%chk=000089230.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089230

0 1
 O    3.751900      0.4098000     -0.3655000    
 O   -2.263000      0.2488000     -0.3082000    
 O   0.3030000      -2.374600     -0.3638000    
 O    1.570400      -1.517000       1.366800    
 O   -1.910900       2.100800      0.9848000    
 N  -0.2011000       1.272400     -0.3526000    
 C    1.542100     -0.4363000     -0.7839000    
 C   0.3001000      0.2827000      -1.313900    
 C   0.7685000       2.290300      4.5499999E-02
 C    1.986800       1.644800      0.6874000    
 C    2.539900      0.5538000     -0.2068000    
 C    1.160200      -1.485900      0.2145000    
 C   -1.494800       1.275100      0.1742000    
 C   -3.605500      0.1787000      0.1859000    
 C  -0.1446000      -3.437600      0.4835000    
 C   -4.303100      -1.005900     -0.4480000    
 H    2.040900     -0.9482000      -1.617100    
 H   0.5656000      0.8460000      -2.217800    
 H  -0.4870000     -0.4168000      -1.607500    
 H   0.3180000       3.008200      0.7380000    
 H    1.054700       2.838400     -0.8601000    
 H    1.727800       1.196800       1.652500    
 H    2.762300       2.399000      0.8561000    
 H   -3.587200      5.7900000E-02   1.274700    
 H   -4.137100       1.101800     -7.0100002E-02
 H  -0.8143000      -4.076500     -9.7999997E-02
 H  -0.6982000      -3.032900       1.336200    
 H   0.7061000      -4.036200      0.8227000    
 H   -5.333200      -1.090700     -9.0899996E-02
 H   -4.313300     -0.9083000      -1.538600    
 H   -3.770600      -1.934700     -0.2174000    


%chk=000089230-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089230

0 1
O 3.714788 0.359390 -0.575226
O -2.227006 0.335901 -0.366589
O 0.635127 -2.653018 -0.378132
O 0.544183 -1.130920 1.383321
O -1.841718 2.176188 1.044061
N -0.198755 1.427675 -0.458584
C 1.427173 -0.445864 -0.837887
C 0.275267 0.448587 -1.439175
C 0.823517 2.353722 0.058837
C 2.001956 1.557690 0.704675
C 2.508715 0.478568 -0.237496
C 0.840562 -1.399104 0.196030
C -1.443991 1.381533 0.152968
C -3.587990 0.220389 0.232070
C 0.006932 -3.667223 0.506627
C -4.226389 -1.025934 -0.372727
H 1.880547 -1.039941 -1.648185
H 0.693881 0.980670 -2.316106
H -0.562385 -0.178330 -1.773861
H 0.347780 3.009035 0.804249
H 1.204459 2.978578 -0.772564
H 1.619649 1.068065 1.620458
H 2.832646 2.234091 0.966463
H -3.482501 0.153471 1.329335
H -4.152802 1.140188 -0.004899
H -0.076676 -4.567693 -0.117089
H -0.984226 -3.316728 0.840651
H 0.644529 -3.848754 1.387558
H -5.246151 -1.156128 0.032988
H -4.297971 -0.942273 -1.470797
H -3.638748 -1.928129 -0.128373


