NIST 24032817552D 1 1.00000 0.00000 NIST Chemistry WebBook 16 17 0 0 0 1 V2000 4.4712 4.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 2.7816 0.0000 C 0 0 0 0 0 0 0 0 0 2.5032 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 3.4042 0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 1.6022 0.4339 0.0000 C 0 0 0 0 0 0 0 0 0 3.6267 1.4088 0.0000 C 0 0 0 0 0 0 0 0 0 1.3797 1.4088 0.0000 C 0 0 0 0 0 0 0 0 0 2.5032 3.7295 0.0000 C 0 0 0 0 0 0 0 0 0 4.2633 3.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0.7431 3.4507 0.0000 C 0 0 0 0 0 0 0 0 0 3.0032 2.1906 0.0000 C 0 0 0 0 0 0 0 0 0 2.0032 2.1906 0.0000 C 0 0 0 0 0 0 0 0 0 3.3122 3.1417 0.0000 C 0 0 0 0 0 0 0 0 0 1.6942 3.1417 0.0000 C 0 0 0 0 0 0 0 0 0 5.0064 2.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0.5352 4.4289 0.0000 O 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 2 10 1 0 0 0 4 3 2 0 0 0 3 5 1 0 0 0 6 4 1 0 0 0 5 7 2 0 0 0 11 6 2 0 0 0 7 12 1 0 0 0 8 13 2 0 0 0 14 8 1 0 0 0 9 13 1 0 0 0 9 15 2 0 0 0 10 14 1 0 0 0 10 16 2 0 0 0 11 12 1 0 0 0 13 11 1 0 0 0 12 14 2 0 0 0 M END