BN6AG4 -OEChem-04022108232D 59 62 0 1 0 0 0 0 0999 V2000 5.3500 7.8432 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.3794 6.3487 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 2.6956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -6.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -6.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0234 1.4356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -2.8432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 1.1568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.4182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -4.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -4.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -4.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -3.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -3.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -1.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -5.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 2.6956 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4543 1.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -1.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -1.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 0.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -0.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -0.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1756 3.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0724 1.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 -7.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5313 -7.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 5.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 6.1408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9013 7.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5704 7.7499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4839 7.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8003 -5.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7868 -4.2355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1853 -4.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3414 -4.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -4.2355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1853 -2.7606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7868 -3.4509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -3.4509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3414 -2.7606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0448 3.2481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8879 1.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1443 1.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -1.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 -1.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 -0.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 -0.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6616 3.8514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7449 3.0587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6094 -7.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0079 -7.2355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1989 4.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2213 -7.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9944 -8.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8413 -8.3801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2846 7.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4415 8.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 2 30 1 0 0 0 0 2 33 1 0 0 0 0 3 18 1 0 0 0 0 3 26 1 0 0 0 0 4 17 1 0 0 0 0 4 27 1 0 0 0 0 5 17 2 0 0 0 0 6 26 2 0 0 0 0 7 29 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 19 1 0 0 0 0 9 22 1 0 0 0 0 9 26 1 0 0 0 0 10 25 1 0 0 0 0 10 29 1 0 0 0 0 10 54 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 6 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 23 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 M END $$$$