346
 OpenBabel09292113323D

 54 55  0  0  1  0  0  0  0  0999 V2000
    1.5077  -15.8349   -5.3463 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1190  -14.6254   -5.8643 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2946  -14.5787   -7.0993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0773  -13.3559   -7.4874 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2818  -12.2168   -6.7920 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1091  -10.8640   -7.2104 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.3530  -10.8509   -7.9369 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2033  -10.0337   -9.1252 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.1394  -10.8792  -10.3912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3816  -11.5343  -10.5479 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5109  -12.4256  -11.9155 P   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3397  -11.3909  -13.0181 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3566  -13.4135  -11.7896 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.8964  -13.0372  -11.8117 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0713   -9.2290   -8.9081 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1710   -8.0580   -8.0820 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9450  -10.1753   -8.0969 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.9332   -9.4126   -7.3855 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0933  -12.3402   -5.6714 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4766  -11.2941   -5.0175 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3532  -11.4424   -3.8776 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6295  -10.0325   -3.3564 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3690   -9.2742   -2.9140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5772   -9.9325   -1.7786 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3652  -10.1294   -0.4788 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5241  -10.8721    0.4930 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7756   -8.7779    0.1382 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1091   -8.1636    0.9603 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9932   -8.3348   -0.2615 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4978  -13.5731   -5.1977 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8612  -16.5982   -5.5027 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7974  -15.7399   -4.3821 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0202  -15.4756   -7.6298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6905  -13.2100   -8.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3054  -10.2533   -6.3199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0890   -9.3899   -9.1668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3369  -11.6197  -10.3319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9602  -10.2247  -11.2517 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5558   -8.8773   -9.8232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1101   -8.0857   -7.8169 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4607  -10.8981   -8.7371 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4813   -8.5698   -7.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3062  -11.8973   -4.1725 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9045  -12.0599   -3.0918 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1117   -9.4465   -4.1499 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3544  -10.0979   -2.5422 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6959   -9.1545   -3.7730 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6505   -8.2553   -2.6245 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1880  -10.8979   -2.1248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3049   -9.3076   -1.5831 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2623  -10.7363   -0.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4268  -10.4995    0.4417 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8328  -10.6248    1.4364 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4399   -8.9186   -0.9073 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
  2  3  1  0  0  0  0
  2 30  2  0  0  0  0
  3  4  2  0  0  0  0
  3 33  1  0  0  0  0
  4  5  1  0  0  0  0
  4 34  1  0  0  0  0
  5  6  1  0  0  0  0
  5 19  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  6 35  1  1  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 36  1  6  0  0  0
  9 10  1  0  0  0  0
  9 37  1  0  0  0  0
  9 38  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 11 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 39  1  6  0  0  0
 16 40  1  0  0  0  0
 17 18  1  0  0  0  0
 17 41  1  6  0  0  0
 18 42  1  0  0  0  0
 19 20  2  3  0  0  0
 19 30  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 43  1  0  0  0  0
 21 44  1  0  0  0  0
 22 23  1  0  0  0  0
 22 45  1  0  0  0  0
 22 46  1  0  0  0  0
 23 24  1  0  0  0  0
 23 47  1  0  0  0  0
 23 48  1  0  0  0  0
 24 49  1  0  0  0  0
 24 50  1  0  0  0  0
 25 27  1  0  0  0  0
 25 26  1  0  0  0  0
 25 24  1  0  0  0  0
 25 51  1  6  0  0  0
 26 52  1  0  0  0  0
 26 53  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
 29 54  1  0  0  0  0
M  CHG  2  13  -1  14  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
