417
 OpenBabel09292113373D

 53 55  0  0  1  0  0  0  0  0999 V2000
    1.3580    0.5389    0.7104 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4005    0.2055    0.1697 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8639    0.5796   -1.0598 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2250    1.4813   -1.9230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2036    2.2754   -1.5336 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6120    3.0413   -2.4716 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8855    3.1106   -3.7869 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9382    2.3412   -4.1091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6631    1.5349   -3.2521 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6713    0.8814   -3.9195 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5688    1.2960   -5.1724 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4912    2.1302   -5.3463 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8842    2.5610   -6.5929 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5205    1.9210   -7.7157 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9391    2.9383   -8.6651 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4226    3.2593   -8.5382 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1461    2.1000   -8.8978 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7741    2.2911   -8.8974 P   0  0  0  0  0  0  0  0  0  0  0  0
    7.2987    0.9169   -9.2804 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9897    3.3808   -9.9368 O   0  5  0  0  0  0  0  0  0  0  0  0
    7.0604    2.7221   -7.4653 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0482    4.1326   -8.3571 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7213    3.9505   -8.9226 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8934    4.0720   -6.8431 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6654    4.7155   -6.4654 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2983   -0.6202    0.8100 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0485   -1.1063    2.1660 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.7482   -2.4638    2.3235 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2246   -3.5358    2.0470 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0543   -2.3902    2.6858 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5160   -0.1284    3.2591 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9259    0.1409    3.0512 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7232    1.1849    3.3269 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2319    1.9979    4.3893 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5975    0.0449   -1.5055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1970    3.6769   -2.1234 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2223    1.0045   -5.9933 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8567    2.1760   -6.5656 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7395    2.5290   -9.6620 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6795    3.5483   -7.5156 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6763    4.0781   -9.2202 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4217    5.0962   -8.7140 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6847    3.0362   -9.2656 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7217    4.5649   -6.3245 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0797    4.6088   -7.2450 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2055   -0.7704    0.3900 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9740   -1.2878    2.2971 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3597   -1.4583    2.8290 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4544   -0.6194    4.2388 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9804    1.0359    2.6543 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6580    1.0069    3.5016 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8476    1.7744    2.4156 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0782    1.5264    5.2253 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 26  1  0  0  0  0
  3  4  1  0  0  0  0
  3 35  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  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  2  0  0  0  0
  8  9  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 37  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 24  1  0  0  0  0
 13 38  1  1  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 22  1  0  0  0  0
 15 39  1  6  0  0  0
 16 17  1  0  0  0  0
 16 40  1  0  0  0  0
 16 41  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 18 21  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 42  1  6  0  0  0
 23 43  1  0  0  0  0
 24 25  1  0  0  0  0
 24 44  1  1  0  0  0
 25 45  1  0  0  0  0
 26 27  1  0  0  0  0
 26 46  1  0  0  0  0
 27 28  1  0  0  0  0
 27 31  1  0  0  0  0
 27 47  1  0  0  0  0
 28 29  2  0  0  0  0
 28 30  1  0  0  0  0
 30 48  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 31 49  1  0  0  0  0
 32 50  1  0  0  0  0
 33 34  1  0  0  0  0
 33 51  1  0  0  0  0
 33 52  1  0  0  0  0
 34 53  1  0  0  0  0
M  CHG  2  20  -1  21  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
