%chk=000025762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025762

0 1
 O   -5.143100     -0.4847000     -3.9999999E-04
 O   -4.445400       1.596700      1.9999999E-04
 N   -4.218800      0.3630000     -3.0000001E-04
 C    1.743600      7.6099999E-02  9.9999997E-05
 C   0.7512000       1.046400      1.9999999E-04
 C    1.178800      -1.191800      9.9999997E-05
 C  -0.5363000      0.3657000      3.9999999E-04
 C  -0.2690000      -1.033800      3.9999999E-04
 C    3.112000      0.3376000     -9.9999997E-05
 C    1.113900       2.380400      9.9999997E-05
 C    2.007900      -2.298000      9.9999997E-05
 C   -1.831900      0.8459000      9.9999997E-05
 C   -1.296300      -1.957900       0.000000    
 C    3.476900       1.698000     -1.9999999E-04
 C    3.952800     -0.7926000     -1.9999999E-04
 C   -2.871400     -8.8699996E-02 -9.9999997E-05
 C    2.483200       2.700900     -1.9999999E-04
 C    3.398900      -2.091100     -9.9999997E-05
 C   -2.607200      -1.472200     -9.9999997E-05
 H   0.3703000       3.170400      9.9999997E-05
 H    1.607900      -3.306500      1.9999999E-04
 H   -2.009700       1.916500      9.9999997E-05
 H   -1.104100      -3.025000     -1.9999999E-04
 H    4.525000       1.986200     -3.9999999E-04
 H    5.033400     -0.6740000     -3.9999999E-04
 H    2.785000       3.745800     -1.9999999E-04
 H    4.064600      -2.951100     -1.9999999E-04
 H   -3.412100      -2.204200     -3.9999999E-04


%chk=000025762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025762

0 1
O -5.259480 -0.516879 0.000624
O -4.519787 1.640695 0.000727
N -4.312378 0.363460 -0.000281
C 1.756740 0.077964 -0.000087
C 0.744291 1.088845 -0.000129
C 1.186525 -1.235943 -0.000092
C -0.552613 0.372173 -0.000160
C -0.280149 -1.051193 -0.000140
C 3.149451 0.342961 -0.000035
C 1.141512 2.430023 -0.000122
C 2.049407 -2.338850 -0.000047
C -1.871393 0.846218 -0.000201
C -1.340177 -1.979546 -0.000162
C 3.533353 1.728491 -0.000031
C 4.013572 -0.805477 0.000009
C -2.912801 -0.114524 -0.000236
C 2.547509 2.730057 -0.000076
C 3.465565 -2.100893 0.000002
C -2.671167 -1.509657 -0.000201
H 0.415814 3.250392 -0.000149
H 1.675938 -3.368546 -0.000047
H -2.123871 1.909298 -0.000215
H -1.144937 -3.056431 -0.000142
H 4.594291 2.003904 0.000004
H 5.101651 -0.672484 0.000047
H 2.856178 3.781234 -0.000071
H 4.140561 -2.963832 0.000034
H -3.523504 -2.193459 -0.000223


