BD5AK1 -OEChem-04012117222D 55 57 0 1 0 0 0 0 0999 V2000 6.0622 3.4506 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 4.9506 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.6395 3.9214 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9058 9.9519 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 8.6421 5.6633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 6.9506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 6.9506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8694 4.4601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 1.5639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 7.9506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.9506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 4.9506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6421 3.2379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 4.9506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0534 1.8208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 6.4506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0566 2.4121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.4506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8292 2.5947 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 3.9506 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9365 3.9464 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9365 4.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 5.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 4.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 3.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 5.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 6.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6086 3.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3142 2.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2807 3.0430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6410 3.9758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 3.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 6.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 6.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8963 2.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8262 0.5985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1465 3.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6975 3.3744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5856 4.0582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9841 3.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4804 2.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 5.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9316 5.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 7.5706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3044 4.4965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3291 5.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 3.9506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 3.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3521 3.9506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2276 0.7602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6645 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4247 0.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3118 2.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9249 1.9821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 30 1 0 0 0 0 3 32 1 0 0 0 0 3 36 1 0 0 0 0 5 22 2 0 0 0 0 6 27 1 0 0 0 0 6 45 1 0 0 0 0 7 27 2 0 0 0 0 8 28 2 0 0 0 0 9 15 1 0 0 0 0 9 37 1 0 0 0 0 10 34 2 0 0 0 0 11 35 2 0 0 0 0 12 20 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 21 13 1 1 0 0 0 13 28 1 0 0 0 0 13 42 1 0 0 0 0 14 18 1 0 0 0 0 14 30 1 0 0 0 0 14 33 1 0 0 0 0 15 29 2 0 0 0 0 16 30 2 0 0 0 0 16 34 1 0 0 0 0 17 31 1 0 0 0 0 17 36 2 0 0 0 0 18 35 1 0 0 0 0 18 47 1 0 0 0 0 19 36 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 6 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 28 29 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 32 46 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 34 35 1 0 0 0 0 37 51 1 0 0 0 0 37 52 1 0 0 0 0 37 53 1 0 0 0 0 M CHG 1 4 1 M END $$$$