B3BMV6 -OEChem-04022107413D 49 51 0 0 0 0 0 0 0999 V2000 5.7818 -1.0093 1.3989 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5278 2.4645 0.3532 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9873 1.9151 0.7574 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -0.1231 -1.2285 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1052 0.3492 -0.1491 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2716 0.7831 0.0137 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2259 -1.1161 0.5509 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7187 -0.2768 0.9509 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 2.5783 -1.5121 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2277 2.9095 -0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4373 1.4771 -0.9654 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4781 1.5453 0.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0489 -0.4642 0.5758 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8489 -1.1999 0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 -0.6485 0.3459 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9775 -2.4497 -0.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4464 -1.3468 -0.0608 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8406 -3.1480 -0.8663 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5751 -2.5964 -0.6669 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1332 -0.7757 0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0578 0.6017 0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9734 -1.5841 0.3512 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3316 1.1211 0.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3727 0.2279 0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7324 0.6981 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1161 0.0302 1.1549 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 0.1061 -0.1323 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8045 -0.0687 -2.4894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7704 3.4404 -1.8774 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9453 2.1911 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1520 3.4185 -0.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6842 3.5511 0.3809 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5809 1.9101 -0.4386 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0846 0.7983 -1.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3196 1.0317 -0.1774 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6599 1.5914 1.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5058 0.3004 0.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9584 -2.8883 -0.6236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9418 -4.1179 -1.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -3.1627 -1.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7612 1.2928 -0.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9139 -2.6670 0.3941 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4498 -1.2562 0.9223 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -0.7693 1.7724 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2014 0.9907 1.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 2.9108 0.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0721 -0.2691 -3.2759 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2279 0.9275 -2.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5857 -0.8335 -2.5338 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 23 1 0 0 0 0 2 46 1 0 0 0 0 3 25 2 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 27 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 22 2 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 15 37 1 0 0 0 0 16 18 1 0 0 0 0 16 38 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 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 M END $$$$