DR1802 -OEChem-05042004282D 39 43 0 0 0 0 0 0 0999 V2000 4.4409 -1.6836 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4718 -0.1949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1397 0.5494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1524 3.7236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8517 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6671 -1.5887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8967 3.0557 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2009 -4.7182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4968 2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4933 0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3069 -3.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5749 -1.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4409 -2.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8505 1.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1827 0.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3069 -4.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2872 3.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4915 2.1414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5749 -3.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2009 -2.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4409 -4.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5749 -4.1836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2552 4.7182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1069 -3.1628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1069 -4.2044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6579 2.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 1.0897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7204 3.4732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8025 1.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0379 -2.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1937 -2.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4409 -5.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0379 -4.4936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8719 4.6545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3189 5.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6385 4.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6427 -2.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6427 -4.5165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 3 9 2 0 0 0 0 4 7 1 0 0 0 0 4 18 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 13 2 0 0 0 0 7 19 2 0 0 0 0 8 17 1 0 0 0 0 8 26 2 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 18 2 0 0 0 0 10 19 1 0 0 0 0 11 16 1 0 0 0 0 12 14 1 0 0 0 0 12 17 2 0 0 0 0 12 21 1 0 0 0 0 14 20 2 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 22 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 23 1 0 0 0 0 20 31 1 0 0 0 0 21 25 2 0 0 0 0 21 32 1 0 0 0 0 22 23 2 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END $$$$