HMDB0253648
     RDKit          3D
Isoindoline
 18 19  0  0  0  0  0  0  0  0999 V2000
    2.1486    1.0087    0.2152 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3002   -0.3309   -0.0831 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2252   -1.1699   -0.3054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0623   -0.6814   -0.2341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2507    0.6502    0.0609 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8538    1.4827    0.2829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7116    0.8608    0.0556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2209   -0.4247    0.4772 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4267   -1.3025   -0.4074 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9831    1.6774    0.3919 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3150   -0.7020   -0.1362 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3603   -2.2292   -0.5408 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6914    2.5206    0.5126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0443    1.0181   -1.0051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0374    1.6936    0.7031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8318   -0.6056    1.4505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8220   -1.1456   -1.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4699   -2.3202   -0.0284 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  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  6  1  1  0
  9  4  1  0
  1 10  1  0
  2 11  1  0
  3 12  1  0
  6 13  1  0
  7 14  1  0
  7 15  1  0
  8 16  1  0
  9 17  1  0
  9 18  1  0
M  END