BX3D8N -OEChem-04012120122D 58 61 0 1 0 0 0 0 0999 V2000 15.9366 0.3047 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.9366 -1.3047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5202 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.2583 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5202 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 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 3.7320 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0000 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 13.2583 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6477 -0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0463 -1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7258 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5229 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8302 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8302 0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3503 -2.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 -0.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 21 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 12 1 0 0 0 0 2 27 1 0 0 0 0 3 34 1 0 0 0 0 4 19 2 0 0 0 0 5 23 2 0 0 0 0 13 8 1 1 0 0 0 8 19 1 0 0 0 0 8 42 1 0 0 0 0 9 18 1 0 0 0 0 9 21 2 0 0 0 0 10 20 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 21 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 24 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 18 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 22 25 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 48 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 55 1 0 0 0 0 31 33 2 0 0 0 0 31 56 1 0 0 0 0 32 34 2 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 M END $$$$