HMDB0258501 RDKit 3D Stilbene oxide 27 29 0 0 0 0 0 0 0 0999 V2000 -4.6931 0.1180 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9696 -0.5402 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5952 -0.6527 -1.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9211 -0.0888 0.0367 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4643 -0.1430 0.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0136 1.2091 0.6006 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 0.4992 -0.5893 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9386 0.1752 -0.3991 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 0.3727 -1.4001 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2153 0.0742 -1.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6335 -0.4437 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7187 -0.6439 0.9851 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3745 -0.3398 0.8041 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6645 0.5573 1.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 0.6755 0.9655 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7588 0.2040 -0.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5392 -0.9568 -1.8948 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0306 -1.1595 -1.8002 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1437 -0.9276 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2192 1.1011 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5893 0.7738 -2.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 0.2208 -1.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6664 -0.6989 0.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -1.0541 1.9428 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7267 -0.5319 1.6486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 1.0081 1.8579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5467 1.1921 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 4 14 1 0 14 15 2 0 15 1 1 0 7 5 1 0 13 8 1 0 1 16 1 0 2 17 1 0 3 18 1 0 5 19 1 0 7 20 1 0 9 21 1 0 10 22 1 0 11 23 1 0 12 24 1 0 13 25 1 0 14 26 1 0 15 27 1 0 M END