HMDB0059879 RDKit 3D Diethyl glutarate 29 28 0 0 0 0 0 0 0 0999 V2000 4.4831 1.7722 -0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3925 0.3032 -0.2513 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9981 -0.0372 -0.2631 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5862 -1.3346 -0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4775 -2.1848 0.2285 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1849 -1.7815 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2046 -0.6947 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1821 -1.2735 -0.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2175 -0.2222 -0.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8923 0.9615 -0.7738 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5487 -0.5366 -0.5536 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6053 0.3280 -0.8034 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7242 1.4774 0.1398 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4658 1.9559 -1.0708 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6292 2.0512 -1.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4549 2.3238 0.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8239 0.0764 0.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9709 -0.2892 -0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0093 -2.6545 -0.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9663 -2.1746 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2818 0.0668 0.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4399 -0.1696 -1.2132 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2841 -2.0608 -1.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4014 -1.6905 0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 0.6952 -1.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5544 -0.2695 -0.7364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4673 1.1961 1.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1625 2.3826 -0.1901 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7931 1.7836 0.1642 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 8 23 1 0 8 24 1 0 12 25 1 0 12 26 1 0 13 27 1 0 13 28 1 0 13 29 1 0 M END