435
 OpenBabel09292113353D

 45 47  0  0  1  0  0  0  0  0999 V2000
    1.7173   -0.0467   -2.0918 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8572   -0.4449   -1.8898 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7742   -0.5203   -2.8808 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3323   -0.9761   -0.5403 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7779   -0.9634   -0.3373 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5451   -2.0461   -0.6777 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0506   -2.9373   -1.3555 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8319   -1.9600   -0.2120 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7984   -2.9485   -0.4460 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6340   -3.8922   -1.3996 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5696   -4.8553   -1.5129 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6855   -5.0201   -0.7829 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.8219   -4.0428    0.1278 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9528   -2.9838    0.3481 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4046   -2.1811    1.3727 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.5322   -2.7512    1.7778 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8090   -3.8932    1.0695 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8699   -4.8544    1.2966 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.1496   -4.9613    2.7049 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5845   -4.8893    2.9010 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.0193   -3.5329    3.4279 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4643   -3.2969    4.7296 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9598   -1.7792    5.3958 P   0  0  0  0  0  0  0  0  0  0  0  0
   15.3994   -2.3385    5.3384 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2544   -1.1327    4.1805 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.4553   -0.2615    6.0621 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.1958   -5.1672    1.5267 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.2439   -6.5901    1.2416 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1806   -4.5624    0.5640 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.2678   -5.2136   -0.7140 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5527   -1.0484   -2.5977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9615   -2.0035   -0.4432 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8965   -0.3596    0.2505 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2461   -0.0840   -0.1609 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0437   -1.3395    0.5601 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3883   -5.5949   -2.2857 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1678   -2.3914    2.5865 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4757   -5.8335    0.9965 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8419   -5.6625    3.6319 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7090   -2.7536    2.7274 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1135   -3.5339    3.4758 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2078   -4.7769    1.3817 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9354   -7.0497    2.0449 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3398   -3.4892    0.4182 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6633   -6.0903   -0.5144 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3 31  1  0  0  0  0
  4  5  1  0  0  0  0
  4 32  1  0  0  0  0
  4 33  1  0  0  0  0
  5  6  1  0  0  0  0
  5 34  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 35  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  2  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 36  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 17  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 37  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 29  1  0  0  0  0
 18 38  1  6  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 27  1  0  0  0  0
 20 39  1  1  0  0  0
 21 22  1  0  0  0  0
 21 40  1  0  0  0  0
 21 41  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 42  1  6  0  0  0
 28 43  1  0  0  0  0
 29 30  1  0  0  0  0
 29 44  1  6  0  0  0
 30 45  1  0  0  0  0
M  CHG  2  25  -1  26  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
