112
 OpenBabel09292113353D

 58 61  0  0  1  0  0  0  0  0999 V2000
    0.9560    0.4689    0.4421 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4023    0.3076    0.4019 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1209    1.4736    0.3636 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6453    2.6892    0.4099 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7042    3.5214    0.2381 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4139    4.9663    0.0952 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8974    2.8105    0.2206 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3066    3.3025    0.1706 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8761    3.6227    1.5628 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0435    2.4164    2.5064 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.0175    1.4461    1.9724 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4494    2.8735    3.9274 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0717    1.8646    4.6102 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4208    2.1622    5.9596 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1872    3.9699    4.4099 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5044    1.4709    0.2156 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2189    0.2594    0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4365    0.3061   -0.1059 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4277   -0.9765    0.0861 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8195   -2.2770   -0.0650 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6998   -2.9701    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5894   -2.1678    0.1693 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2231   -2.6555    0.1683 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0974   -3.7482    1.0843 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0767   -4.6304    0.5839 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5427   -6.0644    0.8083 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7420   -6.2969    0.0707 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1570   -4.3115   -0.8945 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.5353   -4.0050   -1.1544 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7308   -3.1150   -1.2038 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0109   -2.0879   -1.8714 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0539   -0.8806    0.2426 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6263    1.5147    0.4352 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5462    0.0371    1.3604 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4953    0.0177   -0.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3292    5.1133    0.0101 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8646    5.3594   -0.8196 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7633    5.5337    0.9590 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3150    4.2336   -0.4133 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9629    2.6239   -0.3791 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2296    4.3705    2.0421 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8499    4.1162    1.4341 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0820    1.9072    2.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9039    1.9011    1.7687 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6794    1.0416    1.0916 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9698    1.3043    6.3589 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5177    2.3041    6.5601 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0688    3.0415    6.0118 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6212   -4.0491   -0.0849 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5675   -1.8862    0.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8337   -4.4509    1.1689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2162   -6.7747    0.4682 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7518   -6.2325    1.8699 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9910   -7.2258    0.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0946   -5.1522   -1.5486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862   -3.2359   -0.6096 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5601   -3.4154   -1.8543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6639   -2.5455   -2.4393 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 32  1  0  0  0  0
  3  4  2  0  0  0  0
  3 16  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  6 36  1  0  0  0  0
  6 37  1  0  0  0  0
  6 38  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  8  9  1  0  0  0  0
  8 39  1  0  0  0  0
  8 40  1  0  0  0  0
  9 10  1  0  0  0  0
  9 41  1  0  0  0  0
  9 42  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 43  1  0  0  0  0
 11 44  1  0  0  0  0
 11 45  1  0  0  0  0
 12 13  1  0  0  0  0
 12 15  2  0  0  0  0
 13 14  1  0  0  0  0
 14 46  1  0  0  0  0
 14 47  1  0  0  0  0
 14 48  1  0  0  0  0
 16 17  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 32  2  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 21 49  1  0  0  0  0
 22 23  1  0  0  0  0
 22 32  1  0  0  0  0
 23 24  1  0  0  0  0
 23 30  1  0  0  0  0
 23 50  1  1  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 28  1  0  0  0  0
 25 51  1  1  0  0  0
 26 27  1  0  0  0  0
 26 52  1  0  0  0  0
 26 53  1  0  0  0  0
 27 54  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 28 55  1  6  0  0  0
 29 56  1  0  0  0  0
 30 31  1  0  0  0  0
 30 57  1  6  0  0  0
 31 58  1  0  0  0  0
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
