BBC1M4 -OEChem-04022109333D 49 52 0 0 0 0 0 0 0999 V2000 3.7020 0.0418 -1.3467 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 2.1606 2.6206 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1994 -1.3225 -1.2471 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 0.8780 -2.4697 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4735 -2.0008 -0.0489 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0588 0.8690 0.1094 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1858 -0.2734 -1.0408 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8372 -4.5800 1.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5941 -3.9884 0.9393 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 0.0897 1.3624 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4875 2.2427 0.2246 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.0035 -1.2831 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0681 -1.0832 -0.6361 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8048 -0.0367 -1.2035 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4305 0.8629 2.5313 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 2.9253 1.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -1.0821 -0.6674 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0465 -2.0188 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2142 1.0464 -1.8522 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1824 1.0377 -1.8164 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4197 -1.4778 -0.3641 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2247 0.6114 -1.5112 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5682 1.6637 -0.4968 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8302 -3.1722 0.5424 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5648 1.4218 0.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8911 2.8831 -0.4999 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8843 2.3991 1.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2104 3.8605 0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9367 -3.9497 1.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5068 -3.6231 0.7617 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 3.6186 1.3881 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3189 -0.8896 1.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7623 -0.0437 1.5288 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4037 2.1857 0.3657 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7127 2.8291 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2275 0.3376 3.4698 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5178 0.9664 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1792 3.0605 1.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6495 3.9146 1.5794 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9189 -1.8636 -0.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7122 1.8828 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7294 1.8403 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1186 0.0103 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 1.0602 -2.4687 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1003 0.4763 0.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1322 3.1091 -1.2396 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6604 2.2109 2.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6877 4.8125 0.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4566 4.3803 2.1209 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 5 21 2 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 14 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 29 3 0 0 0 0 9 30 3 0 0 0 0 10 15 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 16 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 17 2 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 14 20 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 21 1 0 0 0 0 18 24 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 29 1 0 0 0 0 24 30 1 0 0 0 0 25 27 1 0 0 0 0 25 45 1 0 0 0 0 26 28 2 0 0 0 0 26 46 1 0 0 0 0 27 31 2 0 0 0 0 27 47 1 0 0 0 0 28 31 1 0 0 0 0 28 48 1 0 0 0 0 31 49 1 0 0 0 0 M END $$$$