EXO0583 -OEChem-04222009363D 39 40 0 0 0 0 0 0 0999 V2000 -2.0481 3.0853 0.2130 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9457 0.4995 0.5562 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9285 4.4206 -0.3425 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3528 2.5034 0.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7088 -4.0866 -0.2935 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7388 -4.1624 0.6722 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0629 2.0215 -0.7149 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6581 -3.5263 0.1023 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1693 0.0360 -0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8511 1.1758 -0.7606 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0635 -0.5189 1.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 0.7556 -1.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4276 -0.9394 0.5652 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 0.1987 -0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2005 -0.1156 0.1275 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2034 0.6149 -0.5022 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3453 -1.4848 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3627 -0.0298 -0.9334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5046 -2.1294 -0.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5133 -1.4019 -0.7331 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1523 3.0836 1.7499 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9877 -0.7684 -0.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 2.0441 -0.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2104 1.5109 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 -1.3704 1.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1901 0.2397 1.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7055 1.6138 -1.7714 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0817 -0.0055 -2.0772 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3068 -1.8012 -0.1026 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0667 -1.2643 1.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0504 -0.1572 -0.6234 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3611 1.0027 0.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4441 -2.0341 0.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1518 0.5201 -1.4398 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0872 2.3254 -0.8346 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4285 -1.8712 -1.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1835 2.0838 2.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1248 3.4014 1.5636 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6407 3.7918 2.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 21 1 0 0 0 0 2 9 1 0 0 0 0 2 15 1 0 0 0 0 5 8 1 0 0 0 0 6 8 2 0 0 0 0 7 16 1 0 0 0 0 7 35 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M CHG 2 5 -1 8 1 M END $$$$