357
 OpenBabel09292113343D

 39 40  0  0  1  0  0  0  0  0999 V2000
    3.2658   -2.9928    2.5745 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7657   -1.8826    2.4557 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7799   -1.4454    3.2897 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0354   -0.8616    1.3282 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.3053    0.3437    1.6028 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4792   -0.6611    0.9799 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1226    0.5132    0.9661 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3691    0.6664    0.3840 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8187    2.0042   -0.0019 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.8496    2.8784    1.1332 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2287    4.1415    0.7750 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8484    4.2863    1.4020 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9691    4.2294    2.8075 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5349    4.0343    3.5773 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.7331    5.2351    3.0880 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0534    2.6752    3.0593 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.9133    4.0738    5.0463 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.1518    4.1419   -0.7509 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.4082    4.5345   -1.3537 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9341    2.6709   -1.0729 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.3292    2.3641   -2.4137 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1160   -0.4305   -0.0281 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1770   -0.3644   -0.6483 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5628   -1.6572    0.2567 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2173   -1.8145    0.3934 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6544   -2.8313    0.0009 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5603   -0.5115    3.0332 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5309   -1.2855    0.4442 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7898    0.9984    2.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6375    1.4216    1.3218 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8475    1.9459   -0.3717 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8873    4.9297    1.1556 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1799    3.4966    1.0547 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4097    5.2481    1.1153 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3769    4.7913   -1.1684 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0713    4.5553   -0.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8782    2.4035   -0.9597 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0380    3.0094   -2.6147 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0457   -2.4229   -0.1966 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 27  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 28  1  0  0  0  0
  5 29  1  0  0  0  0
  6  7  2  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 30  1  0  0  0  0
  8  9  1  0  0  0  0
  8 22  1  0  0  0  0
  9 10  1  0  0  0  0
  9 20  1  0  0  0  0
  9 31  1  6  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  1  0  0  0  0
 11 32  1  1  0  0  0
 12 13  1  0  0  0  0
 12 33  1  0  0  0  0
 12 34  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 35  1  6  0  0  0
 19 36  1  0  0  0  0
 20 21  1  0  0  0  0
 20 37  1  1  0  0  0
 21 38  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 39  1  0  0  0  0
 25 26  2  0  0  0  0
M  CHG  2  16  -1  17  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
