HMDB0033245
     RDKit          3D
6-(Hydroxymethyl)-2,4(1H,3H)-pteridinedione
 20 21  0  0  0  0  0  0  0  0999 V2000
   -4.5223   -0.4392   -0.3654 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2940   -0.2727   -0.0900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3467   -0.2621   -1.0642 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0515   -0.0895   -0.8043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0825   -0.0718   -1.7319 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.1080   -1.3995 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6178    0.2836   -0.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0584    0.4794    0.2347 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6170   -0.7748    0.4577 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6629    0.2713    0.8722 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6407    0.0948    0.5826 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6340    0.0770    1.5372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2869    0.2361    2.7433 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9458   -0.1051    1.2002 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3469   -0.2014   -2.7352 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0023    0.1219   -2.1607 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1891    1.1560    1.1044 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5431    1.0025   -0.6258 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9376   -1.4974    0.4041 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6893   -0.1165    1.9334 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14  2  1  0
 11  4  1  0
  5 15  1  0
  6 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
 14 20  1  0
M  END