NIST 24032811332D 1 1.00000 0.00000 NIST Chemistry WebBook 42 42 0 0 0 1 V2000 16.5000 4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 1.0000 15.5885 0.0000 C 0 0 0 0 0 0 0 0 0 16.0000 5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 15.0000 5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 14.5000 6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 13.5000 6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 13.0000 6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 12.0000 6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 11.5000 7.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 10.5000 7.7942 0.0000 C 0 0 0 0 0 0 0 0 0 10.0000 8.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 9.0000 8.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 7.7942 0.0000 C 0 0 0 0 0 0 0 0 0 8.5000 9.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 8.6603 0.0000 C 0 0 0 0 0 0 0 0 0 7.5000 9.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 9.5263 0.0000 C 0 0 0 0 0 0 0 0 0 7.0000 10.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 10.3923 0.0000 C 0 0 0 0 0 0 0 0 0 6.0000 10.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0.5000 11.2583 0.0000 C 0 0 0 2 0 0 0 0 0 5.5000 11.2583 0.0000 C 0 0 0 0 0 0 0 0 0 1.0000 12.1244 0.0000 C 0 0 0 2 0 0 0 0 0 4.5000 11.2583 0.0000 C 0 0 0 0 0 0 0 0 0 3.0000 13.8564 0.0000 C 0 0 0 0 0 0 0 0 0 2.5000 12.9904 0.0000 C 0 0 0 2 0 0 0 0 0 1.5000 12.9904 0.0000 C 0 0 0 2 0 0 0 0 0 4.0000 12.1244 0.0000 C 0 0 0 0 0 0 0 0 0 1.5000 14.7224 0.0000 B 0 0 0 0 0 0 0 0 0 3.0000 12.1244 0.0000 N 0 0 0 0 0 0 0 0 0 4.5000 12.9904 0.0000 O 0 0 0 0 0 0 0 0 0 2.5000 14.7224 0.0000 O 0 0 0 0 0 0 0 0 0 1.0000 13.8564 0.0000 O 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 3 38 1 0 0 0 4 6 1 0 0 0 5 7 1 0 0 0 6 8 1 0 0 0 7 9 1 0 0 0 8 10 1 0 0 0 9 11 1 0 0 0 10 12 1 0 0 0 11 13 1 0 0 0 12 14 1 0 0 0 13 15 1 0 0 0 14 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 17 20 1 0 0 0 18 19 1 0 0 0 19 21 1 0 0 0 20 22 1 0 0 0 21 23 1 0 0 0 22 24 1 0 0 0 23 25 1 0 0 0 24 26 1 0 0 0 25 27 1 0 0 0 26 28 1 0 0 0 27 29 1 0 0 0 28 30 1 0 0 0 29 31 1 0 0 0 30 32 2 3 0 0 31 33 1 0 0 0 32 36 1 0 0 0 33 37 1 0 0 0 34 35 1 4 0 0 41 34 1 0 0 0 35 36 1 0 0 0 35 39 1 0 0 0 36 42 1 4 0 0 37 39 2 0 0 0 37 40 1 0 0 0 38 41 1 0 0 0 42 38 1 0 0 0 M END