HMDB03873.mol
  Mrv0541 02231219482D          

 36 39  0  0  0  0            999 V2000
   -3.7058   -1.7539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7058   -2.5789    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.9913   -2.9914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2769   -2.5789    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2769   -1.7539    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.9913   -1.3414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5624   -2.9914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8479   -2.5789    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8479   -1.7539    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.5624   -1.3414    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1334   -1.3414    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.1334   -0.5164    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8479   -0.1039    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.5624   -0.5164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6512   -1.5963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1361   -0.9289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6512   -0.2614    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2769   -0.9289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2769   -3.4039    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8479   -0.9289    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0472    0.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9061    0.5232    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.3228    1.1065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8479    0.7211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5624   -2.1664    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1334   -2.1664    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2159   -3.1092    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4203   -2.9914    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7131    0.6947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9680    1.4793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7750    1.6508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0299    2.4355    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.8369    2.6070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0504    3.4039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4203    2.0236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4466    3.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  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
 14 10  1  0  0  0  0
 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 12  1  0  0  0  0
  5 18  1  1  0  0  0
  4 19  1  1  0  0  0
  9 20  1  1  0  0  0
 12 21  1  1  0  0  0
 17 22  1  1  0  0  0
 22 23  1  6  0  0  0
 13 24  1  6  0  0  0
 10 25  1  6  0  0  0
 11 26  1  6  0  0  0
  8 27  1  6  0  0  0
  2 28  1  6  0  0  0
 22 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  2  0  0  0  0
 32 36  1  1  0  0  0
M  END