LGE42X -OEChem-05032300053D 51 55 0 0 0 0 0 0 0999 V2000 -4.8073 -1.1774 -0.1118 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.0192 -0.3026 -0.3044 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2469 -2.0475 0.3203 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3476 1.9988 1.2253 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3901 -1.3086 -1.9416 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2238 -0.0133 -0.2799 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2749 1.3574 -0.0232 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1882 0.3001 0.4361 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1629 0.0225 -0.0559 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0859 0.8980 -1.9321 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0929 1.1712 -0.3002 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8466 -1.2362 0.2383 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4250 0.8212 -0.9537 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1924 -1.4576 -0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8458 0.1812 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4529 -0.1261 0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9021 1.1977 0.0975 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -0.4494 0.1826 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 0.5936 0.3234 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9523 2.2327 0.2405 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5949 1.9179 0.3521 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0657 -0.9203 0.7489 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 -0.9072 0.8606 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -0.9457 0.5393 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8017 -0.9591 0.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4243 -1.9791 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3162 0.1259 1.2869 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0336 -1.9918 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9253 0.1132 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4711 1.3124 0.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5292 -0.2381 -1.3607 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0674 1.8163 -1.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6337 1.9963 -0.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2599 1.5026 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9945 -1.1220 1.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2536 -2.1394 0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3013 0.6019 -2.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1168 1.6650 -0.8665 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7128 -2.3005 0.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0682 -1.6914 -1.5077 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8295 -1.4960 0.1528 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 3.2707 0.2642 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8772 2.7277 0.4618 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8390 -0.6390 1.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9617 -1.9053 0.6626 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7819 1.1229 0.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9955 -2.7994 -0.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8004 0.9501 1.8033 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -2.8233 -0.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3828 0.9285 1.6508 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4193 2.8539 -1.0987 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 25 2 0 0 0 0 4 30 2 0 0 0 0 5 31 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 7 15 2 0 0 0 0 7 17 1 0 0 0 0 8 19 1 0 0 0 0 8 25 1 0 0 0 0 8 46 1 0 0 0 0 9 23 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 31 1 0 0 0 0 10 32 2 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 26 2 0 0 0 0 22 27 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 26 28 1 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 32 1 0 0 0 0 32 51 1 0 0 0 0 M END $$$$