B8C0OE -OEChem-04012113013D 47 50 0 0 0 0 0 0 0999 V2000 -2.8824 1.2470 -2.3166 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4008 -3.9957 0.5939 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8380 -3.2109 1.9209 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4293 0.1535 -0.3241 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8381 -2.0183 0.9016 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 0.4411 -0.8983 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4711 2.2705 0.6538 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5027 -3.1601 0.8578 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0958 -0.2667 1.0414 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7813 -0.1938 -0.7558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4407 -1.7408 1.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0822 -1.6707 -0.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6026 0.8947 -1.1716 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1634 -3.4227 1.1477 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2847 1.3060 -0.6697 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1376 2.5103 -0.0127 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1397 2.8552 0.4461 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9394 0.8083 -0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2232 1.9853 0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9712 -0.1686 -0.7214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3861 4.0571 1.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2369 -1.1842 0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -0.0915 -1.9092 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6681 4.3596 1.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6665 3.4407 1.3037 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2305 -2.1248 -0.0751 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6907 -1.0320 -2.1802 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9574 -2.0486 -1.2632 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6749 0.3694 1.7221 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0385 -0.1048 1.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9204 0.0388 -1.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 0.4407 -0.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7584 -2.3671 0.6739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2735 -1.9781 2.3217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1316 -1.8585 -0.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4634 -2.2893 -1.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -4.1027 0.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2166 -3.6189 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0217 -3.6703 2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 3.1690 0.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4191 4.7631 1.3135 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -1.2262 1.1166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5009 0.6948 -2.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8772 5.2841 2.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6871 3.6244 1.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2565 -0.9725 -3.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7387 -2.7636 -1.5081 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 8 1 0 0 0 0 3 8 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 15 2 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 25 2 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 41 1 0 0 0 0 22 26 1 0 0 0 0 22 42 1 0 0 0 0 23 27 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M CHG 2 2 -1 8 1 M END $$$$