HMDB0061136 RDKit 3D di-Hydroxymelatonin 35 36 0 0 0 0 0 0 0 0999 V2000 -3.8216 -0.8852 -2.3295 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1573 0.3607 -2.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7203 0.5499 -0.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4765 1.1309 0.2293 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7678 1.5573 -0.1326 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0379 1.3113 1.5217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7526 0.8800 1.8569 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0313 0.8902 2.9774 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1662 0.3349 2.7522 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2493 -0.0625 1.4267 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3911 -0.6967 0.7249 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1445 0.3550 -0.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -0.1959 -0.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3271 -0.8701 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4557 -1.4194 -0.9472 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3467 -1.0289 1.0817 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9807 0.2930 0.8784 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4473 0.1226 -0.4171 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6426 -0.4722 -1.3656 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -0.7807 -3.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0596 -1.6542 -2.5715 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3424 -1.2416 -1.3964 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1411 1.4532 -1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6431 1.7704 2.2861 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 1.2824 3.9054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9716 0.2018 3.4767 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.4356 -0.0076 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0531 -1.2436 1.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5747 1.0757 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 0.9865 -0.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2598 -0.0629 -1.8045 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6223 -0.8636 -1.8906 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 -2.4965 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3631 -1.3491 -0.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8873 -0.6378 -2.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 10 17 1 0 17 18 2 0 18 19 1 0 18 3 1 0 17 7 1 0 1 20 1 0 1 21 1 0 1 22 1 0 5 23 1 0 6 24 1 0 8 25 1 0 9 26 1 0 11 27 1 0 11 28 1 0 12 29 1 0 12 30 1 0 13 31 1 0 15 32 1 0 15 33 1 0 15 34 1 0 19 35 1 0 M END