HMDB0036759 RDKit 3D Pregeijerene 30 30 0 0 0 0 0 0 0 0999 V2000 -3.3962 -0.3848 -0.7388 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1662 -0.0453 0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8838 1.2137 0.3635 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7452 1.6872 1.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4736 1.8273 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8492 1.5248 -0.7823 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7941 0.4144 -1.0071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9627 -0.5649 0.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2123 -0.6136 0.9047 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0265 -1.4442 0.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2423 -1.4487 -0.4831 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3425 -1.1741 0.5066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2375 -1.3153 -1.3017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6148 0.4225 -1.4955 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2496 -0.5412 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6647 1.9314 0.0357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8833 2.0107 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2599 2.1900 1.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3507 2.4928 -1.1454 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0659 1.5152 -1.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8273 0.8441 -1.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5533 -0.0759 -2.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1507 -1.3906 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3474 0.3681 1.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1068 -0.8389 0.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0893 -2.1981 1.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3548 -2.5029 -0.8992 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2163 -0.8060 -1.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9421 -1.0024 1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9985 -2.0952 0.5589 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 1 0 7 8 1 0 8 9 1 0 8 10 2 0 10 11 1 0 11 12 1 0 12 2 1 0 1 13 1 0 1 14 1 0 1 15 1 0 3 16 1 0 4 17 1 0 5 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 9 23 1 0 9 24 1 0 9 25 1 0 10 26 1 0 11 27 1 0 11 28 1 0 12 29 1 0 12 30 1 0 M END