%chk=000026242.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026242

0 1
 O   -2.014400       1.281200      0.8031000    
 O   -2.097300      -2.812100      0.7935000    
 O   -1.624700      -1.074500       2.180600    
 N   -6.224900      -1.444300      -1.621600    
 C    3.126700      0.4795000     -0.1708000    
 C    4.621100      0.6536000      0.1145000    
 C    2.278400       1.670700      0.2800000    
 C    5.478200     -0.5039000     -0.4027000    
 C   0.7928000       1.430500     -1.0000000E-03
 C    6.966200     -0.2440000     -0.1561000    
 C  -5.4499999E-02   2.634100      0.4222000    
 C    7.827900      -1.380500     -0.7057000    
 C   -1.534500       2.431300      0.1216000    
 C    9.308700      -1.109800     -0.4924000    
 C   -3.045600      0.5970000      0.2130000    
 C   -3.187000     -0.7789000      0.3929000    
 C   -3.960000       1.295000     -0.5760000    
 C   -4.242900      -1.457000     -0.2162000    
 C   -5.015700      0.6168000      -1.185100    
 C   -5.157200     -0.7592000      -1.005300    
 C   -2.241400      -1.525500       1.211300    
 H    2.772800     -0.4304000      0.3295000    
 H    2.983000      0.3245000      -1.247500    
 H    4.962600       1.588100     -0.3482000    
 H    4.771100      0.7630000       1.195700    
 H    2.612800       2.575200     -0.2420000    
 H    2.427300       1.841700       1.353000    
 H    5.175900      -1.434500      9.2200004E-02
 H    5.302200     -0.6361000      -1.477100    
 H   0.4649000      0.5319000      0.5347000    
 H   0.6475000       1.240200      -1.071300    
 H    7.257800      0.6994000     -0.6339000    
 H    7.147000     -0.1308000      0.9197000    
 H   0.2976000       3.539400     -8.5800000E-02
 H   7.3299997E-02   2.789300       1.500600    
 H    7.638000      -1.507600      -1.777900    
 H    7.558500      -2.322700     -0.2144000    
 H   -1.637200       2.337100     -0.9675000    
 H   -2.095900       3.309400      0.4607000    
 H    9.539200      -1.007300      0.5728000    
 H    9.617000     -0.1907000      -1.001000    
 H    9.906300      -1.935500     -0.8915000    
 H   -3.907600       2.370200     -0.7184000    
 H   -4.376400      -2.527500     -7.7000000E-02
 H   -5.725900       1.172500      -1.792300    
 H   -6.329100      -2.441800      -1.491500    
 H   -6.888200     -0.9383000      -2.193100    
 H   -1.459400      -3.307500       1.350300    


%chk=000026242-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026242

0 1
O -1.872700 0.854972 0.252030
O -3.145879 -3.096460 1.219628
O -1.299236 -1.713418 1.040957
N -7.053591 -1.064176 -0.995721
C 3.396418 0.521141 -0.386551
C 4.853979 0.716761 0.087561
C 2.414284 1.556893 0.205277
C 5.834090 -0.323431 -0.500417
C 0.961167 1.357162 -0.278063
C 7.294412 -0.123488 -0.036594
C -0.015636 2.387876 0.329109
C 8.272663 -1.166924 -0.623074
C -1.458820 2.213732 -0.151292
C 9.730175 -0.957439 -0.158436
C -3.147814 0.413122 -0.096980
C -3.501375 -0.938571 0.224043
C -4.113381 1.237331 -0.730472
C -4.807352 -1.405730 -0.077577
C -5.398796 0.753038 -1.031203
C -5.773224 -0.580732 -0.704432
C -2.527327 -1.872501 0.842999
H 3.054409 -0.498999 -0.115335
H 3.361735 0.575380 -1.495161
H 5.195348 1.737335 -0.186870
H 4.888508 0.666076 1.196206
H 2.758935 2.580159 -0.057376
H 2.442712 1.493168 1.313411
H 5.496504 -1.343069 -0.219192
H 5.792824 -0.278784 -1.609249
H 0.610150 0.342088 -0.013878
H 0.929972 1.428961 -1.386293
H 7.634071 0.895002 -0.320438
H 7.337330 -0.166101 1.072200
H 0.306071 3.418768 0.072366
H 0.001865 2.308203 1.433484
H 8.226616 -1.126013 -1.730727
H 7.934227 -2.183731 -0.336483
H -1.528891 2.306005 -1.256231
H -2.130758 2.963298 0.317120
H 9.808111 -1.024240 0.943420
H 10.102252 0.040338 -0.459508
H 10.408263 -1.715863 -0.591677
H -3.867554 2.270233 -0.990815
H -5.050931 -2.438994 0.185145
H -6.121505 1.416392 -1.522323
H -7.315577 -2.015168 -0.756267
H -7.745378 -0.472273 -1.444154
H -2.436365 -3.676128 1.606433


