325
 OpenBabel09292113353D

 42 44  0  0  1  0  0  0  0  0999 V2000
    3.1192    0.4683    4.2014 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.8608    1.3070    4.3553 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.7950    2.1286    2.9371 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9069    2.9705    2.7198 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7592    3.6568    1.3638 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5908    4.5159    1.3057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9915    5.8652    1.6180 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5127    5.8717    1.8079 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1576    7.0036    1.1990 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9411    4.5882    1.0883 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1102    4.8730   -0.3757 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2417    6.3698    2.7516 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6882    5.6637    3.7827 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0683    6.4623    4.6332 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2433    7.7405    4.1525 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9659    7.6989    2.9690 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3275    8.7359    2.1949 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9209    9.8922    2.7360 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2152   10.0910    3.8677 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1718    9.0151    4.6305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9485    9.2579    5.7576 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3891    8.1893    6.6426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0719   10.6105    6.2649 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5609    0.5244    4.3764 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9718    2.4200    5.3865 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.8252    2.3728    2.7208 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9707    3.7066    3.5251 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6397    2.8924    0.5874 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7024    6.4778    0.7546 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7971    5.8528    2.8655 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3831    6.6845    0.2977 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8992    4.2125    1.4624 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1683    4.9199   -0.7809 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5011    4.0215   -0.7893 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7564    4.5821    3.8794 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1935   10.7903    2.1906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3027    7.1787    6.2498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4538    8.3298    6.8632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8454    8.2311    7.5928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6705   11.3878    5.6076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5587   10.7037    7.2287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1300   10.8441    6.4248 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2 24  2  0  0  0  0
  2 25  1  0  0  0  0
  3  4  1  0  0  0  0
  4 26  1  0  0  0  0
  4 27  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  5  4  1  0  0  0  0
  5 28  1  6  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  1  0  0  0  0
  7 29  1  6  0  0  0
  8 10  1  0  0  0  0
  8  9  1  0  0  0  0
  8 30  1  1  0  0  0
  9 31  1  0  0  0  0
 10 11  1  0  0  0  0
 10 32  1  1  0  0  0
 11 33  1  0  0  0  0
 11 34  1  0  0  0  0
 12 13  1  0  0  0  0
 12 16  1  0  0  0  0
 13 14  2  0  0  0  0
 13 35  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 20  2  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 36  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 22 37  1  0  0  0  0
 22 38  1  0  0  0  0
 22 39  1  0  0  0  0
 23 40  1  0  0  0  0
 23 41  1  0  0  0  0
 23 42  1  0  0  0  0
M  CHG  2   1  -1  25  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
