BB2PT6 -OEChem-04022117293D 59 61 0 1 0 0 0 0 0999 V2000 1.9246 4.3013 0.2868 P 0 0 0 0 0 0 0 0 0 0 0 0 3.2258 -3.4470 3.0011 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1498 -2.5264 2.6079 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4635 -1.2964 3.2179 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.1008 -2.1717 -1.3578 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1598 0.9996 -3.1987 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6135 4.0943 1.2138 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0611 -0.0358 1.9524 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3047 5.8527 0.5466 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3426 4.3191 -1.2221 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 3.3371 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7315 -1.5143 0.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 0.0995 -1.7664 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1539 -1.2383 -3.1054 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1866 0.6132 -3.1983 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6796 -0.5941 0.3889 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5356 -0.6045 1.4093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6954 0.6481 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -1.0015 -0.9874 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0311 1.7458 2.1495 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5838 0.7086 0.5164 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3723 -0.0041 -3.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 2.9039 2.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1921 1.8666 0.4684 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 -1.1538 1.4962 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3039 -1.5684 -3.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8812 -0.1505 -3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1435 2.9642 1.2611 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6968 -1.7738 -1.6683 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 -0.7197 -3.1422 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1785 -2.8521 -0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5767 -0.8843 -1.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7929 -2.2992 1.6957 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4197 -2.1511 0.9996 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5399 -3.0407 0.3829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9381 -1.0730 0.2824 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8073 -2.3532 2.4255 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 0.4054 0.3318 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9391 -0.7067 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8931 -1.4841 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6456 -2.4794 0.4335 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9161 1.0315 -1.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8963 1.7118 2.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3027 -0.1451 -0.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8364 -0.8701 -3.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6781 0.9022 -3.6618 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5217 3.7562 2.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0461 1.8664 -0.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1325 -1.1134 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1068 -2.5357 -3.5973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4911 -3.5511 -1.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9869 -0.0398 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2566 -3.1796 2.0611 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5529 -2.0215 2.4313 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 -2.5373 0.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1252 -3.8859 0.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6235 -0.3741 0.7544 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 6.2062 0.1686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9719 4.3706 -1.9727 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 11 2 0 0 0 0 2 37 1 0 0 0 0 3 37 1 0 0 0 0 4 37 1 0 0 0 0 5 19 2 0 0 0 0 6 15 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 25 2 0 0 0 0 9 58 1 0 0 0 0 10 59 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 12 41 1 0 0 0 0 13 19 1 0 0 0 0 13 22 1 0 0 0 0 13 42 1 0 0 0 0 14 27 2 0 0 0 0 14 30 1 0 0 0 0 15 30 2 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 23 1 0 0 0 0 20 43 1 0 0 0 0 21 24 2 0 0 0 0 21 44 1 0 0 0 0 22 27 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 28 2 0 0 0 0 23 47 1 0 0 0 0 24 28 1 0 0 0 0 24 48 1 0 0 0 0 25 33 1 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 31 35 1 0 0 0 0 31 51 1 0 0 0 0 32 36 2 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 35 56 1 0 0 0 0 36 57 1 0 0 0 0 M END $$$$