LAY51Q -OEChem-05022322432D 42 44 0 1 0 0 0 0 0999 V2000 4.6783 -0.8047 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 1.7320 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7619 2.5981 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.3958 2.2320 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.1279 1.2320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.8660 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2619 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4519 -0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6793 -1.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3695 -2.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7368 -0.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7368 0.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -3.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 1.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 -3.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 -0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8819 -1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 7 2 0 0 0 0 3 11 1 0 0 0 0 4 13 2 0 0 0 0 9 8 1 1 0 0 0 8 13 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 18 2 0 0 0 0 15 20 1 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 18 35 1 0 0 0 0 19 24 2 0 0 0 0 20 23 2 0 0 0 0 20 36 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 25 1 0 0 0 0 22 38 1 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 2 5 -1 6 -1 M END $$$$