HMDB0001874
     RDKit          3D
D-threo-Isocitric acid
 21 20  0  0  0  0  0  0  0  0999 V2000
   -0.1530   -2.4846    0.7083 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8711   -1.8882   -0.1290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5097   -2.7156   -1.0680 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1178   -0.4589   -0.2410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2690    0.4495    0.5756 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8482    1.8366    0.2967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1265    2.7085   -0.2059 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1602    2.1329    0.5949 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1589    0.6144    0.0589 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.7366    1.4879    1.0307 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9757   -0.5604   -0.0481 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8280   -0.8524    0.8189 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8438   -1.4099   -1.1338 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4945   -2.6170   -1.2907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2128   -0.2929   -0.0202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9796   -0.1634   -1.3188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3209    0.3206    1.6550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3531    2.4106    1.5656 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0783    1.1728   -0.9035 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1864    2.2494    0.5793 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6087   -1.9399   -1.5250 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  5  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  2  0
 11 13  1  0
  3 14  1  0
  4 15  1  0
  4 16  1  0
  5 17  1  1
  8 18  1  0
  9 19  1  6
 10 20  1  0
 13 21  1  0
M  END