BL09ID -OEChem-04012117082D 42 44 0 0 0 0 0 0 0999 V2000 6.3301 -1.2673 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7327 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0785 2.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 1.2602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8564 2.7568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 -0.3020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0785 -1.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 1.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9387 -1.8119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 1.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4692 -1.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8598 -1.8820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 -0.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6225 -2.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4720 -2.1281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2549 -1.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -2.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -2.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.7696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2639 1.5723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 2 18 1 0 0 0 0 3 14 2 0 0 0 0 4 24 1 0 0 0 0 4 42 1 0 0 0 0 5 24 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 22 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 14 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 10 18 2 0 0 0 0 12 19 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 16 2 0 0 0 0 13 29 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 30 1 0 0 0 0 16 24 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 M END $$$$