HMDB0033379 RDKit 3D cis-3-Hexenyl benzoate 31 31 0 0 0 0 0 0 0 0999 V2000 -5.0713 1.0804 0.9275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9673 0.9872 -0.1298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9585 -0.3671 -0.7001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9142 -1.1610 -0.6335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6506 -0.8131 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5414 -0.8921 -1.0678 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -0.5373 -0.3609 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8831 -0.4892 -0.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9425 -0.7692 -2.1932 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0906 -0.1259 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3252 -0.0805 -0.8562 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2624 -0.1593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4127 0.5708 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1822 0.5356 1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0745 0.1880 1.1082 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4551 2.1044 0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8582 0.3360 0.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 0.7445 1.9042 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0619 1.3269 0.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1735 1.7220 -0.9541 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8772 -0.7270 -1.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9687 -2.1677 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3757 -1.5692 0.7815 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5338 0.1625 0.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5206 -1.9250 -1.4166 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7414 -0.2157 -1.9012 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3404 -0.3308 -1.9258 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4187 0.2937 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 0.8437 1.7561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1295 0.7786 2.9092 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1237 0.1595 1.6172 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 10 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 11 27 1 0 12 28 1 0 13 29 1 0 14 30 1 0 15 31 1 0 M END