BL4D6N -OEChem-04022104253D 41 43 0 0 0 0 0 0 0999 V2000 -3.0996 3.0713 -0.2268 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.8969 -1.8484 0.7538 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 2.2422 0.2305 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3984 3.3939 -0.2807 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0684 2.2994 1.5448 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4788 1.7503 -0.9401 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0531 -0.9758 -0.8456 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8131 0.8833 0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4743 0.5549 -0.9543 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 0.1639 1.3874 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5903 -1.2473 0.2046 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3675 -0.5163 -0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9195 -0.9073 1.3794 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5283 0.8567 -0.5345 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -0.5107 -0.5015 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2609 1.3145 -2.2233 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3264 0.4991 2.6644 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3101 -1.3741 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7779 1.3739 -0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5457 -2.3925 0.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5671 -0.8542 0.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7988 0.5177 0.2095 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0496 -2.7507 -0.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7978 -3.2328 -0.4214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1573 -2.3112 -0.7998 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 2.4185 -1.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8912 -0.7890 -1.8754 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -1.4837 2.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5211 2.3702 -2.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9191 0.9331 -3.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2472 1.1965 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6722 -0.1694 3.4649 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 1.4992 3.0265 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2501 0.3095 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3473 -2.2337 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 -2.5164 1.1743 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0192 -3.3180 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7723 0.9194 0.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8006 -3.4772 0.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5793 -4.2940 -0.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -2.6364 -1.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 6 14 1 0 0 0 0 6 26 1 0 0 0 0 7 15 1 0 0 0 0 7 25 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 16 1 0 0 0 0 10 13 2 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 18 2 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 21 1 0 0 0 0 18 23 1 0 0 0 0 19 22 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$