
 O   -1.485900       3.845000      0.7197000    
 N   1.5400000E-02  4.1000000E-03 -0.3349000    
 N    4.713400       1.220200     -0.4323000    
 N   -1.294600      -4.674300     -0.4242000    
 N   -3.447300       3.412300     -0.3995000    
 C    1.350700     -0.3414000      0.1366000    
 C  -0.9657000     -0.9789000      0.1287000    
 C  -0.3595000       1.346000      0.1151000    
 C    2.375900      0.6515000     -0.4008000    
 C  -0.6133000      -2.367100     -0.3951000    
 C   -1.757000       1.700400     -0.3817000    
 C    3.785400      0.3235000      5.2600000E-02
 C   -1.611800      -3.418900      4.8599999E-02
 C   -2.184200       3.090400      4.8799999E-02
 H    1.677300      -1.315600     -0.2373000    
 H    1.395600     -0.3806000       1.233100    
 H   -1.963800     -0.7799000     -0.2702000    
 H   -1.041700     -0.9891000       1.224100    
 H   0.3003000       2.110800     -0.3044000    
 H  -0.3123000       1.431900       1.208800    
 H    2.360300      0.6706000      -1.497400    
 H    2.201200       1.667800     -3.3799998E-02
 H  -0.5706000      -2.369600      -1.491200    
 H   0.3460000      -2.726100     -9.6000005E-03
 H   -1.809000       1.643200      -1.475700    
 H   -2.527400       1.047500      4.0500000E-02
 H    5.698300       1.123600     -0.2090000    
 H    4.454600       2.002400      -1.025100    
 H   -1.876200      -5.476300     -0.2056000    
 H  -0.4789000      -4.846500      -1.003200    
 H   -3.862700       4.313000     -0.1860000    
 H   -4.006200       2.772100     -0.9545000    


%chk=000075874-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075874

0 1
O 4.169260 -0.960404 -0.123265
O -2.911257 -3.150940 -0.047534
O -1.251202 4.088752 -0.117705
N -0.001484 -0.003775 -0.024590
N 4.771678 1.265181 -0.360627
N -1.282922 -4.773029 -0.349140
N -3.481151 3.500132 -0.349279
C 1.419524 -0.148484 0.384533
C -0.834188 -1.160264 0.395972
C -0.584634 1.298271 0.390287
C 2.373344 0.683142 -0.499311
C -0.607778 -2.400377 -0.494786
C -1.780541 1.712349 -0.493255
C 3.831524 0.248585 -0.302649
C -1.699917 -3.453743 -0.268414
C -2.130826 3.192876 -0.295230
H 1.721225 -1.203808 0.274326
H 1.573269 0.117634 1.459735
H -1.900307 -0.891809 0.305232
H -0.663654 -1.429433 1.467703
H 0.178796 2.087356 0.283300
H -0.892049 1.294780 1.465439
H 2.099172 0.494067 -1.555595
H 2.257061 1.768225 -0.321753
H -0.664012 -2.068342 -1.549895
H 0.397468 -2.835517 -0.343950
H -1.478294 1.568818 -1.549002
H -2.663883 1.071167 -0.317090
H 5.758999 1.022952 -0.275895
H 4.506490 2.240109 -0.488034
H -1.977926 -5.512655 -0.246463
H -0.309111 -5.022524 -0.511917
H -3.764280 4.476337 -0.262494
H -4.193694 2.783570 -0.475250


