%chk=000040749.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040749

0 1
 O   -1.297800      4.4399999E-02  0.3315000    
 O   -3.096100      -1.082000     -0.5745000    
 C    3.387400     -0.4428000      0.2347000    
 C    3.955700      0.7865000     -0.4748000    
 C    1.997700     -0.7517000     -0.2411000    
 C    5.373900       1.087200     -1.5400000E-02
 C   0.9200000     -0.7581000      0.5570000    
 C  -0.4605000      -1.076400      8.3899997E-02
 C   -3.356700       1.178500      0.2812000    
 C   -2.607500     -9.0899996E-02 -4.9600001E-02
 C   -4.816100       1.105400     -0.1329000    
 H    4.023100      -1.313800      3.4499999E-02
 H    3.401500     -0.2819000       1.319600    
 H    3.321900       1.659800     -0.2782000    
 H    3.957800      0.6286000      -1.560300    
 H    1.883600     -0.9925000      -1.295300    
 H    5.761400       1.969300     -0.5347000    
 H    5.403800       1.286100       1.060600    
 H    6.041800      0.2466000     -0.2286000    
 H    1.034700     -0.5250000       1.612700    
 H  -0.4705000      -1.312200     -0.9868000    
 H  -0.8351000      -1.943400      0.6402000    
 H   -3.293600       1.346000       1.361600    
 H   -2.873700       2.011500     -0.2402000    
 H   -5.328900      0.2833000      0.3775000    
 H   -5.330700       2.037900      0.1179000    
 H   -4.911000      0.9410000      -1.211300    


%chk=000040749-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040749

0 1
O -1.469089 -0.205218 -1.085711
O -2.381883 -0.800320 0.978412
C 3.160429 -0.450545 0.241817
C 3.845583 0.867287 -0.215670
C 1.947382 -0.800800 -0.589963
C 5.111410 1.186096 0.607892
C 0.690259 -0.980155 -0.104900
C -0.488921 -1.349374 -0.962585
C -3.262008 1.157951 -0.266000
C -2.361856 -0.045010 -0.021333
C -4.391214 1.279392 0.772378
H 3.907745 -1.269812 0.171787
H 2.875954 -0.369777 1.308990
H 3.119681 1.699231 -0.131793
H 4.109037 0.787641 -1.289796
H 2.119762 -0.912003 -1.673782
H 5.583926 2.126570 0.270598
H 4.868929 1.295616 1.681587
H 5.860736 0.377413 0.513948
H 0.489719 -0.869771 0.969341
H -0.196647 -1.546633 -2.005950
H -1.040571 -2.208916 -0.540335
H -2.617617 2.059049 -0.256888
H -3.660106 1.086861 -1.295241
H -3.981452 1.332938 1.795205
H -4.989276 2.188447 0.584044
H -5.063812 0.405242 0.733147


