BCQ79Y -OEChem-04022117163D 49 52 0 1 0 0 0 0 0999 V2000 -4.8345 -2.1400 -1.8656 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5419 1.5150 1.1355 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5494 -2.8861 0.9762 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3252 -3.6314 -0.6865 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1905 2.5431 -0.5394 N 0 0 2 0 0 0 0 0 0 0 0 0 3.6073 1.9741 0.2526 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6108 -2.7460 0.1553 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5074 2.2429 -0.6431 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2238 1.5853 -0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1885 3.7382 -0.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7505 3.8548 -0.2146 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0787 2.3003 0.1303 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8491 1.1658 -0.5453 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3506 0.8047 0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1699 0.8771 0.1532 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0368 -0.2169 -0.3761 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3988 0.6261 1.1318 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0512 -0.1935 -0.6983 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3057 -0.6117 0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1476 -0.5504 1.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7999 -1.3700 -0.7228 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6683 -0.9609 -1.4716 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8609 -1.6682 -0.5627 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8481 -1.5484 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 -0.1085 1.2732 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1072 -2.2265 -0.2173 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2674 -0.6606 1.6188 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7981 -1.7081 0.8796 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7398 1.9379 -1.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2504 1.4428 0.9463 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0709 0.6078 -0.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8639 4.3619 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 4.0834 -1.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2197 4.6685 -0.7188 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7387 4.0433 0.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9447 2.1038 1.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7025 3.2022 0.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7958 2.6327 1.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2544 0.2457 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0573 1.4329 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6427 1.3962 1.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2459 -0.1096 -1.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9568 -0.6549 1.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5382 -2.1267 -1.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7751 -0.8860 -2.0756 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6539 0.7099 1.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5303 -3.0469 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8145 -0.2661 2.4704 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7604 -2.1307 1.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 15 2 0 0 0 0 3 7 1 0 0 0 0 4 7 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 38 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 19 1 0 0 0 0 16 22 2 0 0 0 0 17 20 1 0 0 0 0 17 41 1 0 0 0 0 18 21 2 0 0 0 0 18 42 1 0 0 0 0 19 23 1 0 0 0 0 19 25 2 0 0 0 0 20 24 2 0 0 0 0 20 43 1 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 26 2 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 28 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M CHG 2 3 -1 7 1 M END $$$$