%chk=000084728.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084728

0 1
 O   0.1350000       2.342700      0.3365000    
 O  -0.9475000      -3.451600     -0.3227000    
 N  -0.3891000       1.063000      0.1903000    
 C   0.3489000     -8.3200000E-02  6.3100003E-02
 C   -1.847300     -0.6143000     -4.6999999E-03
 C   -1.733500      0.7687000      0.1523000    
 C  -0.5255000      -1.138400     -5.9300002E-02
 C    1.796300     -7.5400002E-02  6.9300003E-02
 C   -3.133400      -1.185400     -7.4199997E-02
 C   -2.846200       1.612500      0.2439000    
 C   -4.255600     -0.3538000      1.6400000E-02
 C   -4.111800       1.023400      0.1730000    
 C    2.493400      6.4000003E-02  -1.128100    
 C    2.484700     -0.2070000       1.272600    
 C  -0.1380000      -2.514100     -0.2139000    
 C    3.888300      7.1999997E-02  -1.122000    
 C    3.879500     -0.1991000       1.278600    
 C    4.581300     -5.9599999E-02  8.1299998E-02
 C   0.3206000       2.935700     -0.9524000    
 H   -3.271900      -2.255500     -0.1960000    
 H   -2.738400       2.685000      0.3667000    
 H   -5.250200     -0.7887000     -3.6200002E-02
 H   -4.997000       1.650600      0.2412000    
 H    1.968800      0.1593000      -2.075600    
 H    1.951800     -0.3164000       2.214000    
 H   0.9429000      -2.731300     -0.2350000    
 H    4.434800      0.1788000      -2.054500    
 H    4.419100     -0.3016000       2.215500    
 H    5.667400     -5.3800002E-02  8.5900001E-02
 H    1.049800       2.385900      -1.550200    
 H  -0.6305000       3.007100      -1.489800    
 H   0.7017000       3.949500     -0.8002000    


%chk=000084728-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084728

0 1
O 0.096111 2.286888 0.698377
O -1.028636 -3.436728 -0.949385
N -0.416704 0.997559 0.367508
C 0.359142 -0.113589 0.012917
C -1.903191 -0.628983 -0.180933
C -1.792944 0.732871 0.253109
C -0.550185 -1.157086 -0.321011
C 1.831915 -0.086006 0.015068
C -3.193912 -1.188913 -0.359668
C -2.904776 1.558794 0.507446
C -4.317515 -0.372715 -0.115168
C -4.176880 0.981187 0.310867
C 2.560465 -0.726057 -1.028192
C 2.553490 0.565426 1.056467
C -0.193000 -2.537589 -0.620444
C 3.971103 -0.727438 -1.020975
C 3.963566 0.562434 1.056564
C 4.678798 -0.085352 0.021604
C 0.324363 3.088250 -0.545657
H -3.292083 -2.229003 -0.680879
H -2.785045 2.588344 0.857525
H -5.323378 -0.784937 -0.251095
H -5.074049 1.581628 0.497710
H 2.018219 -1.191812 -1.857598
H 2.005278 1.058086 1.864666
H 0.889435 -2.790507 -0.518136
H 4.516229 -1.222496 -1.831881
H 4.505066 1.059800 1.868643
H 5.774269 -0.086890 0.026115
H 1.108458 2.617513 -1.163622
H -0.616928 3.189971 -1.113486
H 0.661719 4.066351 -0.170656


