LGPT82 -OEChem-05022323533D 46 47 0 1 0 0 0 0 0999 V2000 -0.8877 0.8084 1.5596 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8506 3.3419 -1.0290 F 0 0 0 0 0 0 0 0 0 0 0 0 4.1421 3.3545 1.0208 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0709 2.4701 0.5450 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2245 -3.5997 -0.4469 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0048 -3.6426 1.0392 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0726 -1.0505 -1.5134 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0541 -1.8476 -0.0902 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5634 -1.4789 0.2123 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1988 1.1043 -1.3886 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2023 -1.8277 0.6142 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2759 -2.5788 -0.7194 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9310 -1.2344 -0.5055 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0632 -2.7623 0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -0.9658 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3018 -1.4156 -0.3621 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0664 -0.3470 -1.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3998 -0.8801 0.7596 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7668 -1.1142 -0.4986 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1392 1.2490 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6704 0.8946 -1.3758 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0038 0.3616 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1308 0.3267 -0.2847 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7849 2.5765 0.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3743 0.7820 1.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7091 2.1217 1.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 2.4007 -1.1905 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 2.9532 0.0528 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4237 -2.8593 0.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9511 -2.6935 -1.7605 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2033 -1.1518 -0.8155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3461 -1.3047 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0865 -1.0557 2.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.8137 1.1655 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7052 -0.6093 -2.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -1.5608 1.6013 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6308 -1.3197 -1.5664 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5764 -1.7568 -0.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7665 1.5724 -2.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 0.6287 1.9462 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8212 -4.4481 -0.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 1.1966 2.8431 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3138 0.1263 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9079 2.5168 2.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5759 3.0069 -2.0891 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0482 4.0006 0.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 42 1 0 0 0 0 2 24 1 0 0 0 0 3 24 1 0 0 0 0 4 24 1 0 0 0 0 5 12 1 0 0 0 0 5 41 1 0 0 0 0 6 14 2 0 0 0 0 7 16 2 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 31 1 0 0 0 0 9 16 1 0 0 0 0 9 19 1 0 0 0 0 9 34 1 0 0 0 0 10 23 1 0 0 0 0 10 27 2 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 17 21 1 0 0 0 0 17 35 1 0 0 0 0 18 22 2 0 0 0 0 18 36 1 0 0 0 0 19 23 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END $$$$