LKCP90 -OEChem-05032301443D 32 33 0 0 0 0 0 0 0999 V2000 3.8658 -0.0376 0.0858 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2994 0.8999 1.1186 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3134 -1.4283 0.1213 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0978 0.0046 0.0536 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9398 -0.0303 -0.2128 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7768 1.0459 -0.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8351 -1.2535 0.2132 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2106 1.2368 -0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2675 -0.9809 0.6713 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6984 -0.0055 0.0619 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 1.1005 0.5396 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 -1.1218 -0.4082 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -0.0255 0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4279 1.0906 0.5467 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4171 -1.1317 -0.4011 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3272 0.6367 -1.5007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7764 0.7573 -1.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2589 2.0091 -0.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3524 -1.8928 0.9628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8502 -1.7990 -0.7391 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2096 1.6861 0.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7298 1.9358 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8284 -1.9218 0.6785 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2691 -0.5987 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 0.1331 0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4852 1.9775 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4911 -1.9959 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9536 1.9655 0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9358 -2.0074 -0.7809 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4177 0.6608 -1.5523 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9298 -0.0071 -2.2876 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9266 1.6486 -1.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 11 26 1 0 0 0 0 12 15 2 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 M END $$$$