395
 OpenBabel09292113343D

 43 44  0  0  1  0  0  0  0  0999 V2000
    1.6318    0.7988   -3.2627 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7190    1.3394   -3.4010 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6418    0.9320   -4.3206 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2416    2.5202   -2.5847 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7168    2.4279   -2.5192 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1716    1.3428   -1.6470 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6638    1.2256   -1.5666 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5285    2.2512   -1.5841 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9102    2.0976   -1.5488 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7415    3.3045   -1.7250 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1211    4.4744   -1.1520 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2737    5.5898   -2.0716 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.9722    5.9688   -2.7744 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9237    6.4452   -1.9451 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5781    6.7528   -2.8728 P   0  0  0  0  0  0  0  0  0  0  0  0
    6.0962    7.7599   -3.8912 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2562    5.3761   -3.4342 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.5366    7.2921   -1.9105 O   0  5  0  0  0  0  0  0  0  0  0  0
   10.2952    5.1151   -3.1215 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6624    5.2949   -2.6742 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0505    3.6162   -3.1976 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.2090    2.9349   -3.6957 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4758    0.8216   -1.5066 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1001    0.4114   -1.4028 S   0  0  0  0  0  0  0  0  0  0  0  0
    8.5913   -0.2339   -1.5236 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2262   -0.1420   -1.5493 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5339   -1.1556   -1.5464 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4251    1.5275   -4.1660 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7928    2.5278   -1.5870 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9582    3.4339   -3.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0382    3.3671   -2.2091 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7824    0.4079   -2.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7544    1.4236   -0.6366 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1508    3.2742   -1.6306 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6727    3.1639   -1.1677 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6506    6.4364   -1.4883 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6038    5.0986   -3.3187 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2170    6.7644   -3.4850 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2183    5.6019   -4.0976 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6245    5.5615   -1.7393 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2029    3.3747   -3.8480 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9664    3.4734   -3.3863 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9666   -1.1594   -1.5123 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 28  1  0  0  0  0
  4  5  1  0  0  0  0
  4 29  1  0  0  0  0
  4 30  1  0  0  0  0
  5  6  1  0  0  0  0
  5 31  1  0  0  0  0
  6  7  1  0  0  0  0
  6 32  1  0  0  0  0
  6 33  1  0  0  0  0
  7  8  2  0  0  0  0
  7 26  1  0  0  0  0
  8  9  1  0  0  0  0
  8 34  1  0  0  0  0
  9 10  1  0  0  0  0
  9 23  1  0  0  0  0
 10 11  1  0  0  0  0
 10 21  1  0  0  0  0
 10 35  1  1  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 19  1  0  0  0  0
 12 36  1  1  0  0  0
 13 14  1  0  0  0  0
 13 37  1  0  0  0  0
 13 38  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 39  1  6  0  0  0
 20 40  1  0  0  0  0
 21 22  1  0  0  0  0
 21 41  1  6  0  0  0
 22 42  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 43  1  0  0  0  0
 26 27  2  0  0  0  0
M  CHG  2  17  -1  18  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
