D00PUR -OEChem-10101305032D 36 39 0 0 0 0 0 0 0999 V2000 4.6783 -2.0368 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 1.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 0.1709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 0.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -2.6350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8819 -1.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 -2.6350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 -0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1419 1.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 2.7690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 2.7690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 1.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 7 1 0 0 0 0 2 20 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 11 2 0 0 0 0 4 9 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 14 2 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 7 15 2 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 18 1 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 15 29 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 21 2 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$