HMDB0015642 RDKit 3D Arbekacin 82 84 0 0 0 0 0 0 0 0999 V2000 -4.8417 0.5482 2.1328 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4598 1.7827 2.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7216 2.9625 1.9895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3273 3.1630 2.4603 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8763 4.3520 1.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3754 2.0786 2.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 0.9999 2.8457 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3168 2.1971 1.2655 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3772 1.1188 1.0416 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9655 1.4403 1.6283 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7096 2.3583 0.7324 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9849 3.5799 0.4647 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9986 1.6615 -0.5411 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8607 0.5895 -0.4419 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0394 0.7238 -1.1296 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0499 0.8013 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -0.3157 0.6717 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6913 -0.1803 1.9471 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 0.9752 2.7257 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5384 -1.4726 -0.1176 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6436 -1.6959 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4043 -0.4046 -2.0319 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4420 -0.6391 -3.0819 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 1.1779 -1.2182 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2986 2.2106 -2.0352 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3477 0.6728 -0.3957 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2110 -0.7393 -0.3396 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2638 -1.4161 -0.8844 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8773 -2.2503 -1.9279 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9913 -2.7016 -2.6238 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4651 -1.7158 -3.6686 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5787 -2.2876 -4.2874 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0954 -3.1496 -1.7014 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8153 -4.2268 -2.2078 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4126 -3.5027 -0.3743 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2979 -4.1656 0.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9876 -2.1555 0.2213 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1853 -2.4148 1.3184 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4592 -0.2837 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5316 0.5431 1.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5237 1.7732 2.1481 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4523 1.8236 3.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2986 3.8737 2.3489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8188 3.0350 0.8757 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3622 3.3747 3.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3065 5.1115 2.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2714 3.0919 0.7449 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7642 0.2733 1.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5817 0.5309 1.7929 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7962 1.9880 2.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6263 2.6807 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0023 3.8546 -0.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4078 4.4006 0.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5267 2.4102 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1252 1.6911 -1.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8397 -0.5388 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7403 -0.0105 1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5272 -1.0622 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4652 0.7152 3.3845 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0561 1.2319 3.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6011 -2.3958 0.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5239 -1.1022 -0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7067 -2.1865 -1.0286 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1951 -2.3668 -2.0087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3908 -0.1182 -2.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 0.0122 -3.8713 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5509 -1.6196 -3.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0156 0.3476 -1.9665 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4522 2.0427 -3.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 0.8374 -0.8876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0072 -0.6552 -1.2607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6621 -3.6101 -3.1881 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6122 -1.5791 -4.3756 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -0.7867 -3.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5051 -3.2663 -4.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -2.2638 -1.4972 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1176 -4.7519 -1.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5116 -4.1059 -0.6451 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2792 -3.6713 1.4474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0975 -5.1639 0.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -1.6497 0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7763 -2.4151 2.1207 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 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 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 21 22 1 0 22 23 1 0 13 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 30 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 26 9 1 0 37 28 1 0 22 15 1 0 1 39 1 0 1 40 1 0 2 41 1 0 2 42 1 0 3 43 1 0 3 44 1 0 4 45 1 1 5 46 1 0 8 47 1 0 9 48 1 1 10 49 1 0 10 50 1 0 11 51 1 1 12 52 1 0 12 53 1 0 13 54 1 6 15 55 1 6 17 56 1 1 18 57 1 0 18 58 1 0 19 59 1 0 19 60 1 0 20 61 1 0 20 62 1 0 21 63 1 0 21 64 1 0 22 65 1 6 23 66 1 0 23 67 1 0 24 68 1 6 25 69 1 0 26 70 1 6 28 71 1 6 30 72 1 6 31 73 1 0 31 74 1 0 32 75 1 0 33 76 1 1 34 77 1 0 35 78 1 6 36 79 1 0 36 80 1 0 37 81 1 1 38 82 1 0 M END