422
 OpenBabel09292113353D

 69 72  0  0  1  0  0  0  0  0999 V2000
   11.1322   -5.3584   -2.8812 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4319   -4.5712   -1.9194 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0863   -4.7151   -1.9514 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4693   -5.4375   -2.7195 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5368   -3.9321   -0.9833 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0944   -3.7147   -0.9054 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.5374   -4.7575    0.0679 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4631   -4.6233    1.2839 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2264   -5.9189   -0.5762 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8991   -6.9911    0.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6820   -2.2706   -0.4959 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.1913   -1.7822    0.8792 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6686   -0.4185    1.2528 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5257   -0.0403    1.9294 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4927   -0.9286    2.5350 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4291    1.3407    1.9914 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5105    1.8326    1.3936 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9147    3.1397    1.1637 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0384    4.2075    1.6060 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1202    3.3813    0.5014 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9278    2.3391    0.0818 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5527    0.9726    0.3409 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2379    0.0047    0.0114 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3201    0.7700    0.9658 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0341    2.7419   -0.5745 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9640    4.0530   -0.5346 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8257    4.5099    0.1065 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6021    5.9415    0.2626 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1372    6.6492   -0.8954 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8980    7.8107   -0.4599 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.4251    7.6851   -0.5500 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9880    7.6094   -1.8502 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6556    7.5789   -1.7502 P   0  0  0  0  0  0  0  0  0  0  0  0
   13.9778    8.9071   -1.0791 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9108    6.3626   -0.8725 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.1225    7.4558   -3.1850 O   0  5  0  0  0  0  0  0  0  0  0  0
    9.5302    7.9801    1.0194 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.2812    8.6886    1.2053 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2835    6.5491    1.4887 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4387    6.5472    2.6482 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9787   -1.3088   -1.5405 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3686   -1.4803   -1.9502 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1758   -5.0323   -2.8911 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7206   -5.2234   -3.8866 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1008   -6.4126   -2.5893 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1642   -3.2184   -0.6327 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6575   -3.9048   -1.8950 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9303   -7.9255   -0.2584 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8880   -6.8468    0.6991 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6202   -7.0718    1.1291 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5845   -2.2653   -0.4471 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2804   -1.8162    0.9296 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8610   -2.4554    1.6721 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6737   -1.9818    2.2823 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4918   -0.6791    2.1757 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5066   -0.8543    3.6268 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1179    3.8319    2.0716 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7273    4.8252    0.7578 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5313    4.8370    2.3504 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7154    4.7219   -0.9550 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5212    6.1090    0.2630 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5612    8.6528   -1.0767 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7460    6.8094    0.0146 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8360    8.5863   -0.0812 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2868    8.4968    1.6194 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0267    9.0479    0.3360 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2209    6.0370    1.7312 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0309    7.4402    2.6500 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7072   -0.6039   -1.6625 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 43  1  0  0  0  0
  1 44  1  0  0  0  0
  1 45  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 46  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  1  0  0  0  0
  6 47  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 48  1  0  0  0  0
 10 49  1  0  0  0  0
 10 50  1  0  0  0  0
 11 12  1  0  0  0  0
 11 41  1  0  0  0  0
 11 51  1  0  0  0  0
 12 13  1  0  0  0  0
 12 52  1  0  0  0  0
 12 53  1  0  0  0  0
 13 14  2  0  0  0  0
 13 24  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 54  1  0  0  0  0
 15 55  1  0  0  0  0
 15 56  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 24  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 57  1  0  0  0  0
 19 58  1  0  0  0  0
 19 59  1  0  0  0  0
 20 21  2  0  0  0  0
 20 27  1  0  0  0  0
 21 22  1  0  0  0  0
 21 25  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 60  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 39  1  0  0  0  0
 28 61  1  1  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 37  1  0  0  0  0
 30 62  1  6  0  0  0
 31 32  1  0  0  0  0
 31 63  1  0  0  0  0
 31 64  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
 33 36  1  0  0  0  0
 37 38  1  0  0  0  0
 37 39  1  0  0  0  0
 37 65  1  1  0  0  0
 38 66  1  0  0  0  0
 39 40  1  0  0  0  0
 39 67  1  1  0  0  0
 40 68  1  0  0  0  0
 41 42  1  0  0  0  0
 42 69  1  0  0  0  0
M  CHG  2  35  -1  36  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
