%chk=000101475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101475

0 1
 O   -3.176800      -2.722200       0.000000    
 N    1.743700       1.534600      1.9999999E-04
 N  -0.5527000       1.120300      5.0000002E-04
 N    1.136900     -0.6034000     -3.0000001E-04
 N   -2.851200       1.238900      6.0000003E-04
 N   -1.798800     -0.8765000      6.0000003E-04
 C    2.915000      0.8218000       0.000000    
 C    2.509700     -0.5099000     -3.0000001E-04
 C   0.7144000      0.6380000       0.000000    
 C   -1.737500      0.4311000      7.9999998E-04
 C    4.253600       1.215500      9.9999997E-05
 C    3.484000      -1.522300     -5.0000002E-04
 C   -4.112100      0.6949000     -1.9999999E-04
 C    5.210000      0.1948000       0.000000    
 C    4.834200      -1.150400     -3.9999999E-04
 C   -4.259500     -0.6387000     -3.0000001E-04
 C   -5.276500       1.635200     -1.4000000E-03
 C   -3.036200      -1.501700      5.0000002E-04
 H    1.658700       2.542400      3.9999999E-04
 H  -0.6561000       2.133800      6.9999998E-04
 H    4.542800       2.260300      3.9999999E-04
 H    3.202200      -2.570400     -6.9999998E-04
 H   -2.773900       2.249900      1.9999999E-04
 H    6.265800      0.4544000      9.9999997E-05
 H    5.600500      -1.921400     -6.0000003E-04
 H   -5.227700      -1.125000     -1.1000000E-03
 H   -5.250700       2.275100      0.8868000    
 H   -6.233800       1.103400     -2.3000001E-03
 H   -5.249000       2.275000     -0.8897000    


%chk=000101475-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101475

0 1
O -3.198289 -2.809634 0.001038
N 1.792352 1.587668 0.000326
N -0.577705 1.140693 -0.000189
N 1.161161 -0.620518 -0.000495
N -2.921470 1.262929 -0.000730
N -1.843415 -0.888517 -0.000185
C 2.994654 0.851669 0.000239
C 2.575353 -0.523045 -0.000261
C 0.736208 0.643591 -0.000124
C -1.786215 0.419850 -0.000338
C 4.349195 1.233422 0.000540
C 3.541850 -1.552230 -0.000468
C -4.210059 0.693402 -0.000686
C 5.301295 0.187432 0.000323
C 4.903925 -1.180367 -0.000176
C -4.315411 -0.676318 -0.000493
C -5.364316 1.664396 -0.000732
C -3.118247 -1.547454 -0.000826
H 1.720866 2.603795 0.000608
H -0.652853 2.158668 -0.000078
H 4.664795 2.282409 0.000922
H 3.227305 -2.600017 -0.000846
H -2.838441 2.281618 -0.001011
H 6.368731 0.434683 0.000543
H 5.674915 -1.958677 -0.000325
H -5.294928 -1.160391 -0.000267
H -5.346587 2.316054 0.894352
H -6.319072 1.116380 -0.000709
H -5.346597 2.316007 -0.895853


