HMDB0015303 RDKit 3D Kanamycin 69 71 0 0 0 0 0 0 0 0999 V2000 7.6266 -0.0102 -0.6457 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5756 -0.5179 0.2067 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3211 0.3119 0.0328 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3487 -0.2114 0.8661 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1122 0.4011 0.7134 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2890 -0.2386 -0.1764 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0985 -0.7065 0.3982 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1406 -2.2159 0.2873 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3312 -2.8593 1.2954 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5808 -2.5521 -1.0987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9173 -2.3549 -0.9986 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3975 -3.3675 -0.0538 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2338 -0.9559 -0.5279 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0949 -0.3017 -1.4264 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3177 0.0115 -0.8529 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5166 1.3820 -0.7506 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 1.7411 0.0043 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0916 1.9018 1.4467 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1122 2.2673 2.3041 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6911 0.7017 0.0627 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8910 1.3408 0.3534 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7691 0.0584 -1.3091 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8771 -0.8380 -1.4066 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4697 -0.6894 -1.5116 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2558 -0.7754 -2.8813 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0321 -0.0877 -0.3612 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4347 1.0872 0.2719 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2427 1.8450 0.2849 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2057 1.9372 -1.0853 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4678 2.5052 0.8797 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3822 2.5407 2.2522 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6707 1.7421 0.3705 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0944 2.3603 -0.8056 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5557 -0.1267 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5638 -0.3051 -1.6242 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3819 -1.5977 0.0434 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9125 -0.3948 1.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0303 0.2464 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6269 0.3978 1.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0919 -0.4422 1.4855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1748 -2.6182 0.3032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7859 -3.7960 1.4836 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3739 -2.3279 2.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8039 -3.6121 -1.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0344 -1.8443 -1.7974 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3292 -2.5538 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7479 -4.1829 -0.6003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -2.9676 0.5051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7623 -1.0600 0.4441 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2715 -0.3609 0.2038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0542 2.7020 -0.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 0.8735 1.7528 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2103 2.5413 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7495 2.8369 1.8246 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4154 -0.0606 0.8355 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6304 0.6907 0.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8096 0.8933 -2.0525 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6954 -0.2857 -1.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6851 -1.6087 -2.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5618 -1.6954 -1.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3603 -1.7148 -3.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3114 0.2075 -1.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2348 1.8992 -0.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3531 2.3861 0.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7103 1.1522 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4718 3.5540 0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9532 3.2371 2.6642 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4856 1.8338 1.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0474 2.6506 -0.7624 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 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 13 26 1 0 26 27 1 0 5 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 32 3 1 0 26 7 1 0 24 15 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 3 38 1 6 5 39 1 1 7 40 1 1 8 41 1 6 9 42 1 0 9 43 1 0 10 44 1 0 10 45 1 0 11 46 1 6 12 47 1 0 12 48 1 0 13 49 1 1 15 50 1 1 17 51 1 6 18 52 1 0 18 53 1 0 19 54 1 0 20 55 1 1 21 56 1 0 22 57 1 6 23 58 1 0 23 59 1 0 24 60 1 1 25 61 1 0 26 62 1 6 27 63 1 0 28 64 1 1 29 65 1 0 30 66 1 6 31 67 1 0 32 68 1 1 33 69 1 0 M END