HMDB0060481 RDKit 3D heparan sulfate alpha-D-glucosaminide 79 81 0 0 0 0 0 0 0 0999 V2000 -4.9428 -2.0564 2.2582 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7891 -0.7535 1.6496 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0347 -0.7827 0.3679 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7214 -1.1527 0.6095 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8093 -0.1830 0.2694 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8813 0.2354 1.3813 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5267 0.9282 2.3801 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1104 1.1980 0.7275 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7701 1.9666 1.6404 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3564 3.5528 1.7301 S 0 0 0 0 0 6 0 0 0 0 0 0 0.9288 4.0996 3.0345 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0066 4.3276 0.6243 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2917 3.8347 1.8061 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9223 0.3964 -0.2133 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0197 1.0385 -0.7855 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1912 0.3579 -0.5984 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3683 1.1536 -0.1344 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0249 2.0476 1.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1377 2.7844 1.4233 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6704 3.7767 2.6841 S 0 0 0 0 0 6 0 0 0 0 0 0 3.7821 4.9038 2.1843 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8825 4.4556 3.3054 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8805 2.9418 3.8915 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3729 0.2600 0.2577 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9285 -0.2412 -0.9354 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2600 0.7845 -1.8183 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8738 -1.1060 -1.5864 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4462 -1.7487 -2.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 -3.4630 -2.5299 S 0 0 0 0 0 6 0 0 0 0 0 0 5.2197 -4.1787 -3.8438 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2672 -3.8181 -1.6382 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8328 -4.0145 -1.7732 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6718 -0.2558 -1.9524 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7114 -1.0618 -2.5054 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -0.0204 -1.2561 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9762 -0.7807 -0.8607 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5593 -2.1500 -0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6398 -2.4859 -0.7146 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4192 -3.1533 -0.1039 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6255 -1.5392 -0.6166 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9367 -1.3387 -0.8491 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0497 -0.4826 -2.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4864 -1.0843 -3.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7775 -0.7429 0.1871 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6901 -1.6932 0.7097 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1212 -0.0967 1.3580 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8372 1.2579 1.0761 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1762 -2.7140 2.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8226 -2.4911 1.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2657 -0.0995 2.3727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 0.2576 -0.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 0.7430 -0.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3877 -0.6647 1.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3721 1.3214 1.9927 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5515 1.8809 0.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5675 3.6443 2.7543 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3234 -0.5190 0.2724 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0686 -0.5565 0.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8026 1.7292 -0.9927 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 2.7905 0.6483 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 1.4723 1.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5674 2.6653 4.5823 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8612 -0.8057 -0.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 0.4391 -2.7443 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5645 -1.8719 -0.8433 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8809 -1.5436 -3.5648 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6118 -4.5723 -0.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0242 0.5764 -2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7197 -0.9530 -3.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6831 -0.8212 -1.7375 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0862 -3.6836 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3781 -2.3360 -1.1484 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5938 0.5191 -1.9765 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -0.2940 -2.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0638 -0.4570 -3.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4686 0.0392 -0.2497 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5121 -1.2533 1.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7363 -0.1100 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7059 1.7501 1.9328 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 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 2 0 10 13 1 0 8 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 2 0 20 23 1 0 17 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 2 0 29 32 1 0 27 33 1 0 33 34 1 0 14 35 1 0 35 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 3 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 41 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 46 2 1 0 36 5 1 0 33 16 1 0 1 48 1 0 1 49 1 0 2 50 1 1 3 51 1 6 5 52 1 6 6 53 1 1 7 54 1 0 8 55 1 6 13 56 1 0 14 57 1 1 16 58 1 1 17 59 1 6 18 60 1 0 18 61 1 0 23 62 1 0 25 63 1 1 26 64 1 0 27 65 1 1 28 66 1 0 32 67 1 0 33 68 1 6 34 69 1 0 36 70 1 6 39 71 1 0 41 72 1 6 42 73 1 0 42 74 1 0 43 75 1 0 44 76 1 6 45 77 1 0 46 78 1 1 47 79 1 0 M END