D08HES 01210517072D 1 1.00000 0.00000 0 46 48 0 1 0 999 V2000 3.9667 -3.5417 0.0000 N 0 0 3 0 0 0 0 0 0 4.5792 -3.9000 0.0000 C 0 0 0 0 0 0 0 0 0 3.2542 -3.5417 0.0000 C 0 0 0 0 0 0 0 0 0 3.2542 -2.8292 0.0000 C 0 0 2 0 0 0 0 0 0 3.9667 -2.8292 0.0000 C 0 0 1 0 0 0 0 0 0 5.1917 -3.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0.7792 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 1.4000 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0.2042 -2.4125 0.0000 N 0 0 0 0 0 0 0 0 0 2.6375 -2.4750 0.0000 N 0 0 0 0 0 0 0 0 0 2.0167 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 4.5792 -2.4750 0.0000 S 0 0 0 0 0 0 0 0 0 -0.3708 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 5.8167 -3.8917 0.0000 S 0 0 0 0 0 0 0 0 0 4.5792 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0.5625 -3.5125 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1458 -3.5125 0.0000 S 0 0 0 0 0 0 0 0 0 5.1792 -1.4167 0.0000 C 0 0 0 0 0 0 0 0 0 9.5125 -2.4667 0.0000 C 0 0 0 0 0 0 0 0 0 6.4250 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 6.4292 -3.5417 0.0000 C 0 0 0 0 0 0 0 0 0 5.1917 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 1.4000 -1.7625 0.0000 N 0 0 0 0 0 0 0 0 0 2.7500 -4.0500 0.0000 O 0 0 0 0 0 0 0 0 0 5.8042 -1.7667 0.0000 S 0 0 0 0 0 0 0 0 0 9.5042 -1.7542 0.0000 N 0 0 0 0 0 0 0 0 0 5.1792 -0.7042 0.0000 N 0 0 0 0 0 0 0 0 0 8.8917 -2.8292 0.0000 S 0 0 0 0 0 0 0 0 0 2.0167 -3.5417 0.0000 O 0 0 0 0 0 0 0 0 0 9.6000 -4.5167 0.0000 C 0 0 0 0 0 0 0 0 0 5.8042 -2.4792 0.0000 C 0 0 0 0 0 0 0 0 0 7.0417 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 3.9667 -4.9667 0.0000 O 0 0 0 0 0 0 0 0 0 9.6000 -3.8042 0.0000 O 0 0 0 0 0 0 0 0 0 7.0417 -3.9000 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9875 -2.4750 0.0000 N 0 0 0 0 0 0 0 0 0 4.5667 -1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 10.1292 -2.8292 0.0000 N 0 0 0 0 0 0 0 0 0 7.6625 -2.8292 0.0000 C 0 0 0 0 0 0 0 0 0 5.2000 -4.9667 0.0000 O 0 0 0 0 0 0 0 0 0 8.2792 -2.4667 0.0000 C 0 0 0 0 0 0 0 0 0 2.0167 -1.4042 0.0000 O 0 0 0 0 0 0 0 0 0 10.2167 -4.8750 0.0000 O 0 0 0 0 0 0 0 0 0 7.6625 -3.5417 0.0000 C 0 0 0 0 0 0 0 0 0 8.9792 -4.8750 0.0000 C 0 0 0 0 0 0 0 0 0 3.9667 -2.1167 0.0000 H 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 1 1 0 0 0 4 3 1 0 0 0 5 1 1 0 0 0 6 2 2 0 0 0 7 8 1 0 0 0 8 11 1 0 0 0 9 7 1 0 0 0 4 10 1 1 0 0 11 10 1 0 0 0 12 5 1 0 0 0 13 9 2 0 0 0 14 6 1 0 0 0 15 2 1 0 0 0 16 7 2 0 0 0 17 16 1 0 0 0 18 25 1 0 0 0 19 28 1 0 0 0 20 21 1 0 0 0 21 14 1 0 0 0 22 6 1 0 0 0 23 8 2 0 0 0 24 3 2 0 0 0 25 31 1 0 0 0 26 19 2 0 0 0 27 18 2 0 0 0 28 41 1 0 0 0 29 11 2 0 0 0 31 20 1 0 0 0 32 20 2 0 0 0 33 15 2 0 0 0 34 30 2 0 0 0 35 21 2 0 0 0 36 13 1 0 0 0 37 18 1 0 0 0 38 19 1 0 0 0 39 44 2 0 0 0 40 15 1 0 0 0 41 39 1 0 0 0 42 23 1 0 0 0 43 30 1 0 0 0 44 35 1 0 0 0 45 30 1 0 0 0 5 46 1 6 0 0 5 4 1 0 0 0 12 22 1 0 0 0 32 39 1 0 0 0 17 13 1 0 0 0 M END $$$$