LJ01BZ -OEChem-05022321273D 49 51 0 0 0 0 0 0 0999 V2000 -7.0463 0.6398 -1.1987 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8003 1.3402 0.9584 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1962 -0.9899 -0.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6535 0.2689 -0.0674 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6752 -1.2691 -0.4007 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2191 0.4481 0.0941 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3671 -2.2209 -0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5689 1.4568 -0.1127 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 0.5874 -1.0285 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3403 0.4809 1.3714 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -1.4113 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8688 -2.7233 -1.3282 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1203 -2.8258 1.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 1.9195 1.0676 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8386 2.0257 -1.3323 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 0.7920 0.4036 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9726 0.7593 -0.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7158 0.6526 1.5262 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0901 -3.8802 -1.2961 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3419 -3.9828 1.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9465 3.0235 1.0256 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6902 3.1297 -1.3744 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1732 -4.5100 -0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2441 3.6286 -0.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9664 0.9711 0.5652 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 0.7390 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3266 0.9504 -0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1384 -0.4833 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8035 -2.1854 -0.9917 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1766 0.5678 -2.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2811 0.3730 2.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3747 -0.5210 1.5323 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5108 -1.5782 0.6894 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0936 -2.2670 1.4863 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0686 -2.2413 -2.2812 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -2.4233 2.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4578 2.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4131 1.6431 -2.2552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5655 0.8829 -1.7752 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1339 0.6737 2.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3111 -4.2906 -2.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -4.4727 2.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3772 3.4124 1.9437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9223 3.6006 -2.3251 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7796 -5.4106 -0.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9071 4.4882 -0.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 1.3092 1.5485 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6444 0.3769 -1.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0090 0.7642 -1.0565 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 49 1 0 0 0 0 2 27 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 5 11 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 12 2 0 0 0 0 7 13 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 17 1 0 0 0 0 9 30 1 0 0 0 0 10 18 2 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 19 1 0 0 0 0 12 35 1 0 0 0 0 13 20 2 0 0 0 0 13 36 1 0 0 0 0 14 21 1 0 0 0 0 14 37 1 0 0 0 0 15 22 2 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 23 2 0 0 0 0 19 41 1 0 0 0 0 20 23 1 0 0 0 0 20 42 1 0 0 0 0 21 24 2 0 0 0 0 21 43 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$