BV3A5M -OEChem-04012115472D 30 32 0 0 0 0 0 0 0999 V2000 3.8366 1.9513 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8851 2.4341 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.4282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0433 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.2931 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2215 3.0727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5433 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7160 4.0433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 2.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 3.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7987 2.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6941 3.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9313 1.2283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3356 2.5308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1549 4.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 13 2 0 0 0 0 4 8 1 0 0 0 0 5 8 2 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 6 26 1 0 0 0 0 7 16 2 0 0 0 0 7 20 1 0 0 0 0 8 17 1 0 0 0 0 9 20 2 0 0 0 0 9 22 1 0 0 0 0 10 12 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 23 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 19 2 0 0 0 0 15 25 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 M CHG 2 4 -1 8 1 M END $$$$