HMDB0003459
     RDKit          3D
D-Alanyl-D-alanine
 23 22  0  0  0  0  0  0  0  0999 V2000
   -2.9646    1.0402    0.3188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1207   -0.2162    0.4598 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2844   -1.0523   -0.7139 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7134    0.1702    0.6780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4372    0.8896    1.6550 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3230   -0.2567   -0.1937 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7052    0.0939   -0.0211 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.2226    0.8557   -1.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5436   -1.1353    0.1189 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9827   -2.2607    0.0728 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8996   -1.1007    0.2959 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4885    1.7833   -0.3391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0557    1.5014    1.3305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9695    0.7408   -0.0779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5020   -0.7360    1.3812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1603   -0.7441   -1.2289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4131   -2.0460   -0.4259 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0710   -0.8545   -0.9999 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7783    0.7291    0.8836 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2889    1.1091   -0.9906 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6315    1.7596   -1.4269 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2582    0.1777   -2.1017 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4050   -0.4481    0.8697 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  1
  3 16  1  0
  3 17  1  0
  6 18  1  0
  7 19  1  1
  8 20  1  0
  8 21  1  0
  8 22  1  0
 11 23  1  0
M  END