D0BM5G -OEChem-10121501032D 46 48 0 0 0 0 0 0 0999 V2000 2.8660 2.7531 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.5846 -1.2911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7128 -2.7877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9923 0.2189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 0.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 2.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.7289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2602 0.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1243 -0.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1205 -1.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8525 -1.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 -1.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8564 -0.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7166 -1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4486 -1.7944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3166 -1.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 1.3607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.6705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 0.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 -0.4229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -0.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -0.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -0.4229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 2.8357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 2.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6188 0.0985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6188 3.4077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0678 2.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5824 -1.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9822 -2.4011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3945 0.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0483 -2.2678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8453 -2.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6245 -1.8359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8547 -0.9898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0087 -0.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 23 2 0 0 0 0 4 18 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 28 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 12 14 2 0 0 0 0 12 36 1 0 0 0 0 13 15 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 3 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END $$$$