B5Y8IE -OEChem-04022101463D 31 31 0 0 0 0 0 0 0999 V2000 4.7998 1.7583 0.5657 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0503 1.4158 0.0426 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9676 1.3913 0.0541 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5781 -0.8561 0.0019 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5172 -0.8706 -0.0106 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8994 -0.8665 -0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6175 -2.0620 -0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9707 0.3772 0.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 0.3530 0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0122 -2.0378 -0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6889 -0.8182 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9194 -3.3828 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6765 1.6482 0.0348 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3625 0.2311 0.0166 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0498 2.8892 -0.5924 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7951 -0.1937 0.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7645 0.7291 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 0.2945 0.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0715 1.3054 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5874 -2.9596 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7758 -0.8191 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2994 -3.5107 0.8195 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2949 -3.4688 -0.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6296 -4.2168 -0.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9504 -1.7898 -0.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4429 3.4096 0.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4418 2.6212 -1.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8466 3.5524 -0.9424 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0189 -1.2552 -0.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5574 1.7934 0.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9201 1.1565 0.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 14 2 0 0 0 0 3 18 1 0 0 0 0 3 31 1 0 0 0 0 4 18 2 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 M END $$$$