D0PP5M -OEChem-04152110152D 44 42 0 1 0 0 0 0 0999 V2000 2.0000 -3.1340 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -4.8660 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 -4.6340 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 -3.1340 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1340 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6340 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9641 -2.2680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6340 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2320 -4.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2320 -2.2680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6340 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 -1.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 4.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -1.0514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -1.7416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -1.7166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -1.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 4.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 5.4860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 4.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 2 0 0 0 0 4 14 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 2 0 0 0 0 5 14 1 0 0 0 0 12 20 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 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 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 40 1 0 0 0 0 25 27 2 0 0 0 0 25 41 1 0 0 0 0 26 28 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 6 1 1 2 1 3 1 6 -1 9 -1 10 -1 M END $$$$