HMDB0034782 RDKit 3D Benzyl sulfate 20 20 0 0 0 0 0 0 0 0999 V2000 1.4303 -0.0055 1.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4337 0.1187 0.4420 S 0 0 0 0 0 6 0 0 0 0 0 0 3.6303 0.8341 1.0588 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8748 -1.4339 -0.0286 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8876 1.0472 -0.8159 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8592 0.5243 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3222 0.2955 -0.6825 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5231 -0.9493 -0.1456 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6083 -1.2106 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5108 -0.2014 0.9466 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3387 1.0629 0.4225 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2277 1.2888 -0.3959 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8226 -2.0012 0.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -0.3777 -2.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5534 1.3104 -2.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1684 -1.7574 -0.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7712 -2.2020 1.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3641 -0.4380 1.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0547 1.8408 0.6516 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0706 2.2545 -0.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 2 0 2 4 1 0 2 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 12 7 1 0 4 13 1 0 6 14 1 0 6 15 1 0 8 16 1 0 9 17 1 0 10 18 1 0 11 19 1 0 12 20 1 0 M END