%chk=000050578.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050578

0 1
 O   0.6803000      2.4900001E-02 -2.5200000E-02
 O    4.154900      0.3975000      3.8000001E-03
 O    2.524700       1.872900     -5.1899999E-02
 N    2.919200      0.6706000     -1.6500000E-02
 N   -4.812800     -0.1767000     -2.0600000E-02
 N   -1.184500       2.410800      6.7900002E-02
 C  -6.5300003E-02  -1.111100     -5.1000002E-03
 C    1.982000     -0.3641000     -7.9999998E-04
 C   0.7461000      -2.221100      3.2099999E-02
 C    2.075700      -1.736000      3.4800000E-02
 C   -1.478900      -1.082800     -2.1299999E-02
 C   -2.233000      4.4799998E-02 -1.2000000E-02
 C   -3.656300     -7.8699999E-02 -1.6500000E-02
 C   -1.652000       1.349100      3.1300001E-02
 H   0.4293000      -3.254600      5.4800000E-02
 H    2.985000      -2.319800      5.9799999E-02
 H   -1.984500      -2.047600     -3.9900001E-02


%chk=000050578-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050578

0 1
O 0.704992 0.057044 0.002102
O 4.281299 0.201956 0.014218
O 2.715381 1.890449 0.001330
N 3.063478 0.651287 0.002292
N -4.926167 -0.227753 -0.002534
N -1.484320 2.570949 -0.012769
C -0.067221 -1.128328 0.006474
C 2.033522 -0.360789 0.005958
C 0.795164 -2.241002 0.012962
C 2.136313 -1.749866 0.012811
C -1.496608 -1.057722 0.004162
C -2.306666 0.069243 -0.002593
C -3.737640 -0.091827 -0.003572
C -1.829939 1.426087 -0.008602
H 0.481671 -3.283309 0.017176
H 3.063840 -2.315611 0.016948
H -1.997199 -2.032709 0.008337


