L3NDB7 -OEChem-05022321402D 79 81 0 1 0 0 0 0 0999 V2000 4.8154 5.6442 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.9555 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8096 6.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3455 2.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.4555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 6.8215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 5.0894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 6.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2115 4.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3455 5.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3455 9.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 5.6200 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9436 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2115 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2115 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8096 5.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 4.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2115 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3455 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4795 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4795 4.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3455 8.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 8.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5855 5.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5855 3.5853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 8.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8096 8.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6795 5.1408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6795 4.0992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2115 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 9.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8096 9.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 10.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2115 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 0.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 11.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 5.4555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5406 5.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4805 4.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6010 7.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9995 6.5374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1196 5.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3465 5.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4996 6.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3236 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5636 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8221 8.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4236 8.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6881 3.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2896 4.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7349 8.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1335 8.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5927 6.2746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5927 2.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5406 8.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3465 8.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4805 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6746 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1437 3.7871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8086 9.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8824 9.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5406 9.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3465 9.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4805 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6746 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0776 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5636 11.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9436 11.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3236 11.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 5.9924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 4.9185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 6.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 5 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 42 1 0 0 0 0 3 19 2 0 0 0 0 4 21 2 0 0 0 0 5 79 1 0 0 0 0 12 8 1 6 0 0 0 8 15 1 0 0 0 0 8 19 1 0 0 0 0 9 14 1 0 0 0 0 9 20 1 0 0 0 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0 0 0 0 41 74 1 0 0 0 0 41 75 1 0 0 0 0 42 76 1 0 0 0 0 42 77 1 0 0 0 0 42 78 1 0 0 0 0 M END $$$$