HMDB0000693 RDKit 3D Heparan sulfate 64 65 0 0 0 0 0 0 0 0999 V2000 -5.5153 1.4647 -1.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3155 0.8739 -1.4168 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3822 0.8512 -0.3675 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3378 1.6536 -0.7507 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 1.5693 0.0907 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6108 2.0259 1.4798 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 1.9010 2.2473 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6397 2.3593 3.8289 S 0 0 0 0 0 6 0 0 0 0 0 0 -0.4694 1.1532 4.7089 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 3.3754 4.1391 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1403 3.0356 4.0385 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6635 0.1463 0.1551 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6612 0.2151 -0.1785 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5572 -0.1182 0.8188 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2977 0.9703 1.1179 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5863 1.0849 0.7865 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8510 2.5295 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9869 2.9680 0.1704 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8507 3.4948 0.5854 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1295 0.2652 -0.3165 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5318 1.0245 -1.4094 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8607 0.7825 -1.7618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1689 -0.7833 -0.8393 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7991 -1.8431 -1.4561 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3952 -1.2835 0.3945 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7230 -2.3998 -0.0057 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2122 -3.8051 0.7448 S 0 0 0 0 0 6 0 0 0 0 0 0 3.5732 -4.1608 0.2104 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2842 -4.9209 0.3673 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3551 -3.6188 2.4046 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -0.7123 -0.6753 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2560 -2.0513 -0.6879 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9563 -0.5789 -0.0649 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8751 -1.4777 -0.7027 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8381 -1.2579 -2.0323 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5328 -2.6027 -2.8051 S 0 0 0 0 0 6 0 0 0 0 0 0 -5.6913 -3.0414 -1.9352 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -3.7054 -2.9173 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0287 -2.2213 -4.3548 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2088 1.4561 -1.8695 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9276 0.9049 -0.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3464 2.5158 -0.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8692 1.3169 0.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4604 2.2769 -0.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9413 3.0801 1.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3955 1.3845 1.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1825 3.8640 3.4877 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7258 -0.1933 1.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0243 -0.4147 1.7557 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2029 0.8678 1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0348 4.4570 0.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0237 -0.3287 -0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9923 -0.2958 -2.0368 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1153 1.4595 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5278 0.9960 -0.9055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4384 -0.2848 -1.5076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9941 -1.5970 -2.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1845 -1.4779 1.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9711 -4.2716 2.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6913 -0.2990 -1.7181 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6755 -2.5498 0.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9025 -0.7811 1.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6609 -2.4680 -0.5388 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7957 -2.7793 -4.6220 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 2 0 8 10 2 0 8 11 1 0 5 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 16 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 2 0 27 30 1 0 12 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 36 38 2 0 36 39 1 0 33 3 1 0 25 14 1 0 1 40 1 0 1 41 1 0 1 42 1 0 3 43 1 1 5 44 1 6 6 45 1 0 6 46 1 0 11 47 1 0 12 48 1 1 14 49 1 1 16 50 1 1 19 51 1 0 20 52 1 1 22 53 1 0 22 54 1 0 22 55 1 0 23 56 1 6 24 57 1 0 25 58 1 1 30 59 1 0 31 60 1 6 32 61 1 0 33 62 1 1 34 63 1 0 39 64 1 0 M END