HMDB0028920 RDKit 3D Isoleucyl-Valine 38 37 0 0 0 0 0 0 0 0999 V2000 4.3208 -1.7309 -0.0407 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -0.2505 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7536 0.1442 0.5182 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 1.6566 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6039 -0.5198 -0.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5364 -0.1562 -1.5872 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3047 -0.2714 0.4632 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2303 -0.5502 1.6876 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 0.2563 -0.2157 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 0.4964 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4392 1.9335 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6787 2.7239 -0.2847 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6081 2.4513 0.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1954 -0.2949 -0.2045 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9407 -1.7844 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4743 -0.0280 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7631 -2.2314 0.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0957 -2.2555 -1.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4135 -1.8961 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9809 -0.0084 -1.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9139 0.3412 0.2498 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7947 -0.1326 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8282 2.1658 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3621 2.0714 -0.3389 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6003 1.9034 0.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7966 -1.6206 -0.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8176 -0.7548 -2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2271 0.8375 -1.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7305 0.4767 -1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.2046 1.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6278 3.2599 1.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 0.0187 -1.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8752 -2.0266 -0.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2909 -2.2818 -1.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4701 -2.2385 0.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0926 0.7106 0.0378 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0911 -0.9566 0.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2852 0.3375 1.5931 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 2 0 11 13 1 0 10 14 1 0 14 15 1 0 14 16 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 2 21 1 0 3 22 1 0 4 23 1 0 4 24 1 0 4 25 1 0 5 26 1 0 6 27 1 0 6 28 1 0 9 29 1 0 10 30 1 0 13 31 1 0 14 32 1 0 15 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 16 38 1 0 M END