L3LQK8 -OEChem-05022323473D 42 43 0 1 0 0 0 0 0999 V2000 -4.7501 -2.6406 -0.7266 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.9528 -1.6547 -2.4863 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.8444 -0.9976 -1.6385 F 0 0 0 0 0 0 0 0 0 0 0 0 1.5084 -1.3318 0.3483 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3859 1.3960 0.1831 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9486 -0.8387 0.0772 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0776 -3.5621 0.2419 F 0 0 0 0 0 0 0 0 0 0 0 0 5.7975 -3.3187 0.1061 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6473 1.1728 0.3203 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9816 3.8830 0.0303 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1805 3.0088 1.2132 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0237 -0.2643 2.4258 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.2203 -1.4445 0.5853 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7925 1.5915 -0.5466 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6027 -0.6201 1.2998 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2660 2.8961 -0.7132 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2156 1.7112 -0.9262 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0184 2.5138 0.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8701 3.5185 -2.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0068 1.0286 -0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6783 0.1188 -0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8757 -0.4343 -0.4301 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4971 1.4017 1.1547 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4328 0.0528 0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3836 -0.0694 0.8166 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6944 0.8486 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -1.4145 -1.3036 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8409 -1.2060 0.2821 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8158 0.1833 0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6162 -0.9579 0.1438 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6413 -2.3471 0.2277 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 -2.2231 0.1586 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1047 2.0461 -1.4764 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7291 0.9239 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1693 4.3477 -1.9014 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3969 2.7977 -2.7281 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7438 3.9387 -2.5654 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4945 1.2639 -1.4619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7641 4.1444 -0.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2724 -0.1573 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0259 2.1031 1.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0582 1.1577 2.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 17 1 0 0 0 0 9 24 1 0 0 0 0 10 16 1 0 0 0 0 10 39 1 0 0 0 0 11 18 2 0 0 0 0 12 15 1 0 0 0 0 13 15 2 0 0 0 0 14 18 1 0 0 0 0 14 20 1 0 0 0 0 14 38 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 27 1 0 0 0 0 23 26 2 0 0 0 0 23 41 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 28 31 1 0 0 0 0 29 30 2 0 0 0 0 30 32 1 0 0 0 0 31 32 2 0 0 0 0 M CHG 2 12 -1 15 1 M END $$$$