%chk=000055431.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055431

0 1
 O  -0.5250000       2.035200     -1.9999999E-04
 O    4.117300      0.7239000     -5.0000002E-04
 O   -2.717400       2.673200      9.9999997E-05
 N   -4.095000      -1.248900     -8.9999998E-04
 C   0.1114000     -0.3277000      6.0000003E-04
 C   -1.316000     -0.6756000      6.0000003E-04
 C   0.4706000       1.026400      9.9999997E-05
 C    2.501900     -0.8539000      9.9999997E-05
 C    1.155500      -1.276900      5.0000002E-04
 C    2.772000      0.5084000     -9.9999997E-05
 C   -2.273200      0.3466000      1.9999999E-04
 C    1.792400       1.493100     -9.9999997E-05
 C   -1.794200      -1.994100      5.0000002E-04
 C   -1.888000       1.773100      3.9999999E-04
 C    3.767500      -1.498200     -9.9999997E-05
 C   -3.627100      1.6100001E-02 -6.9999998E-04
 C    4.711700     -0.4978000     -3.0000001E-04
 C   -3.164500      -2.222900     -3.0000001E-04
 H   0.9570000      -2.343900      6.9999998E-04
 H    2.036400       2.548400     -3.9999999E-04
 H   -1.132200      -2.853200      7.9999998E-04
 H    3.966100      -2.560600       0.000000    
 H   -4.403200      0.7753000     -1.1000000E-03
 H    5.791800     -0.4909000     -5.0000002E-04
 H   -3.555400      -3.235300     -5.0000002E-04


%chk=000055431-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055431

0 1
O -0.523793 2.072658 -0.000460
O 4.165130 0.764372 0.000235
O -2.710810 2.748777 0.000971
N -4.133105 -1.267200 0.000382
C 0.117983 -0.333607 -0.000483
C -1.307447 -0.688222 -0.000459
C 0.459460 1.062005 -0.000286
C 2.503694 -0.862647 -0.000083
C 1.163347 -1.293589 -0.000306
C 2.775773 0.543686 0.000032
C -2.290614 0.350411 -0.000607
C 1.787598 1.530380 -0.000021
C -1.795878 -2.024440 -0.000080
C -1.924378 1.782517 -0.001491
C 3.802355 -1.523796 0.000120
C -3.671322 0.010598 -0.000056
C 4.755039 -0.530372 0.000278
C -3.182176 -2.259762 0.000338
H 0.930054 -2.362076 -0.000326
H 2.000758 2.600868 0.000091
H -1.112704 -2.878068 0.000030
H 3.997412 -2.594186 0.000126
H -4.416801 0.812614 -0.000249
H 5.841804 -0.536888 0.000445
H -3.570979 -3.284232 0.000758


