D01CKY -OEChem-04152108482D 54 55 0 1 0 0 0 0 0999 V2000 6.4318 2.4196 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 3.9162 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 2.3038 -3.0676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8137 -3.9162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4279 3.4196 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4318 2.4158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4317 2.4234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6876 -1.6496 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6876 -0.6497 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7937 -2.1843 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7937 -0.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5536 -2.1496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8876 -1.6705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8876 -0.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5536 -0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4196 -1.6496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6876 0.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4196 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3036 -3.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3037 -3.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5376 0.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3296 -0.1428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4356 1.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3377 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2056 1.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0697 0.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2095 2.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6941 -2.4996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1982 0.3548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 0.3640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1551 -2.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9521 -2.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2767 -1.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6785 -2.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6785 -0.0451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2767 -0.7349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6317 -2.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0302 -1.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3076 0.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6876 0.9703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0676 0.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7703 -3.3607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6198 -3.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -2.7283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9971 1.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 -0.4590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7438 1.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7576 0.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6054 0.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3818 1.4278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8295 2.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2119 3.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5895 2.3978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 23 1 0 0 0 0 3 20 1 0 0 0 0 3 48 1 0 0 0 0 4 20 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 28 1 6 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 17 1 1 0 0 0 10 13 1 0 0 0 0 10 19 1 1 0 0 0 10 20 1 0 0 0 0 11 14 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 16 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 18 1 0 0 0 0 15 21 2 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 22 2 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 21 23 1 0 0 0 0 21 45 1 0 0 0 0 22 24 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M CHG 2 2 1 5 -1 M END $$$$