L3BY5U -OEChem-05022321452D 53 57 0 1 0 0 0 0 0999 V2000 3.0908 1.7584 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.2157 0.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 -0.4323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6173 2.9826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 1.2998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2157 2.4232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6398 -0.3033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5258 -0.2277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 1.2998 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3069 2.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3069 2.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8069 1.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3069 0.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3069 0.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2408 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2408 2.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8351 1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9976 1.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9976 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4382 3.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8915 2.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8915 0.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7976 1.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7976 0.7789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6617 0.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4771 1.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8895 2.3778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1993 2.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4146 2.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7243 2.3778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6364 0.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2408 -0.2212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0427 3.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5762 4.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8338 3.5361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8843 2.9544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8843 -0.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3333 2.1326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 16 1 0 0 0 0 2 20 1 0 0 0 0 3 15 2 0 0 0 0 4 17 2 0 0 0 0 10 5 1 6 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 21 1 0 0 0 0 8 14 2 0 0 0 0 9 33 3 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 24 1 0 0 0 0 21 25 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 22 45 1 0 0 0 0 23 26 2 0 0 0 0 23 46 1 0 0 0 0 24 27 2 0 0 0 0 24 47 1 0 0 0 0 25 28 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 33 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 31 2 0 0 0 0 29 50 1 0 0 0 0 30 32 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$