71
 OpenBabel09292113343D

 52 55  0  0  1  0  0  0  0  0999 V2000
    1.2844    0.3099    0.0229 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7628    0.1994    0.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3090   -1.0547   -0.0241 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6009   -0.8773   -0.0168 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5581   -1.8412   -0.0550 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8539   -1.4781   -0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3111   -0.1841    0.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3167    0.8885    0.1005 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5732    2.0866    0.2088 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9515    0.4763    0.0559 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7462    1.1852    0.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6121    2.6796    0.0925 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8468    3.2281    1.3034 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4619    2.9054    2.6693 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.7949    3.5385    2.8732 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5334    3.3768    3.8092 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2575    3.7548    4.8972 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3137    3.3922    3.7794 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6839   -0.1756    0.0285 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0327   -1.4542    0.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9435   -2.2914   -0.0299 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9094   -3.7418    0.0401 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.2419   -4.2790    0.1137 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2761   -5.5289   -0.6216 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.3458   -5.4096   -1.7073 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6260   -5.2130   -1.1131 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8779   -5.7682   -1.1914 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0842   -6.6372   -0.3654 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2361   -4.3912   -1.1691 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.8144   -4.4773   -1.0228 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8339   -0.6894   -0.0019 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9402    0.8557   -0.8590 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9206    0.8065    0.9254 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2418   -2.7995   -0.2358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0605    2.9702   -0.8122 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5723    3.1916    0.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8170    2.8527    1.2765 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7516    4.3172    1.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5736    1.8242    2.8037 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7221    4.5331    2.6307 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4462    3.1676    2.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2078    3.6715    4.6332 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0505   -1.8240    0.0184 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3887   -3.9923    0.9736 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5616   -6.3079    0.0946 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1559   -4.5595   -2.3695 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3932   -6.3245   -2.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5780   -4.3862   -0.5981 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8801   -6.2093   -2.1931 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4119   -6.6133    0.5530 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4655   -3.8435   -2.0905 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6144   -5.4217   -0.8361 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 31  1  0  0  0  0
  1 32  1  0  0  0  0
  1 33  1  0  0  0  0
  2  3  1  0  0  0  0
  2 11  2  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4 10  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 21  1  0  0  0  0
  7  8  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 35  1  0  0  0  0
 12 36  1  0  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
 14 16  1  0  0  0  0
 14 39  1  0  0  0  0
 15 40  1  0  0  0  0
 15 41  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 42  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 20 43  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 29  1  0  0  0  0
 22 44  1  1  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 27  1  0  0  0  0
 24 45  1  1  0  0  0
 25 26  1  0  0  0  0
 25 46  1  0  0  0  0
 25 47  1  0  0  0  0
 26 48  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 49  1  6  0  0  0
 28 50  1  0  0  0  0
 29 30  1  0  0  0  0
 29 51  1  6  0  0  0
 30 52  1  0  0  0  0
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
