%chk=000007618.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007618

0 1
 O   -3.415500       1.344700     -0.1559000    
 O    2.885500       2.261200     -0.1578000    
 O   0.5368000      -3.618800     -0.1522000    
 N  -3.5999999E-03  6.5000001E-03  0.2357000    
 C   -1.066600      0.8986000     -0.2257000    
 C    1.298100      0.4738000     -0.2397000    
 C  -0.2521000      -1.361700     -0.2172000    
 C   -2.417300      0.4419000      0.3018000    
 C    1.607700       1.855200      0.3146000    
 C   0.8271000      -2.301500      0.2964000    
 H   -1.097800      0.9675000      -1.321500    
 H  -0.9410000       1.920600      0.1439000    
 H    1.353800      0.4824000      -1.336500    
 H    2.123200     -0.1550000      0.1058000    
 H  -0.3166000      -1.427600      -1.311600    
 H   -1.190000      -1.766000      0.1747000    
 H   -2.434900      0.4297000       1.396900    
 H   -2.721000     -0.5367000     -7.4800000E-02
 H    1.636500       1.849900       1.409100    
 H   0.9132000       2.631800     -1.1200000E-02
 H   0.8644000      -2.306700       1.390900    
 H    1.820400      -2.079900     -9.7400002E-02
 H   -4.264500       1.042700      0.2096000    
 H    2.843700       2.295300      -1.128900    
 H    1.227800      -4.202300      0.2054000    


%chk=000007618-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007618

0 1
O -3.466551 1.310057 0.038830
O 2.912165 2.380294 0.144597
O 0.603554 -3.722714 0.002682
N 0.006656 -0.040544 -0.255657
C -1.227395 0.702542 -0.597388
C 1.265809 0.654794 -0.592871
C -0.018680 -1.479735 -0.604551
C -2.283829 0.567245 0.508250
C 1.651179 1.697424 0.478206
C 0.643306 -2.331974 0.487392
H -1.673123 0.365401 -1.560631
H -0.989995 1.775538 -0.713964
H 1.213552 1.155582 -1.593855
H 2.084395 -0.085043 -0.656024
H 0.484081 -1.691432 -1.575918
H -1.067781 -1.809840 -0.711321
H -1.883048 0.990296 1.452598
H -2.527117 -0.504000 0.676472
H 1.844263 1.194994 1.438912
H 0.829168 2.430309 0.625903
H 0.082341 -2.214191 1.437552
H 1.690148 -1.997997 0.653283
H -4.184745 1.252460 0.716901
H 2.797814 2.863704 -0.712695
H 1.031135 -4.317572 0.667696


