B6M8EY -OEChem-04022117163D 49 52 0 0 0 0 0 0 0999 V2000 -6.0170 -2.5360 0.6968 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8146 1.7063 -0.3937 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2327 -0.4727 0.8368 O 0 5 0 0 0 0 0 0 0 0 0 0 9.0641 -0.7943 -1.3282 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2009 0.6673 0.4112 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0242 0.3849 0.0815 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5495 -0.5340 -0.2138 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7429 -0.1240 -0.7003 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1001 1.7881 0.7112 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1214 -0.6894 -0.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4913 1.2870 1.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1386 1.1566 0.0872 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1886 0.0658 0.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4025 0.1548 0.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5949 0.5595 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1828 0.2174 1.1624 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9964 -0.1363 -1.2203 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7395 -0.3833 0.1612 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1191 -0.0738 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5567 -0.0108 1.0888 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3704 -0.3646 -1.2939 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1506 -0.3018 -0.1394 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5492 -1.6763 0.5875 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9389 -1.1773 0.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7291 1.1249 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3355 -1.1132 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1144 1.1920 -0.6999 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9071 0.0833 -0.4399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0917 -0.9725 -0.9353 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8215 0.4869 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7043 2.3784 1.5467 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1824 2.4598 -0.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0324 -1.4308 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5071 -1.2150 -1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4327 0.7645 2.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1432 2.1605 1.2326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4022 1.9869 0.7569 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1878 1.5633 -0.9317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1606 -0.2701 1.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9925 -0.7893 -0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7519 0.4273 2.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4078 -0.1752 -2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1329 0.0431 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7993 -0.5854 -2.2681 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6279 -2.1789 0.8455 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1476 2.0160 -0.7436 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9640 -1.9760 0.1989 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5710 2.1174 -1.0394 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9833 0.1447 -0.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 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 8 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 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 16 2 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 16 20 1 0 0 0 0 16 41 1 0 0 0 0 17 21 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 24 1 0 0 0 0 19 25 2 0 0 0 0 20 22 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 23 45 1 0 0 0 0 24 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 $$$$