HMDB0033946 RDKit 3D 2-Phenylethyl benzoate 31 32 0 0 0 0 0 0 0 0999 V2000 1.1305 -0.9283 1.0881 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5925 -0.3548 0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6607 0.1228 -0.8295 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7104 0.0070 -0.6908 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3059 0.6415 0.5108 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 0.4136 0.4858 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5768 1.3401 -0.1422 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9466 1.1500 -0.1786 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4951 0.0325 0.4153 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7196 -0.9224 1.0568 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3574 -0.6957 1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0398 -0.1894 -0.1457 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9743 -0.6487 0.7293 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3346 -0.4900 0.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7408 0.1582 -0.6347 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8078 0.6216 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4518 0.4560 -1.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 0.4062 -1.5886 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9611 -1.0838 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 1.7308 0.5365 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9136 0.1497 1.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0865 2.1937 -0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5311 1.9060 -0.6834 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5833 -0.1089 0.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1657 -1.7963 1.5194 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -1.4146 1.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6575 -1.1534 1.6224 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0664 -0.8639 1.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7925 0.3011 -0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1291 1.1313 -2.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7478 0.8398 -2.0148 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 2 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 11 6 1 0 17 12 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 7 22 1 0 8 23 1 0 9 24 1 0 10 25 1 0 11 26 1 0 13 27 1 0 14 28 1 0 15 29 1 0 16 30 1 0 17 31 1 0 M END