%chk=000171345.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171345

0 1
 O   -3.991700      0.8739000      -1.041700    
 N   -3.505700      0.2617000     -2.7400000E-02
 N   -3.982400     -0.7815000      0.5342000    
 C    1.431000     -0.1022000     -0.2040000    
 C    2.769800      0.3973000      0.3436000    
 C   0.2190000      0.5923000      0.4238000    
 C    3.943500     -0.3378000     -0.3082000    
 C   -1.120300      7.6399997E-02 -0.1051000    
 C    5.281100      0.1362000      0.2600000    
 C   -2.282200      0.7758000      0.5812000    
 C    6.447600     -0.6157000     -0.3608000    
 C   -5.209600      -1.276300     -9.5600002E-02
 H    1.405400      4.7300000E-02  -1.290600    
 H    1.351300      -1.182800     -3.1399999E-02
 H    2.861700       1.474900      0.1621000    
 H    2.798000      0.2479000       1.429700    
 H   0.2899000       1.671600      0.2400000    
 H   0.2541000      0.4536000       1.511700    
 H    3.924700     -0.1740000      -1.392500    
 H    3.837300      -1.417000     -0.1425000    
 H   -1.168300      0.2359000      -1.189700    
 H   -1.183900      -1.007200      5.5399999E-02
 H    5.404200       1.209700      7.5499997E-02
 H    5.297800     -1.0600000E-02   1.346200    
 H   -2.252300       1.859600      0.4253000    
 H   -2.302800      0.5805000       1.658900    
 H    7.394000     -0.2601000      5.8600001E-02
 H    6.371300      -1.689900     -0.1643000    
 H    6.478700     -0.4657000      -1.444700    
 H   -6.011500     -0.5321000     -4.6799999E-02
 H   -5.549400      -2.166200      0.4430000    
 H   -5.034900      -1.565300      -1.137400    


%chk=000171345-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000171345

0 1
O -3.723944 0.346833 -1.362432
N -3.577573 0.086564 -0.078203
N -4.443146 -0.526400 0.701542
C 1.494666 -0.213994 -0.194553
C 2.828383 0.329014 0.365834
C 0.252188 0.420457 0.470468
C 4.071623 -0.305603 -0.297296
C -1.072644 -0.114624 -0.117305
C 5.406829 0.239759 0.259131
C -2.291453 0.524687 0.572643
C 6.643578 -0.398514 -0.409614
C -5.672066 -0.923018 -0.027908
H 1.455908 -0.033224 -1.288815
H 1.461173 -1.315142 -0.059643
H 2.862544 1.430217 0.228340
H 2.866496 0.151107 1.461119
H 0.293772 1.522557 0.343890
H 0.284435 0.228503 1.563152
H 4.034024 -0.129795 -1.392886
H 4.041024 -1.406758 -0.158615
H -1.124563 0.102783 -1.200077
H -1.118363 -1.215057 0.000738
H 5.436325 1.339945 0.120586
H 5.443993 0.063503 1.353685
H -2.254173 1.624771 0.475353
H -2.365637 0.247444 1.635468
H 7.584598 0.007238 0.005382
H 6.653126 -1.494855 -0.260143
H 6.645781 -0.209771 -1.499907
H -6.183440 -0.042727 -0.466052
H -6.328664 -1.425579 0.696590
H -5.439399 -1.600121 -0.873971


