HMDB0000210 RDKit 3D Pantothenic acid 32 31 0 0 0 0 0 0 0 0999 V2000 -3.5084 -0.2236 -0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0594 -0.1990 0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8267 1.2371 0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8387 -1.0823 1.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1034 -2.4185 1.0135 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1597 -0.5378 -1.0827 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3667 0.4409 -2.0731 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2642 -0.6792 -0.7404 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -1.5365 0.0662 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2494 0.1857 -1.3367 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6539 0.0855 -1.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8348 0.4129 0.4523 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2685 0.3039 0.8515 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 -0.7546 0.5856 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8886 1.3492 1.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5154 0.2871 -1.3901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1421 0.3490 0.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8837 -1.2454 -0.5524 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2435 1.3800 1.5493 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7671 1.5363 0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4141 1.9425 -0.1448 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8214 -0.9441 1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5658 -0.7489 2.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5152 -2.5986 0.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4869 -1.5176 -1.5345 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2255 1.3238 -1.6594 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9716 0.9141 -2.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2749 0.7527 -1.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9932 -0.9579 -1.1876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1909 -0.2014 1.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4765 1.4715 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8164 1.6733 1.2161 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 2 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 1 18 1 0 3 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 6 25 1 6 7 26 1 0 10 27 1 0 11 28 1 0 11 29 1 0 12 30 1 0 12 31 1 0 15 32 1 0 M END