BD8IB4 -OEChem-04022118403D 43 46 0 1 0 0 0 0 0999 V2000 -2.4033 -0.2904 0.7078 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3072 2.1527 -1.5939 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1666 2.0070 0.7519 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9658 -1.3097 -1.1249 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3728 1.8519 1.5128 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2019 0.7770 -1.7212 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8331 0.5335 0.2066 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4722 -0.1703 0.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7976 1.5185 1.3732 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3206 0.5745 1.3088 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0186 -0.3924 0.2269 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0359 1.2834 -1.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -0.2037 -0.9248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7225 0.8759 0.8947 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4077 -1.3270 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7603 -0.1483 0.3081 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9335 -0.9175 -1.1835 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5691 -1.3181 0.8609 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8572 -0.1092 -1.2149 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5724 -2.0639 0.9339 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3289 -1.8605 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9852 -1.3036 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3113 -0.1597 -1.6618 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5557 -1.2273 0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.1365 -0.7399 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3835 2.4249 1.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1575 1.0667 2.3057 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 0.0145 2.2519 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1795 2.2265 2.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5865 1.0785 -2.6087 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8288 -1.4902 2.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1942 0.7714 0.7241 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5143 -0.7583 -2.0847 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5824 -1.2894 1.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0735 -2.2573 0.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3147 -0.9697 -1.6277 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3639 0.7854 -1.6109 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8982 -2.8037 1.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2305 -2.4450 -0.3967 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5248 -2.1969 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5447 -0.4294 0.6561 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8538 0.7433 -1.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3637 -0.2256 -2.7531 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 16 1 0 0 0 0 2 12 2 0 0 0 0 3 14 2 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 29 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 15 2 0 0 0 0 13 17 2 0 0 0 0 15 20 1 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 32 1 0 0 0 0 17 21 1 0 0 0 0 17 33 1 0 0 0 0 18 22 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 23 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 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$