BDPO42 -OEChem-04022103433D 52 53 0 0 0 0 0 0 0999 V2000 0.2432 -2.7293 1.8471 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 -2.1650 -1.1931 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2978 -1.5597 -0.5833 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2456 0.5361 -0.4342 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0981 0.6699 0.4308 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6176 4.2989 -0.5836 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8856 2.4928 1.4238 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.0334 3.0627 -0.2387 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7099 -0.6262 0.7925 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 1.2979 1.3341 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3279 1.1742 -0.7892 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2549 2.5152 1.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2342 2.3884 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1423 -1.8206 1.1184 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4868 -1.9121 0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0405 -0.8514 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3921 4.8775 -1.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4576 5.0040 0.3642 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6175 -1.9681 1.3266 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6251 -1.9414 -0.8761 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8865 -2.0530 0.7538 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8939 -2.0263 -1.4489 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0247 -2.0820 -0.6338 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1016 0.1037 0.5369 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3341 -0.2504 -0.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9907 1.3213 0.9894 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4476 -2.0374 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3755 -2.2186 -0.3014 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2496 -3.5010 -1.6211 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 0.8248 2.3007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9406 0.5970 -1.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8652 2.9921 1.7801 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0284 2.7602 -2.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4051 -1.8537 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3274 5.0746 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7734 4.2235 -2.6856 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9079 5.8376 -2.0065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3349 4.4065 0.6363 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8982 5.2678 1.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8376 5.9436 -0.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 -1.9434 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7532 -1.9054 -1.5241 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7214 -2.0922 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9954 -2.0498 -2.5305 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5741 -1.4619 -2.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3374 -1.9173 -0.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2795 -2.2823 -0.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 -1.3033 0.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3487 -3.1188 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1033 -4.0869 -0.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3527 -3.6389 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1122 -3.8996 -2.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 23 1 0 0 0 0 2 28 1 0 0 0 0 3 25 1 0 0 0 0 3 27 1 0 0 0 0 4 25 2 0 0 0 0 5 9 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 26 2 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 9 16 2 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 11 13 2 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 24 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 21 1 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 23 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 27 29 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M CHG 2 5 1 7 -1 M END $$$$