416
 OpenBabel09292113302D

 42 45  0  0  1  0  0  0  0  0999 V2000
    7.6069   -1.2868    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2002   -0.3733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2057   -0.2688    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7989    0.6448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3867    1.4538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7989    2.2628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1079    3.2139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0861    3.4218    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3951    4.3729    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.3462    4.6819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3462    5.6819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3951    5.9909    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.0861    6.9419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8073    5.1819    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.8073    5.1819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3073    6.0479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8073    6.9139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3073    6.0479    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.8073    6.9139    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8073    5.1819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8073    5.1819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3073    4.3158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3073    4.3158    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8073    3.4498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8479    1.9538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8479    0.9538    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0388    0.3660    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0878    0.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000   -0.1340    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5000   -0.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000   -1.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.0000   -0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.0878   -0.9430    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7788   -1.8940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0388   -0.6340    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8479   -1.2218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3812    1.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9690    2.1583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7880    0.4357    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2 42  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4 26  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 40  1  0  0  0  0
  6  7  1  0  0  0  0
  6 25  2  0  0  0  0
  7  8  1  0  0  0  0
  9  8  1  6  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  1  0  0  0
 12 14  1  0  0  0  0
 14 15  1  1  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 25 26  1  0  0  0  0
 27 26  1  1  0  0  0
 27 28  1  0  0  0  0
 27 38  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  1  0  0  0
 29 36  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
 32 35  1  0  0  0  0
 36 37  1  6  0  0  0
 36 38  1  0  0  0  0
 38 39  1  6  0  0  0
 40 41  2  0  0  0  0
 40 42  1  0  0  0  0
M  CHG  2  34  -1  35  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
