424
 OpenBabel09292113373D

 59 62  0  0  1  0  0  0  0  0999 V2000
    1.1458    0.4623    0.1429 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6158    0.4048    0.2874 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1355   -0.8145    0.5703 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4291   -0.6966    0.4489 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3326   -1.7189    0.4174 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7569   -3.0236    0.1169 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6556   -1.4269    0.2305 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1315   -0.1347    0.0402 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1685    0.9747    0.0137 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4341    2.1501   -0.2199 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8135    0.6265    0.2217 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6184    1.3624    0.1654 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4971    2.8527    0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4098    3.3630   -1.4347 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.3916    2.7009   -2.2027 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1685    4.8918   -1.5513 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.1482    5.3082   -3.0052 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8157    5.3584   -0.9595 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2873    4.9576    0.0636 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2554    6.3287   -1.7367 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4873   -0.1429   -0.1527 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8380   -1.4131   -0.0206 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7575   -2.2519    0.1816 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8435   -3.6976    0.2939 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.7994   -4.0572    1.2910 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4404   -5.3053    0.9158 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.9590   -5.1677    1.0596 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2604   -5.1439    2.4592 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9176   -4.9721    2.9251 P   0  0  0  0  0  0  0  0  0  0  0  0
   13.1313   -6.3395    2.2332 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8974   -3.6493    2.1258 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.5748   -4.8003    3.3909 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.9594   -5.6539   -0.5035 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.9907   -6.7374   -0.5256 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2192   -4.4145   -0.9999 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0601   -4.7843   -1.7736 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7536   -0.5597    0.0539 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8528    0.9744   -0.7733 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6708    0.9331    1.0041 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6749   -2.9879   -0.0590 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9007   -3.7180    0.9485 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1803   -3.4213   -0.8077 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3143    3.3616    0.5437 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5860    3.1186    0.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3570    3.1278   -1.9355 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6197    2.5947   -1.6198 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9575    5.4563   -1.0439 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5649    4.5968   -3.4770 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0793    5.1022   -3.3838 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8643    6.4219   -2.5148 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8568   -1.7958   -0.0713 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8962   -4.0685    0.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0916   -6.0594    1.6313 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2808   -4.2395    0.5792 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4537   -6.0199    0.5857 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7634   -5.9448   -1.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7289   -6.9257    0.3940 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8626   -3.8019   -1.6367 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0299   -5.7663   -1.7192 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  1 39  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  2  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 40  1  0  0  0  0
  6 41  1  0  0  0  0
  6 42  1  0  0  0  0
  7  8  2  0  0  0  0
  7 23  1  0  0  0  0
  8  9  1  0  0  0  0
  8 21  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 43  1  0  0  0  0
 13 44  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 45  1  0  0  0  0
 15 46  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 47  1  0  0  0  0
 17 48  1  0  0  0  0
 17 49  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 20 50  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 51  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 35  1  0  0  0  0
 24 52  1  1  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 33  1  0  0  0  0
 26 53  1  1  0  0  0
 27 28  1  0  0  0  0
 27 54  1  0  0  0  0
 27 55  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 33 56  1  6  0  0  0
 34 57  1  0  0  0  0
 35 36  1  0  0  0  0
 35 58  1  6  0  0  0
 36 59  1  0  0  0  0
M  CHG  2  31  -1  32  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
