HMDB0000101 RDKit 3D Deoxyadenosine 31 33 0 0 0 0 0 0 0 0999 V2000 5.3171 0.1584 -0.4503 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -0.4307 -0.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -1.6502 0.3103 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7238 -2.1955 0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -1.5504 0.2179 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6392 -0.3268 -0.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8766 0.2338 -0.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6498 1.4285 -1.0597 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3316 1.6110 -1.1665 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 0.5064 -0.6983 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7412 0.4108 -0.6852 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3075 -0.9513 -0.7384 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4458 -0.8687 0.2898 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5591 -1.5521 -0.1301 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6405 0.6326 0.3348 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4527 1.0589 1.5336 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4593 2.4480 1.6386 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3134 1.0675 0.4293 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4403 0.9953 -1.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1663 -0.2551 -0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7237 -3.1957 0.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8892 2.5110 -1.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1423 0.9734 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8376 -1.1654 -1.7129 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6491 -1.7875 -0.5504 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0565 -1.1987 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0506 -1.9621 0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0628 0.9669 -0.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1249 0.5619 2.4616 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 0.7630 1.3213 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6525 2.7627 2.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 7 2 1 0 18 11 1 0 10 6 1 0 1 19 1 0 1 20 1 0 4 21 1 0 9 22 1 0 11 23 1 6 12 24 1 0 12 25 1 0 13 26 1 1 14 27 1 0 15 28 1 6 16 29 1 0 16 30 1 0 17 31 1 0 M END