B8WOF9 -OEChem-04012113373D 51 53 0 1 0 0 0 0 0999 V2000 -0.2714 -0.9101 -1.1796 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3688 -0.8517 -2.6261 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9748 -1.9419 -0.4399 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0519 5.4832 -0.4589 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6314 0.6593 -0.5268 N 0 0 2 0 0 0 0 0 0 0 0 0 -2.2917 0.0939 1.2917 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4259 0.1310 2.6284 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3169 1.7539 -0.8254 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1046 0.5595 0.8854 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3121 3.1024 -0.5036 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4366 -1.0842 -0.7535 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3913 0.9321 1.9676 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6128 4.2754 -0.8057 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4012 -0.6421 -1.6411 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7744 -1.6591 0.4587 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3299 -0.3929 0.4983 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1082 -1.3566 -0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2618 0.6439 3.0358 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7481 -0.7794 -1.3056 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1214 -1.7964 0.7944 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5482 -1.5046 0.2703 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5001 0.1026 -0.7882 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1804 -1.3680 1.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -0.3849 -1.5825 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2183 -1.8556 0.2095 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3971 -1.3640 -1.0835 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0976 -0.3127 1.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0841 0.4670 0.5537 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 1.7343 -1.8941 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2482 1.6386 -0.2615 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2418 3.2238 -1.0758 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6179 3.1802 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6059 1.3430 2.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5348 4.2048 -0.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8663 4.3083 -1.8699 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1419 -0.1885 -2.5926 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0228 -2.0031 1.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0956 0.7846 4.0942 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5073 -0.4313 -2.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3881 -2.2454 1.7475 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -1.7024 -0.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -2.3953 0.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9094 0.9121 -1.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0595 -1.7788 2.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5588 6.2124 -0.6606 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6875 0.0088 -2.5837 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8862 -2.6193 0.5969 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 -1.7413 -1.7008 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6693 -0.0889 1.9846 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4382 1.3065 1.1419 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5514 0.2848 -0.4077 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 5 1 0 0 0 0 1 11 1 0 0 0 0 4 13 1 0 0 0 0 4 45 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 16 1 0 0 0 0 7 18 2 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 12 2 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 18 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 19 1 0 0 0 0 14 36 1 0 0 0 0 15 20 2 0 0 0 0 15 37 1 0 0 0 0 16 22 2 0 0 0 0 16 23 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 27 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END $$$$