BE1O5D -OEChem-04012119382D 50 50 0 1 0 0 0 0 0999 V2000 3.7320 -1.1550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0622 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.1550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 0.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 0.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -0.6299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -0.6299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 0.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 2.7373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 3.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 4.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 16 2 0 0 0 0 3 17 2 0 0 0 0 4 19 1 0 0 0 0 4 48 1 0 0 0 0 5 19 2 0 0 0 0 6 26 1 0 0 0 0 6 50 1 0 0 0 0 7 26 2 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 8 35 1 0 0 0 0 9 17 1 0 0 0 0 9 21 1 0 0 0 0 9 39 1 0 0 0 0 15 10 1 1 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 16 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 36 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 26 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 25 2 0 0 0 0 23 45 1 0 0 0 0 24 27 2 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 27 49 1 0 0 0 0 M END $$$$