BS1QJ7 -OEChem-04022108562D 38 41 0 0 0 0 0 0 0999 V2000 4.6186 2.4430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4131 0.3281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1186 0.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8095 1.8552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7941 2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1186 0.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4336 0.1194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0912 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4276 1.8552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8035 0.1194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1459 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4903 -0.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1776 -1.3674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4692 -0.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8439 -2.1132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1355 -0.9592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8228 -1.9090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5312 -3.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0338 2.6593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2718 2.4214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2072 -0.4578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9636 -0.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 1.8093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 1.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6186 3.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6051 -0.4680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6278 2.6793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7519 1.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5707 -1.4940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6631 0.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7424 -0.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2359 -2.3714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9423 -2.8692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3373 -3.6519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1201 -3.2569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 1 27 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 8 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 15 32 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 M END $$$$