LJI84Q -OEChem-05032301112D 51 54 0 1 0 0 0 0 0999 V2000 3.5602 5.3192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -4.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.2154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -2.3494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3426 -0.9220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.4601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 3.0863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2746 1.9295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 0.4409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.2154 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6783 -2.4106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6783 -4.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8959 3.8306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -3.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 4.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 3.6243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5387 5.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2496 4.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 2.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 0.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 1.3914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 0.9790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5436 -3.7677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 -2.3144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -4.5870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 -4.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5956 -1.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5026 3.9584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7535 4.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5891 5.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 3.2967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1486 3.0491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0651 5.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3074 6.1006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7026 4.6607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 3.8807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.4054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.0254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1704 3.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3819 -4.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -5.5254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5276 1.5193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3572 0.8511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 16 1 0 0 0 0 2 48 1 0 0 0 0 3 18 1 0 0 0 0 3 49 1 0 0 0 0 4 16 2 0 0 0 0 5 25 2 0 0 0 0 11 6 1 1 0 0 0 6 25 1 0 0 0 0 6 34 1 0 0 0 0 7 15 1 0 0 0 0 7 26 1 0 0 0 0 7 47 1 0 0 0 0 8 26 2 0 0 0 0 8 29 1 0 0 0 0 9 27 1 0 0 0 0 9 28 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 1 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 15 35 1 0 0 0 0 17 23 2 0 0 0 0 17 36 1 0 0 0 0 18 24 2 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 M END $$$$