HMDB0028911 RDKit 3D Isoleucyl-Leucine 41 40 0 0 0 0 0 0 0 0999 V2000 4.4739 -0.3034 -1.3236 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1382 0.7760 -0.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6447 0.7474 0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3733 1.8204 1.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9115 0.8975 -1.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 2.1476 -1.9177 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 0.6967 -1.1763 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3131 1.5695 -1.6156 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0715 -0.4616 -0.5873 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4882 -0.7385 -0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8871 -0.7559 1.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3363 -1.0339 1.2545 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2386 -0.0089 0.6055 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5629 -0.8616 2.7659 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8501 -1.9686 -1.1628 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -2.6091 -1.7753 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1365 -2.4768 -1.2124 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3105 0.1377 -2.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7714 -1.1589 -1.1999 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5212 -0.5901 -1.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7502 0.6829 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3249 1.7752 -0.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4328 -0.2277 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3412 1.8011 1.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0425 1.6398 1.8814 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6578 2.8362 0.6325 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2988 0.0887 -1.9708 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0992 2.9803 -1.3236 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6897 2.2676 -2.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5828 -1.1832 -0.2243 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0156 0.1511 -0.8913 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6185 0.1641 1.5418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3148 -1.5831 1.5203 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6531 -2.0645 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1589 0.9731 1.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2885 -0.3569 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0808 0.1119 -0.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4729 0.2270 2.9562 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7337 -1.3944 3.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5587 -1.2506 3.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3476 -3.4644 -1.1278 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 3 5 1 0 5 6 1 0 5 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 10 15 1 0 15 16 2 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 4 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 6 28 1 0 6 29 1 0 9 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 13 35 1 0 13 36 1 0 13 37 1 0 14 38 1 0 14 39 1 0 14 40 1 0 17 41 1 0 M END