LAY51Q -OEChem-05022322503D 42 44 0 1 0 0 0 0 0999 V2000 2.0423 -0.0213 0.9153 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5872 -3.9835 0.4365 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.2201 -2.3755 0.3901 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1634 -0.0537 -2.4803 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2297 -4.3878 1.8637 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6965 -4.6166 -0.6285 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.0802 -4.0504 0.1291 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6233 -0.1183 -0.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0278 -0.2000 -0.6308 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8830 0.4608 0.4616 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4358 -1.6618 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 1.9696 0.3944 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4205 -0.0480 -1.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 0.0051 -0.7659 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9022 2.6891 1.0994 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8173 2.6434 -0.3726 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0988 0.1103 -0.6467 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9327 0.0761 -1.4829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 0.0628 0.7073 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8877 4.0826 1.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8029 4.0368 -0.4348 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4721 0.1812 -0.9838 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8381 4.7564 0.2703 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7315 0.0845 1.7195 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4461 0.2031 0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 0.1551 1.3548 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1837 0.3153 -1.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5648 0.1382 1.4621 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9271 0.1326 0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8376 -2.1249 -1.6141 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4921 -1.7332 -1.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3677 -0.1690 0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1568 2.1766 1.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5726 2.0941 -0.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9677 0.1027 -2.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1365 4.6429 1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5425 4.5615 -1.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7766 0.2194 -2.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4521 0.0472 2.7686 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8268 5.8413 0.2218 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4966 0.2578 -0.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 0.1724 2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 7 2 0 0 0 0 3 11 1 0 0 0 0 4 13 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 18 2 0 0 0 0 15 20 1 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 2 0 0 0 0 18 35 1 0 0 0 0 19 24 2 0 0 0 0 20 23 2 0 0 0 0 20 36 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 25 1 0 0 0 0 22 38 1 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 2 5 -1 6 -1 M END $$$$