Mrv1652304062013382D          

 18 17  0  0  0  0            999 V2000
 2507.0263 2505.5982    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 2506.3102 2505.1849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 2505.5961 2505.5982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2504.8821 2505.1849    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
 2504.1680 2505.5982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2503.4539 2505.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2502.7399 2505.5982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2502.0258 2505.1849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 2502.7399 2506.4228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 2504.8821 2504.3605    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 2505.5961 2506.4228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 2507.7404 2505.1849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2508.4544 2505.5982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2509.1685 2505.1849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 2508.4544 2506.4228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 2507.0263 2506.4228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 2507.7404 2506.8339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 2506.3102 2506.8339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 16  1  6  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  2  0  0  0  0
  4  5  1  0  0  0  0
  4 10  1  1  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
M  END