%chk=000160716.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160716

0 1
 O    1.765700      -2.304400      0.3170000    
 O   -4.837400      1.4600000E-02  0.8971000    
 O    4.084700      -1.252200     -0.3390000    
 O    4.342900      0.8556000      0.5098000    
 N   0.2471000       1.408700     -0.3465000    
 N   -2.005400      0.5262000     -0.3577000    
 C  -0.6651000      0.3266000     -0.2410000    
 C  -0.1566000     -0.9637000     -1.2200000E-02
 C  -0.3342000       2.724100     -0.5831000    
 C    1.603600       1.187900     -0.2249000    
 C    1.306200      -1.187200      0.1163000    
 C    2.185300      2.7000001E-03 -7.1999999E-03
 C   -1.032000      -2.046600      9.6000001E-02
 C   -2.828800     -0.5419000     -0.2484000    
 C   -2.397000      -1.834400     -2.4100000E-02
 C  -0.6327000       3.408300      0.7370000    
 C   -4.290200     -0.2719000     -0.3837000    
 C    3.643600     -5.2200001E-02  9.4700001E-02
 H   0.3754000       3.345100      -1.145600    
 H   -1.233700       2.681500      -1.209100    
 H    2.186000       2.098300     -0.3269000    
 H  -0.6675000      -3.054300      0.2731000    
 H   -3.090200      -2.664400      5.9099998E-02
 H   -1.363200       2.843500       1.325300    
 H   0.2732000       3.515000       1.343200    
 H   -1.041400       4.408400      0.5614000    
 H   -4.457800      0.5929000      -1.034800    
 H   -4.817500      -1.129000     -0.8161000    
 H   -5.784700      0.1924000      0.7688000    
 H    5.061400      -1.327100     -0.2857000    


%chk=000160716-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160716

0 1
O 1.727943 -2.463813 0.400789
O -5.152471 -1.215248 0.098810
O 4.254104 -1.309070 0.135518
O 4.350036 0.958830 -0.307984
N 0.236055 1.374440 -0.429319
N -1.995469 0.597529 -0.272606
C -0.666595 0.307921 -0.205319
C -0.146632 -0.991394 0.070026
C -0.278280 2.754196 -0.671331
C 1.583675 1.138206 -0.365755
C 1.322098 -1.285943 0.144219
C 2.170442 -0.101411 -0.102791
C -1.094235 -2.024267 0.278739
C -2.879013 -0.417518 -0.068743
C -2.470469 -1.747568 0.211465
C -0.559303 3.509210 0.641457
C -4.340729 -0.025726 -0.162849
C 3.654578 -0.078022 -0.105027
H 0.477243 3.282827 -1.278363
H -1.205008 2.659455 -1.258382
H 2.240601 1.996472 -0.540972
H -0.707827 -3.026689 0.490461
H -3.234292 -2.511104 0.365955
H -1.336839 2.990515 1.226676
H 0.351657 3.596714 1.259617
H -0.920521 4.528541 0.415098
H -4.539665 0.779567 0.575917
H -4.531774 0.387842 -1.176060
H -6.111656 -0.986540 0.033926
H 5.242045 -1.175454 0.109628


