B5RUP8
  -OEChem-04042104143D

 24 26  0     0  0  0  0  0  0999 V2000
    4.6555    2.2099   -0.6910 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0436   -0.3055   -1.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7326   -0.1663   -1.2456 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6717    0.3238   -0.5074 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1661   -1.2439   -0.5305 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5756    1.7556    0.6729 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7625    0.6451    0.5792 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7192    1.5553    0.0270 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0095   -0.9360    0.7104 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3702   -1.2938    1.2101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5276    0.3208    1.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4958   -0.3079   -0.2223 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8079    0.6294    0.5361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7078   -1.8595   -0.0562 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4421   -0.6110    0.4242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9859   -1.5641   -0.5434 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7746    0.8481   -0.3399 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4667   -1.0037    2.2636 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5323   -2.3776    1.1728 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0224    1.0401    1.6169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2763   -2.8308   -0.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5442   -2.2776   -1.1383 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1337   -2.1934   -0.8749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3372    0.5931   -1.1949 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 17  2  0  0  0  0
  2  5  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 24  1  0  0  0  0
  4  8  1  0  0  0  0
  4 12  1  0  0  0  0
  5 15  1  0  0  0  0
  5 23  1  0  0  0  0
  6  8  2  0  0  0  0
  6 13  1  0  0  0  0
  7 15  2  0  0  0  0
  7 17  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 11 13  1  0  0  0  0
 11 20  1  0  0  0  0
 12 13  2  0  0  0  0
 12 16  1  0  0  0  0
 14 16  2  0  0  0  0
 14 21  1  0  0  0  0
 16 22  1  0  0  0  0
M  END

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