%chk=000121287.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121287

0 1
 O   0.4860000     -0.7126000     -0.9670000    
 O  -0.3321000     -0.3457000       1.192300    
 N   -2.902200     -0.5308000      0.1038000    
 C   -5.315500       1.110000      0.2652000    
 C   -3.954200       1.621100      0.7233000    
 C   -5.363100     -0.4121000      0.3319000    
 C   -2.817500      0.9302000     -3.1500001E-02
 C   -4.181800      -1.038600     -0.4107000    
 C   -1.782800      -1.173900     -0.5836000    
 C  -0.4904000     -0.6912000      2.8999999E-02
 C    1.735800     -0.2828000     -0.5144000    
 C    2.611800      -1.214000      1.3000000E-03
 C    2.049200       1.056800     -0.6014000    
 C    4.203400      0.5647000      0.3755000    
 C    3.860500     -0.7852000      0.4518000    
 C    3.297900       1.485800     -0.1510000    
 C    2.263500      -2.663300      9.0499997E-02
 C    1.093300       2.057700      -1.162500    
 C    5.538100       1.023800      0.8574000    
 H   -6.107800       1.539200      0.8882000    
 H   -5.501800       1.437300     -0.7651000    
 H   -3.897000       2.704600      0.5683000    
 H   -3.840500       1.445300       1.800600    
 H   -5.348800     -0.7326000       1.381500    
 H   -6.304300     -0.7717000     -9.9200003E-02
 H   -2.854300       1.222800      -1.089800    
 H   -1.888000       1.337200      0.3771000    
 H   -4.230800      -2.125900     -0.2744000    
 H   -4.276900     -0.8404000      -1.486600    
 H   -1.814200      -2.261900     -0.4568000    
 H   -1.797600     -0.9416000      -1.655600    
 H    4.569200      -1.500500      0.8626000    
 H    3.568100       2.537600     -0.2090000    
 H    1.845200      -3.021200     -0.8563000    
 H    3.144000      -3.279400      0.3028000    
 H    1.535400      -2.829900      0.8906000    
 H   0.6014000       1.672000      -2.061600    
 H   0.3325000       2.311600     -0.4181000    
 H    1.604700       2.981600      -1.454400    
 H    6.264000      0.9921000      3.8899999E-02
 H    5.488300       2.047700       1.243200    
 H    5.902500      0.3918000       1.674300    


%chk=000121287-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121287

0 1
O 0.571817 -0.233321 -0.961258
O -0.427561 0.273259 1.100754
N -3.037569 -0.261401 -0.112587
C -5.813779 0.397739 0.608502
C -4.605529 1.071136 1.297522
C -5.411699 -0.998511 0.080910
C -3.382582 1.106092 0.360071
C -4.170795 -0.902705 -0.828695
C -1.804912 -0.300990 -0.906282
C -0.534433 -0.047915 -0.094914
C 1.910512 -0.030368 -0.465828
C 2.506856 -1.009246 0.362804
C 2.595461 1.119515 -0.922891
C 4.590594 0.330061 0.310023
C 3.855926 -0.802063 0.740050
C 3.942442 1.279036 -0.518870
C 1.732646 -2.224285 0.832342
C 1.900978 2.142077 -1.800973
C 6.047077 0.508048 0.704683
H -6.665220 0.315294 1.310223
H -6.153117 1.028057 -0.239981
H -4.856855 2.103927 1.606614
H -4.333246 0.505398 2.208800
H -5.174411 -1.662318 0.934431
H -6.244802 -1.459674 -0.483950
H -3.602336 1.779819 -0.512399
H -2.511214 1.515586 0.897559
H -3.855597 -1.915038 -1.146234
H -4.442526 -0.330182 -1.756550
H -1.696482 -1.300128 -1.368532
H -1.793680 0.429307 -1.758880
H 4.340829 -1.545735 1.384805
H 4.493641 2.164716 -0.858873
H 1.192444 -2.705977 -0.003278
H 2.406598 -2.970732 1.285011
H 0.978127 -1.939733 1.589198
H 1.458441 1.668916 -2.696035
H 1.074206 2.640049 -1.259456
H 2.608040 2.921706 -2.130798
H 6.721079 0.012303 -0.021089
H 6.329650 1.574954 0.738617
H 6.254182 0.068928 1.696538


