93
 OpenBabel09292113373D

 56 59  0  0  1  0  0  0  0  0999 V2000
    1.1222    0.1360    0.0066 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5599   -0.0905    0.0822 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1845   -1.3213    0.1488 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5635   -1.4260    0.3105 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0042   -2.7142    0.2932 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9144   -3.4163    0.1337 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7629   -2.6404    0.0771 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4518   -3.2769   -0.0123 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5026   -4.5407    0.7322 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8292   -5.5831   -0.0183 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8308   -6.6615   -0.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4197   -7.2878    0.6830 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1588   -4.8923   -1.1980 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1671   -4.4384   -0.8692 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0239   -3.6580   -1.4329 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.2768   -2.6327   -2.0836 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3792   -0.2340    0.4283 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5827   -0.2209    0.6802 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7197    0.9861    0.2437 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3309    1.0708    0.1058 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9609    2.3344    0.0313 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1153    3.0877    0.0662 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0949    4.5701    0.0127 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2329    2.2719    0.1458 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6907    2.6416    0.1337 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1948    2.9917    1.5488 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.2752    1.7821    2.3387 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5833    3.6827    1.5952 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.6562    4.9416    0.8221 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.0019    3.9869    3.0691 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6498    3.0424    3.9741 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6307    4.9795    3.4188 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5296   -0.7728   -0.0494 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8653    0.7292   -0.8796 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7796    0.6838    0.8927 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8896   -4.4939    0.0656 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7265   -2.6579    0.5077 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1003   -6.0333    0.6651 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6397   -6.2550   -1.0656 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3218   -7.4438   -1.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8862   -6.6008    1.1934 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0645   -5.5249   -2.0873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2757   -4.4319    0.1004 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8878   -3.9143   -2.0565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6691   -2.8844   -1.9922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0758    4.9642    0.0065 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6134    4.9268   -0.8821 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6137    4.9827    0.8855 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8026    3.4949   -0.5451 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2897    1.8353   -0.3082 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4676    3.6412    2.0525 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3530    1.0083    1.7316 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3450    3.0000    1.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1735    5.6902    1.3211 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2727    4.8710   -0.1141 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1065    2.3178    3.5742 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  1  0  0  0  0
  2  3  1  0  0  0  0
  2 20  1  0  0  0  0
  3  4  2  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4 17  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6 36  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 15  1  0  0  0  0
  8 37  1  1  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 13  1  0  0  0  0
 10 38  1  1  0  0  0
 11 12  1  0  0  0  0
 11 39  1  0  0  0  0
 11 40  1  0  0  0  0
 12 41  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 42  1  6  0  0  0
 14 43  1  0  0  0  0
 15 16  1  0  0  0  0
 15 44  1  6  0  0  0
 16 45  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 24  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 46  1  0  0  0  0
 23 47  1  0  0  0  0
 23 48  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 49  1  0  0  0  0
 25 50  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 51  1  0  0  0  0
 27 52  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 28 53  1  0  0  0  0
 29 54  1  0  0  0  0
 29 55  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
 31 56  1  0  0  0  0
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
