%chk=000005508.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005508

-1 1
 O   0.7344000      -2.408300      0.2428000    
 O   -4.248900       2.046100      0.4398000    
 O   -4.959400      0.2006000       1.589900    
 N   -1.692400     -0.8380000     -0.1493000    
 C   -2.573000      3.1000001E-03 -0.7780000    
 C  -0.4507000     -0.5045000     -0.5410000    
 C   -1.843400      0.8644000      -1.567400    
 C  -0.4761000      0.5290000      -1.407700    
 C   -4.033500     -8.4600002E-02 -0.5721000    
 C   0.7601000      -1.203700     -6.0300000E-02
 C   -2.057500      -1.891900      0.7743000    
 C    2.032400     -0.5089000      5.8100000E-02
 C    2.058400      0.8576000      0.3369000    
 C    3.227000      -1.209400     -0.1085000    
 C    4.473500      0.8231000      0.2820000    
 C    3.278900       1.523700      0.4487000    
 C    4.447500     -0.5435000      3.5000001E-03
 C   -4.455700      0.8105000      0.6045000    
 C    5.778500       1.534700      0.4037000    
 H   -2.249300       1.646200      -2.194500    
 H   0.3553000       1.004100      -1.909400    
 H   -4.555500      0.2804000      -1.466300    
 H   -4.377400      -1.114700     -0.4316000    
 H   -2.053000      -2.839100      0.2293000    
 H   -3.041400      -1.711300       1.206500    
 H   -1.338400      -1.912100       1.597300    
 H    1.154000       1.430400      0.5196000    
 H    3.230300      -2.273200     -0.3319000    
 H    3.286800       2.586100      0.6779000    
 H    5.371600      -1.100300     -0.1276000    
 H    6.540200       1.075200     -0.2354000    
 H    5.688600       2.581100      9.2500001E-02
 H    6.126900       1.505900       1.440800    


%chk=000005508-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000005508

-1 1
O 0.717959 -2.329891 0.584612
O -5.452024 1.644458 0.301103
O -4.637687 -0.113254 1.628483
N -1.771748 -0.827818 -0.108857
C -2.645906 -0.001770 -0.808821
C -0.435384 -0.404336 -0.326182
C -1.861643 0.967201 -1.500325
C -0.503645 0.727465 -1.198263
C -4.127555 -0.129826 -0.776680
C 0.738720 -1.111087 0.152193
C -2.220068 -1.908911 0.794250
C 2.071579 -0.392586 0.126901
C 2.220273 0.999568 0.365555
C 3.246510 -1.170868 -0.050837
C 4.675070 0.820008 0.199336
C 3.502238 1.591717 0.399794
C 4.522630 -0.574263 -0.027612
C -4.813782 0.551715 0.528746
C 6.053770 1.457505 0.266073
H -2.274859 1.745951 -2.139450
H 0.361029 1.253692 -1.599340
H -4.550889 0.364681 -1.665345
H -4.432313 -1.192977 -0.764612
H -2.365632 -2.848933 0.228631
H -3.160478 -1.575862 1.275353
H -1.441156 -2.093085 1.546777
H 1.330794 1.610006 0.551574
H 3.125378 -2.249904 -0.195747
H 3.593193 2.668334 0.594889
H 5.415746 -1.193848 -0.183668
H 6.775819 0.927797 -0.381686
H 6.024990 2.516632 -0.047568
H 6.457872 1.431188 1.297825


