20
 OpenBabel09292113313D

 52 55  0  0  1  0  0  0  0  0999 V2000
   -0.2403   -6.7348    1.2465 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5595   -5.9852    2.3058 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.0412   -6.6937    2.2495 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4770   -7.1608    0.9832 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5560   -6.0456   -0.0626 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6233   -5.1272    0.2902 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5456   -5.0470   -0.7817 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.3944   -6.3518   -1.5620 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8916   -6.5610   -1.4668 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3108   -5.7255   -2.5065 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8092   -6.2350   -2.9315 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8859   -4.8815   -0.3153 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0069   -3.7527    0.5538 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7860   -2.3997   -0.1179 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.5446   -1.4633    0.8116 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.7444   -2.1943    1.1741 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4490   -3.6180    1.0620 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.8376   -4.2570    2.3003 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0838   -4.9894    3.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7674   -5.2359    3.1187 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3389   -5.9838    4.1479 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0906   -6.4714    5.1613 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4151   -6.2240    5.1668 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9632   -5.4304    4.1439 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2421   -4.9714    3.8946 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1247   -4.2726    2.7842 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1683   -6.7267    6.2310 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7734   -1.0631    2.0778 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5239   -0.1114    2.8433 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3839   -2.3385   -1.4269 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8336   -4.5318    1.9484 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1150   -6.2147    3.7389 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.8144   -7.9706    0.6547 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4667   -7.6051    1.1373 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6315   -5.4700   -0.0965 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2828   -4.1933   -1.4172 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9587   -7.1627   -1.0898 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5792   -7.5897   -1.6685 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6123   -5.1965   -2.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0329   -5.8116   -3.3604 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2983   -3.8223    1.3813 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7300   -2.1413   -0.2336 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8811   -0.5641    0.2831 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1389   -4.0180    0.3062 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2696   -6.1996    4.1669 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9307   -3.7560    2.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5449   -6.9041    7.0123 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9856   -6.1562    6.4083 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5884   -1.9173    2.7343 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8166   -0.6011    1.8166 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0167    0.4532    2.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3508   -2.3304   -1.3212 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2 31  2  0  0  0  0
  2 32  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 33  1  0  0  0  0
  4 34  1  0  0  0  0
  5  6  1  0  0  0  0
  5  9  1  0  0  0  0
  5 35  1  6  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  1  0  0  0  0
  7 36  1  6  0  0  0
  8  9  1  0  0  0  0
  8 11  1  0  0  0  0
  8 37  1  1  0  0  0
  9 10  1  0  0  0  0
  9 38  1  6  0  0  0
 10 39  1  0  0  0  0
 11 40  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 17  1  0  0  0  0
 13 41  1  1  0  0  0
 14 15  1  0  0  0  0
 14 30  1  0  0  0  0
 14 42  1  6  0  0  0
 15 16  1  0  0  0  0
 15 28  1  0  0  0  0
 15 43  1  6  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 44  1  6  0  0  0
 18 19  1  0  0  0  0
 18 26  1  0  0  0  0
 19 20  1  0  0  0  0
 19 24  2  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 21 45  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 27  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 46  1  0  0  0  0
 27 47  1  0  0  0  0
 27 48  1  0  0  0  0
 28 29  1  0  0  0  0
 28 49  1  0  0  0  0
 28 50  1  0  0  0  0
 29 51  1  0  0  0  0
 30 52  1  0  0  0  0
M  CHG  2   1  -1  32  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
