HMDB0246213
     RDKit          3D
Alanyl-D-alanine
 23 22  0  0  0  0  0  0  0  0999 V2000
   -2.9508   -0.5311   -0.1653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8886    0.4954    0.2266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8972    1.6118   -0.6697 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5576   -0.1503    0.3448 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4327   -1.1694    1.2802 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4403    0.1907   -0.3623 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7250   -0.4664   -0.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5596   -0.3580   -1.4513 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4364    0.0377    0.9926 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5717   -0.4071    1.2984 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8927    1.0007    1.8200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6276   -1.1038   -1.0602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1105   -1.2397    0.6588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8634    0.0495   -0.3987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2033    0.8723    1.2306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8620    1.6412   -1.1109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7751    2.5014   -0.1388 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7865   -2.0851    1.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5068   -1.5474   -0.0512 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9014   -0.3365   -2.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2525    0.4965   -1.4523 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1993   -1.2794   -1.5760 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4696    1.7769    2.1378 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  1  0
  4  6  2  3
  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  0
  3 16  1  0
  3 17  1  0
  5 18  1  0
  7 19  1  0
  8 20  1  0
  8 21  1  0
  8 22  1  0
 11 23  1  0
M  END