HMDB0060691
     RDKit          3D
Isophosphamide mustard
 22 21  0  0  0  0  0  0  0  0999 V2000
   -0.4328    2.2679    0.7463 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0806    0.9901    0.0233 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.1190    1.3263   -1.6252 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5120    0.4861    0.5038 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3306    0.0451   -0.5925 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5223   -0.6872    0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9949   -0.4438   -0.9407 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2248   -0.2193    0.5035 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3614   -0.3240   -0.3735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5252   -0.7796    0.5007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8962    0.5916    1.5699 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9954    1.6572   -1.9081 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9964    1.1712    1.1270 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7243    0.8517   -1.2238 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7324   -0.6652   -1.1922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7057   -0.3542    1.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2832   -1.7569    0.0533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8124   -1.1348    0.7484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5951    0.6649   -0.8044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1904   -1.0342   -1.2128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4131   -1.0521   -0.0839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1556   -1.6009    1.1557 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  1  0
  2  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
  3 12  1  0
  4 13  1  0
  5 14  1  0
  5 15  1  0
  6 16  1  0
  6 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
 10 21  1  0
 10 22  1  0
M  END