BH7R4W -OEChem-04012113212D 40 42 0 0 0 0 0 0 0999 V2000 5.8424 1.1568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -4.0865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 -1.0865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2242 -4.0865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -0.4987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 -4.0865 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 -2.5865 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 0.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 -0.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 0.4524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8479 1.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4411 2.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 2.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -2.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0234 2.8794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6222 3.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -3.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 -2.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6112 3.6884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 4.7065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 -3.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2045 4.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1588 -0.6903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 0.9539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0104 2.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9271 1.8282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2231 -2.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 -0.2181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 -0.9993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 -1.3974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2756 2.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0056 3.9623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 -4.7065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8951 -2.2765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2278 3.6236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9578 5.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5689 5.1036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 20 2 0 0 0 0 3 21 2 0 0 0 0 4 24 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 20 1 0 0 0 0 6 24 1 0 0 0 0 6 36 1 0 0 0 0 7 21 1 0 0 0 0 7 24 1 0 0 0 0 7 37 1 0 0 0 0 8 10 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 17 2 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 18 34 1 0 0 0 0 19 23 2 0 0 0 0 19 35 1 0 0 0 0 22 25 2 0 0 0 0 22 38 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$