BJ3IW6 -OEChem-04022108363D 27 28 0 0 0 0 0 0 0999 V2000 4.4029 0.2208 -0.0588 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6618 -0.1547 0.2398 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3335 -0.3309 0.4264 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2957 0.3492 -0.4085 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1542 1.1035 -0.2848 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5798 -0.9777 0.9993 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5087 0.8974 -0.9496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9121 -1.0839 0.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6775 0.1715 -0.2226 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3721 1.0149 0.6387 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3399 -0.8462 -0.9015 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7434 0.8386 0.8231 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7112 -1.0225 -0.7172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -0.1801 0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 1.7821 0.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4843 1.5651 -1.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1436 -1.9694 1.1562 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7156 -0.4907 1.9716 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4152 0.3161 -1.8749 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9546 1.8637 -1.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6536 -1.5742 0.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8183 -1.6744 -0.6488 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8584 1.8116 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8011 -1.5064 -1.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2899 1.4946 1.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2327 -1.8155 -1.2451 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4808 -0.3173 0.2887 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 11 13 2 0 0 0 0 11 24 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 M END $$$$