BS3WR4 -OEChem-04042106233D 46 49 0 1 0 0 0 0 0999 V2000 -7.8792 2.1443 0.3272 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5445 1.0831 2.0981 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3453 -3.9681 -0.5329 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0154 2.8049 -1.3368 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4412 -2.2586 -0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0497 -2.3252 -0.4195 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4665 1.8419 0.7405 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9118 4.0493 0.1767 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -0.3921 0.0101 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0753 0.9675 0.2155 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9084 0.5217 -0.8195 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8038 1.6809 -1.7556 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0795 1.4605 -0.9898 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0325 0.5250 0.4090 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9055 -0.4398 0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8215 0.0409 1.6285 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4673 2.8287 -0.0879 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1626 -1.7882 -0.0758 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5908 0.0257 0.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4666 -0.8573 -0.0179 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1052 -2.6713 -0.2944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2094 -2.2057 -0.2653 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7808 -3.2738 0.8352 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9602 -1.1247 -0.1851 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2212 -0.3470 -0.0649 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4457 -0.9716 -0.2389 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5944 -0.1974 -0.1176 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 1.6879 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4849 1.1585 0.1701 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0683 -0.4416 -1.2847 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 1.4673 -2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3258 2.1406 -0.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9395 1.0968 -1.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5389 -0.7518 1.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1694 -0.2834 2.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3369 1.0640 0.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4587 4.2404 1.0636 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 4.7983 -0.5066 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9715 -2.9508 -0.4438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8895 0.6022 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5216 -4.2597 0.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2887 -3.1116 1.8003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8633 -3.2452 0.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5341 -2.0289 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5676 -0.6627 -0.2496 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0615 2.7390 0.5514 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 16 1 0 0 0 0 3 21 1 0 0 0 0 4 12 1 0 0 0 0 4 17 1 0 0 0 0 5 18 1 0 0 0 0 5 23 1 0 0 0 0 6 24 2 0 0 0 0 7 14 1 0 0 0 0 7 17 2 0 0 0 0 8 17 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 20 1 0 0 0 0 9 24 1 0 0 0 0 9 40 1 0 0 0 0 10 25 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 22 39 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 29 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 M END $$$$