B3R9IY -OEChem-04022107342D 29 30 0 0 0 0 0 0 0999 V2000 3.2320 1.2204 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 0.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 2.0295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0009 3.7520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4186 3.0475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4131 2.9430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3334 0.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -4.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -4.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7487 4.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6175 3.6872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1664 3.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0542 2.5459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 11 1 0 0 0 0 2 16 1 0 0 0 0 3 8 1 0 0 0 0 3 15 2 0 0 0 0 4 15 1 0 0 0 0 4 17 2 0 0 0 0 5 17 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 17 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 14 2 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 10 12 2 0 0 0 0 10 19 1 0 0 0 0 11 13 2 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 14 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 M END $$$$