HMDB0012127 RDKit 3D (R)-2-Benzylsuccinate 27 27 0 0 0 0 0 0 0 0999 V2000 2.7816 -1.6187 0.6464 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5647 -1.0835 -0.4599 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0535 -1.7490 -1.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8505 0.1709 -0.6939 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3335 0.8209 0.5626 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3625 -0.0261 1.3112 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8463 -0.3763 0.5495 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 0.4451 0.5643 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1094 0.1263 -0.1416 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1945 -1.0238 -0.8968 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0901 -1.8443 -0.9182 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9363 -1.5206 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8288 2.1699 0.2527 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8544 2.6412 -0.9095 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3072 2.9527 1.2668 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8587 -1.3189 -2.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9866 -0.0704 -1.3777 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5048 0.8947 -1.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2581 0.9862 1.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0523 0.5628 2.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8767 -0.9098 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9358 1.3685 1.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9773 0.7779 -0.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0898 -1.2852 -1.4572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1213 -2.7640 -1.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0762 -2.1796 -0.2284 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1299 3.8529 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 5 13 1 0 13 14 2 0 13 15 1 0 12 7 1 0 3 16 1 0 4 17 1 0 4 18 1 0 5 19 1 1 6 20 1 0 6 21 1 0 8 22 1 0 9 23 1 0 10 24 1 0 11 25 1 0 12 26 1 0 15 27 1 0 M END