%chk=000024089.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024089

0 1
 O   0.3128000      -1.026900     -0.3988000    
 O    1.523900      -1.297000       1.616800    
 N   -3.057200      0.4284000     -0.1325000    
 C   -4.283100      0.2417000     -0.9125000    
 C   -3.309300      0.1406000       1.281600    
 C   -1.986800     -0.4132000     -0.6463000    
 C    1.600800     -0.9076000      0.2417000    
 C  -0.6985000     -0.1736000      0.1245000    
 C    2.530400      -1.904500     -0.4986000    
 C   -4.738000      -1.213400     -0.8429000    
 C   -4.037000      0.6705000      -2.355500    
 C   -3.715900      -1.319500       1.460000    
 C   -4.391800       1.078800       1.805700    
 C    2.124300      0.5217000      9.7300000E-02
 C    3.948700      -2.002700      7.6300003E-02
 C    2.247900       1.054900      -1.165900    
 C    2.452000       1.222900       1.235700    
 C    4.756500      -3.081700     -0.6297000    
 C    2.725200       2.358900      -1.297700    
 C    2.929200       2.527000       1.103800    
 C    3.065800       3.094900     -0.1630000    
 H   -5.089000      0.8973000     -0.5680000    
 H   -2.430900      0.3690000       1.891800    
 H   -1.745500     -0.1342000      -1.679300    
 H   -2.153400      -1.490500     -0.6952000    
 H  -0.4134000      0.8801000      3.7099998E-02
 H  -0.7944000     -0.4310000       1.180900    
 H    2.577200      -1.679000      -1.571400    
 H    2.070800      -2.901700     -0.4399000    
 H   -5.319900      -1.388600      -1.764300    
 H   -4.009300      -2.018500     -0.9188000    
 H   -5.521400      -1.391200     -0.1050000    
 H   -3.542900       1.647400      -2.407300    
 H   -4.994800      0.7721000      -2.880400    
 H   -3.448300     -5.3399999E-02  -2.928700    
 H   -3.380600      -1.561200       2.484300    
 H   -4.785500      -1.505000       1.576100    
 H   -3.186500      -2.093900      0.9060000    
 H   -4.194700       2.120000       1.525800    
 H   -4.403800       1.043100       2.902100    
 H   -5.404200      0.8122000       1.486200    
 H    3.912200      -2.235200       1.146200    
 H    4.469800      -1.045300     -3.1399999E-02
 H    1.551400      -2.267300       1.662500    
 H    1.975700      0.5004000      -2.058100    
 H    2.358400      0.8123000       2.235200    
 H    4.288400      -4.064100     -0.5107000    
 H    4.843600      -2.868900      -1.700000    
 H    5.766300      -3.134000     -0.2105000    
 H    2.828800       2.802300      -2.283700    
 H    3.194400       3.100700       1.987000    
 H    3.436600       4.110500     -0.2655000    


%chk=000024089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000024089

0 1
O 0.397885 -1.123168 -0.460501
O 1.596115 -1.124158 1.620473
N -3.181173 -0.140643 0.084211
C -4.241748 0.064846 -0.936515
C -3.568714 -0.209330 1.519209
C -2.019570 -0.966933 -0.293107
C 1.703854 -0.883910 0.176225
C -0.698230 -0.221744 -0.026836
C 2.633362 -1.925388 -0.490304
C -4.817863 -1.239062 -1.568713
C -3.747448 1.024874 -2.047660
C -4.538104 -1.374679 1.878282
C -4.121358 1.142198 2.030693
C 2.179024 0.559297 -0.003702
C 4.074200 -1.938039 0.061853
C 2.121696 1.137232 -1.297043
C 2.694932 1.317508 1.073092
C 4.922568 -3.062827 -0.569150
C 2.582188 2.453845 -1.512136
C 3.153271 2.637772 0.858061
C 3.101888 3.209089 -0.433861
H -5.075530 0.571850 -0.413029
H -2.621335 -0.395327 2.065077
H -2.062361 -1.211529 -1.369735
H -1.994477 -1.941618 0.245740
H -0.668910 0.719623 -0.606525
H -0.579989 0.015726 1.047800
H 2.648391 -1.727286 -1.578188
H 2.163145 -2.922169 -0.357970
H -5.664752 -0.996896 -2.238300
H -4.055724 -1.761449 -2.176806
H -5.178393 -1.939008 -0.795728
H -3.425022 1.984131 -1.607244
H -4.545995 1.220315 -2.788423
H -2.886042 0.590731 -2.589636
H -4.658351 -1.455971 2.975214
H -5.540707 -1.207645 1.442776
H -4.152925 -2.341267 1.503854
H -3.408902 1.954375 1.805111
H -4.286468 1.104151 3.123673
H -5.090434 1.392197 1.559520
H 4.044952 -2.058888 1.162252
H 4.553156 -0.959032 -0.131494
H 1.319466 -2.069032 1.738571
H 1.703372 0.555620 -2.127000
H 2.726349 0.866232 2.068365
H 4.485981 -4.058588 -0.362105
H 4.984776 -2.947163 -1.667869
H 5.953681 -3.057330 -0.170998
H 2.532184 2.892426 -2.515270
H 3.550121 3.218700 1.698485
H 3.458970 4.231937 -0.599689


