234
 OpenBabel09292113333D

 30 31  0  0  1  0  0  0  0  0999 V2000
    1.1543   -0.9668   -0.3706 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4131   -1.6190   -0.0183 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3354   -0.9828    0.7773 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5023   -1.5609    1.0572 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8077   -0.7317    2.0995 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.7594   -2.9182    0.4869 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8531   -3.4561    0.7005 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7984   -3.5154   -0.2218 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.6454   -2.9110   -0.5164 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7843   -3.4587   -1.2077 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2763    0.4675   -0.3791 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1871    1.0461    0.3770 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.6395    1.5080    1.7620 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5521    2.5933    1.6476 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0662    3.2068    3.1813 P   0  0  0  0  0  0  0  0  0  0  0  0
    3.0315    4.0836    2.3539 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5922    3.6489    3.3757 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.5263    3.7558    4.5540 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8618   -0.0664    0.4660 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.6693   -0.1162   -0.7248 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0183   -1.3213    0.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9008   -1.2412   -1.4016 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0946    0.0095    1.1456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1758    1.9034   -0.1999 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1242    0.7057    2.3252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2538    1.8254    2.3102 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5484    0.0365    1.3126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1224    0.2571   -1.4409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5374   -2.2205    0.1924 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3178   -1.4951    1.5670 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  6  0  0  0
  2  3  1  0  0  0  0
  2  9  1  0  0  0  0
  3  4  2  0  0  0  0
  3 23  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 19  1  0  0  0  0
 12 24  1  6  0  0  0
 13 14  1  0  0  0  0
 13 25  1  0  0  0  0
 13 26  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  2  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 27  1  1  0  0  0
 20 28  1  0  0  0  0
 21 29  1  0  0  0  0
 21 30  1  0  0  0  0
M  CHG  2  16  -1  17  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
