B3W4MI -OEChem-04012115313D 39 42 0 0 0 0 0 0 0999 V2000 0.6272 -2.2886 0.5224 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1831 -1.4776 -1.6838 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3072 -0.2325 -0.4083 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8524 0.6925 1.9706 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 1.8214 -1.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 0.9938 -1.1568 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2496 0.9812 -0.5697 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6743 -0.1910 -0.0763 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5933 1.2593 -0.3726 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4327 -1.1145 0.6273 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4323 -1.2482 -0.0882 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3652 0.3371 0.3346 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7886 -0.8411 0.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9548 -0.3551 0.2609 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9572 -1.0330 -0.5615 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2973 -0.0897 -0.0708 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 0.5750 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8151 0.6042 0.5649 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6946 0.1266 1.5084 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1144 -0.3418 -1.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1803 1.0019 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 0.0794 -1.1708 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9717 0.7408 -0.0613 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 2.8043 -0.8289 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5267 1.9437 -2.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1967 1.5474 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5572 0.7178 -2.1348 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0273 2.1752 -0.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0144 -2.0321 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3936 -1.5566 1.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8051 0.1296 2.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2305 1.2460 -0.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3922 -0.3267 0.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9569 1.0976 1.5315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9614 1.1332 2.8737 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7291 -0.8552 -2.0666 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5882 1.5168 1.9244 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0839 -0.1123 -2.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0111 1.0592 -0.0672 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 15 2 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 17 1 0 0 0 0 4 19 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 9 12 2 0 0 0 0 9 28 1 0 0 0 0 10 13 2 0 0 0 0 10 29 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 2 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 21 2 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 31 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$