%chk=000148764.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148764

0 1
 O    3.863500       2.050600     -6.9999998E-04
 O    2.062700       3.306100     -3.0000001E-04
 N    2.624600       2.192700       0.000000    
 N   -4.946400      -1.889100     -1.9999999E-04
 C  -0.4066000      7.7000000E-03   0.000000    
 C   -1.820500      0.1730000     -9.9999997E-05
 C   0.1786000      -1.286600     -9.9999997E-05
 C   0.4131000       1.157100      3.0000001E-04
 C    1.611100      -1.416400     -9.9999997E-05
 C   -2.667600     -0.9561000       0.000000    
 C   -2.393000       1.468400     -9.9999997E-05
 C    2.409700     -0.2458000      3.0000001E-04
 C    1.803400       1.014600      5.0000002E-04
 C  -0.7088000      -2.387100       0.000000    
 C  -0.1695000       2.431800      1.9999999E-04
 C   -2.097100      -2.228500      9.9999997E-05
 C   -1.554300       2.586500     -9.9999997E-05
 C   -4.059900     -0.7843000      1.9999999E-04
 C   -3.788200       1.612300       0.000000    
 C    2.300300      -2.656000     -3.9999999E-04
 C   -4.615700      0.4925000       0.000000    
 C    3.812700     -0.3373000      6.0000003E-04
 C    3.695600      -2.733300     -3.9999999E-04
 C    4.452400      -1.572700      3.0000001E-04
 H  -0.3372000      -3.408700      9.9999997E-05
 H   0.2220000       3.431100      1.1000000E-03
 H   -2.687400      -3.139600      1.9999999E-04
 H   -1.977300       3.589800     -9.9999997E-05
 H   -4.243700       2.600400     -9.9999997E-05
 H    1.760600      -3.599500     -7.9999998E-04
 H   -5.694000      0.6317000     -9.9999997E-05
 H    4.613000      0.3770000      2.4999999E-03
 H    4.184500      -3.703100     -6.0000003E-04
 H    5.537200      -1.635300      7.9999998E-04
 H   -5.944200      -1.718700      6.0000003E-04
 H   -4.620800      -2.843300      1.5000000E-03


%chk=000148764-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148764

0 1
O 3.665550 2.316710 -0.903013
O 2.451378 3.233923 0.791398
N 2.695901 2.268100 -0.041470
N -4.976057 -1.929817 -0.022611
C -0.406479 0.046753 0.010804
C -1.846693 0.183045 -0.000894
C 0.193526 -1.258012 0.003384
C 0.431971 1.242334 0.025694
C 1.642145 -1.401774 0.006996
C -2.690097 -0.986930 -0.010790
C -2.443478 1.492828 -0.005504
C 2.482356 -0.222545 -0.023168
C 1.841943 1.069177 -0.010865
C -0.676484 -2.402019 -0.010692
C -0.212671 2.538872 0.020862
C -2.058029 -2.273201 -0.016222
C -1.589316 2.649498 -0.002164
C -4.127083 -0.831071 -0.019039
C -3.859051 1.608461 -0.016741
C 2.272689 -2.687357 0.052451
C -4.685898 0.476771 -0.022900
C 3.909665 -0.390849 -0.006813
C 3.661617 -2.823685 0.068124
C 4.484919 -1.660243 0.042544
H -0.250204 -3.407280 -0.023854
H 0.400680 3.439816 0.051926
H -2.657485 -3.190911 -0.030904
H -2.054623 3.641983 -0.009609
H -4.309510 2.607632 -0.019808
H 1.660791 -3.592356 0.084606
H -5.776078 0.593132 -0.030248
H 4.555443 0.487589 -0.046781
H 4.117450 -3.818688 0.104753
H 5.575206 -1.761260 0.057005
H -5.983252 -1.793965 -0.027459
H -4.627943 -2.882758 -0.013900


