D08MCE -OEChem-10101305022D 38 40 0 0 0 0 0 0 0999 V2000 4.9889 2.1767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.4214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.3833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -2.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -2.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 -0.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 -1.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 -0.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 0.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6793 -1.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3695 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -0.9726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -2.7136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 0.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 -2.7136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 0.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8819 -1.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 10 1 0 0 0 0 3 9 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 11 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 12 30 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 14 18 1 0 0 0 0 14 32 1 0 0 0 0 15 19 2 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 M END $$$$