EXO0237 -OEChem-04222009272D 59 62 0 1 0 0 0 0 0999 V2000 6.3301 1.0381 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9075 1.5090 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9101 3.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.5381 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.1962 4.5381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1373 2.0476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0270 -1.3002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2111 -3.9396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 -3.4879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9101 0.8254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5381 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.3214 -0.5917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3245 -0.0004 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0971 0.1822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5381 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2044 1.5340 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2044 2.5423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8765 1.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5822 0.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5486 0.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7662 -2.2656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9089 1.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7316 -2.5264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8008 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5054 -3.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1643 0.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3554 0.9389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9654 0.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 1.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.9555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7484 0.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 3.5131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 3.5131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.2281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5723 2.0840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5699 -3.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3302 -2.6881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8933 -1.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9625 -1.4063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2023 -1.8431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6392 -2.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5798 0.5714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1929 -0.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0494 -4.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 21 1 0 0 0 0 2 33 1 0 0 0 0 2 37 1 0 0 0 0 3 18 2 0 0 0 0 4 23 1 0 0 0 0 5 23 2 0 0 0 0 6 24 2 0 0 0 0 7 13 1 0 0 0 0 7 32 1 0 0 0 0 8 36 1 0 0 0 0 8 59 1 0 0 0 0 9 36 2 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 17 1 0 0 0 0 11 24 1 0 0 0 0 11 42 1 0 0 0 0 12 22 1 0 0 0 0 12 26 2 0 0 0 0 12 27 1 0 0 0 0 13 25 2 3 0 0 0 14 28 1 0 0 0 0 14 37 2 0 0 0 0 15 37 1 0 0 0 0 15 57 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 25 28 1 0 0 0 0 26 29 1 0 0 0 0 26 45 1 0 0 0 0 27 30 2 0 0 0 0 27 46 1 0 0 0 0 28 33 2 0 0 0 0 29 31 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 32 36 1 0 0 0 0 33 50 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 35 55 1 0 0 0 0 35 56 1 0 0 0 0 M CHG 2 4 -1 12 1 M END $$$$