LMD3W5 -OEChem-05032302043D 55 58 0 1 0 0 0 0 0999 V2000 9.0807 0.0990 -0.9565 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4161 -1.2051 -2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2901 -0.1258 2.2149 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 -2.9146 0.8739 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2121 0.6012 0.6152 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7835 -0.3422 -0.4903 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8104 -1.4251 -0.9006 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2434 0.0802 1.8531 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9863 -0.1098 2.2391 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6508 -1.9726 0.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 0.9321 -0.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -0.2836 -0.2260 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9336 0.7637 0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1637 0.3010 1.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1062 0.9633 -0.8565 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3957 1.2539 -1.0227 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6218 0.9350 -0.7157 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7653 0.3164 1.1177 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1975 0.8044 -0.0666 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9994 1.2642 -1.1157 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0524 -0.8025 0.7686 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2396 -1.2784 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 1.8597 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8732 -0.0158 -1.4095 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 0.8828 -0.4523 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6948 -0.0362 1.9801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5936 1.8335 0.2414 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4848 -0.0419 -1.2777 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7706 -2.2750 -0.5903 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9383 0.8755 0.4367 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2256 0.8323 -0.2027 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6239 -2.6249 -0.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4213 0.8553 -0.3167 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2148 1.3248 -1.0847 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9438 1.7390 0.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6670 -0.6167 0.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3899 1.1632 -1.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5856 1.7257 -0.2332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 1.6102 -1.8381 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1484 -0.0421 1.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5445 1.6406 -2.0303 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1511 -1.1615 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5527 2.6057 0.6564 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3525 -0.7378 -2.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9771 1.0175 1.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2081 -0.4540 2.8524 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1094 2.5606 0.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9148 -0.7879 -1.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2327 -3.1948 -0.9177 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9539 1.1402 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4197 1.7865 0.7447 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9981 0.1819 1.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1392 -3.3582 -0.9418 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5041 -0.8965 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1026 0.3919 3.0164 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 30 1 0 0 0 0 2 7 1 0 0 0 0 2 54 1 0 0 0 0 3 26 1 0 0 0 0 3 55 1 0 0 0 0 4 32 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 15 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 12 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 9 14 1 0 0 0 0 10 21 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 20 2 0 0 0 0 16 39 1 0 0 0 0 17 23 2 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 41 1 0 0 0 0 21 26 1 0 0 0 0 22 29 2 0 0 0 0 22 42 1 0 0 0 0 23 27 1 0 0 0 0 23 43 1 0 0 0 0 24 28 2 0 0 0 0 24 44 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 25 33 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 33 3 0 0 0 0 32 53 1 0 0 0 0 M END $$$$