253
 OpenBabel09292113363D

 48 50  0  0  1  0  0  0  0  0999 V2000
    3.6806   -0.4309    0.5184 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7000    0.3165   -0.7820 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2060   -0.1628   -1.9428 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4605   -1.4410   -2.1593 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4101   -2.4328   -2.6088 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8450   -3.4248   -3.4210 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2788   -4.7720   -3.4387 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5870   -5.6287   -4.2798 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1638   -6.8567   -4.1271 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6784   -8.1292   -4.6359 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4711   -8.1194   -5.5859 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2289   -8.2925   -4.8798 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7477   -9.3148   -6.4797 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2270  -10.4774   -5.7898 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2749   -9.3178   -6.5798 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.7624   -8.4123   -7.7083 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1781   -8.5526   -7.8731 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8342   -7.6060   -9.1640 P   0  0  0  0  0  0  0  0  0  0  0  0
    4.9915   -8.5012  -10.1029 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2522   -6.3757   -8.4357 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.4902   -6.6594  -10.4549 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7444   -8.8588   -5.2797 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1770   -6.7034   -3.2052 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2426   -5.4707   -2.7294 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5421   -5.3137   -5.0565 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2528   -4.0122   -5.0139 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8127   -3.0798   -4.2366 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3318    1.6806   -0.7532 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2473   -1.4311    0.4339 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1034    0.1196    1.2684 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7033   -0.5572    0.8863 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3004    0.4420   -2.8395 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6771   -1.2058   -2.8904 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9410   -1.7853   -1.2601 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9988   -2.8509   -1.8954 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4227   -8.7043   -3.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4079   -7.2354   -6.2203 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0597   -9.2566   -4.9243 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2266   -9.2464   -7.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9898  -11.0497   -5.5969 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6687  -10.3292   -6.7223 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5017   -7.3760   -7.4773 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2514   -8.7068   -8.6303 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8085   -7.5320   -2.9094 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4611   -3.6801   -5.6728 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7002    1.9290    0.2474 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6009    2.4488   -1.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1793    1.7303   -1.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 29  1  0  0  0  0
  1 30  1  0  0  0  0
  1 31  1  0  0  0  0
  2  3  2  0  0  0  0
  2 28  1  0  0  0  0
  3  4  1  0  0  0  0
  3 32  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 35  1  0  0  0  0
  6  7  1  0  0  0  0
  6 27  2  0  0  0  0
  7  8  2  0  0  0  0
  7 24  1  0  0  0  0
  8  9  1  0  0  0  0
  8 25  1  0  0  0  0
  9 10  1  0  0  0  0
  9 23  1  0  0  0  0
 10 11  1  0  0  0  0
 10 22  1  0  0  0  0
 10 36  1  1  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 37  1  6  0  0  0
 12 38  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 39  1  6  0  0  0
 14 40  1  0  0  0  0
 15 16  1  0  0  0  0
 15 22  1  0  0  0  0
 15 41  1  6  0  0  0
 16 17  1  0  0  0  0
 16 42  1  0  0  0  0
 16 43  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
 23 24  2  0  0  0  0
 23 44  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 45  1  0  0  0  0
 28 46  1  0  0  0  0
 28 47  1  0  0  0  0
 28 48  1  0  0  0  0
M  CHG  2  20  -1  21  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
