403
 OpenBabel09292113343D

 47 48  0  0  1  0  0  0  0  0999 V2000
    1.0156    0.0785   -0.1117 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2418    0.0491   -0.1705 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9714    1.2053   -0.1283 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3295    1.3263   -0.3014 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9354    2.8926   -0.3160 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.0254    0.1308   -0.4734 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4925    0.1063   -0.6563 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.8944   -0.9947   -1.4978 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0282   -1.6649   -0.8824 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.6376   -2.9749   -0.2026 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1891   -3.9252   -1.1730 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7903   -5.4808   -0.5296 P   0  0  0  0  0  0  0  0  0  0  0  0
    8.2540   -5.5446   -0.0434 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6808   -4.7389    0.2589 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.3916   -7.0364    0.1138 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.5721   -0.6614    0.1339 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.3743    0.3639   -0.5096 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3072    0.0158    0.6453 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.6239    1.2903    1.2173 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3472   -1.0856   -0.4356 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0211   -1.1998   -0.3043 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2548   -2.4889   -0.2685 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8785   -3.6568    0.3361 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2978   -3.5058    1.7332 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1360   -3.3717    2.6936 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6862   -3.0937    4.3677 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.4883   -1.8912    4.4285 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5563   -3.2785    5.2579 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6812   -4.3510    4.5641 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4418    2.0568   -0.0272 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7808    1.0071   -1.2075 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7433   -1.8660   -1.6871 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8588   -2.7976    0.5427 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5258   -3.3522    0.3142 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1832   -1.0941    0.9309 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2730    0.2377   -1.4720 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7966   -0.5902    1.4010 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4008    1.6037    0.7095 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9497   -1.9898   -0.5411 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9949   -2.7448   -1.3036 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2877   -2.3409    0.2266 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7418   -3.9643   -0.1633 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0069   -2.6784    1.8477 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8530   -4.4112    1.9996 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5098   -4.2690    2.6909 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5071   -2.5086    2.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5360   -4.2111    4.0924 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 21  1  0  0  0  0
  3  4  1  0  0  0  0
  3 30  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 20  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  7 31  1  6  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 16  1  0  0  0  0
  9 32  1  6  0  0  0
 10 11  1  0  0  0  0
 10 33  1  0  0  0  0
 10 34  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 35  1  1  0  0  0
 17 36  1  0  0  0  0
 18 19  1  0  0  0  0
 18 37  1  1  0  0  0
 19 38  1  0  0  0  0
 20 21  2  0  0  0  0
 20 39  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 40  1  0  0  0  0
 22 41  1  0  0  0  0
 23 24  1  0  0  0  0
 23 42  1  0  0  0  0
 24 25  1  0  0  0  0
 24 43  1  0  0  0  0
 24 44  1  0  0  0  0
 25 26  1  0  0  0  0
 25 45  1  0  0  0  0
 25 46  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  2  0  0  0  0
 26 29  1  0  0  0  0
 29 47  1  0  0  0  0
M  CHG  2  14  -1  15  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
