HMDB0000759 RDKit 3D Glycylleucine 29 28 0 0 0 0 0 0 0 0999 V2000 -3.0409 -1.7361 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2808 -0.5752 -0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0417 0.6714 0.2768 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8561 -0.6019 0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0741 0.4095 -0.2391 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4293 0.1902 0.3446 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5497 -0.0175 -0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3651 -0.0109 -1.7523 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -0.2392 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8409 -0.4192 -1.0741 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2783 1.7725 0.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0745 2.1622 1.3467 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9766 2.6966 -0.5647 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9941 -2.6451 -0.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6029 -1.8921 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1082 -1.4666 0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -0.6836 -1.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2673 1.3384 -0.5865 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4878 1.1927 1.0761 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0128 0.3711 0.7675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8967 -0.5441 1.4425 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4464 -1.6266 0.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1737 0.3721 -1.3401 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4946 0.1994 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2329 0.6458 0.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -1.0930 0.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4624 -1.1857 -1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7897 -0.6478 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6283 3.3627 -0.1676 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 7 9 1 0 9 10 1 0 5 11 1 0 11 12 2 0 11 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 3 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 4 22 1 0 5 23 1 6 6 24 1 0 9 25 1 0 9 26 1 0 10 27 1 0 10 28 1 0 13 29 1 0 M END