@MOLECULE (2r,4r,5s,6r)-4-amino-5-hydroxy-6-methyltetrahydro-2h-pyran-2-yl [(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2h)-pyrimidinyl)tetrahydro-2-furanyl]methyl dihydrogen diphosphate (non-preferred name) 61 63 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 5.0910 -3.3295 -1.7406 O.2 1 UNL1 -0.4733 2 C 5.0265 -2.3355 -1.0582 C.ar 1 UNL1 0.6021 3 C 5.7378 -2.0596 0.1882 C.ar 1 UNL1 -0.2239 4 C 6.7607 -3.0508 0.6011 C.3 1 UNL1 -0.4084 5 C 5.4668 -0.9392 0.9015 C.ar 1 UNL1 0.1029 6 N 4.1608 -1.3006 -1.4985 N.ar 1 UNL1 -0.6354 7 C 3.9317 -0.1119 -0.7980 C.ar 1 UNL1 0.7116 8 O 3.2138 0.7473 -1.2645 O.2 1 UNL1 -0.5185 9 N 4.5942 0.0427 0.4389 N.ar 1 UNL1 -0.4943 10 C 4.0754 1.0466 1.4080 C.3 1 UNL1 0.3233 11 O 2.8148 0.5865 1.8219 O.3 1 UNL1 -0.4452 12 C 3.9211 2.4480 0.8096 C.3 1 UNL1 -0.3637 13 C 2.4027 2.6633 0.6819 C.3 1 UNL1 0.1460 14 O 2.1164 3.8399 1.4078 O.3 1 UNL1 -0.5780 15 C 1.7571 1.4463 1.3820 C.3 1 UNL1 0.0302 16 C 0.8375 0.6134 0.4755 C.3 1 UNL1 -0.0353 17 O -0.5278 0.7724 0.8691 O.3 1 UNL1 -0.3298 18 P -1.4548 1.9976 0.4013 P.3 1 UNL1 0.3539 19 O -2.6843 1.7006 1.3555 O.3 1 UNL1 -0.2736 20 O -0.9577 3.3613 0.4799 O.2 1 UNL1 -0.2278 21 O -1.8771 1.7647 -1.1039 O.3 1 UNL1 -0.1771 22 P -2.3683 0.8090 -2.2617 P.3 1 UNL1 0.3674 23 O -2.5977 1.6373 -3.4261 O.2 1 UNL1 -0.1250 24 O -1.3211 -0.3568 -2.4672 O.3 1 UNL1 -0.3294 25 O -3.7748 0.1793 -1.8245 O.3 1 UNL1 -0.3348 26 C -3.9604 -0.9034 -0.9564 C.3 1 UNL1 0.3653 27 C -4.9902 -0.4972 0.1049 C.3 1 UNL1 -0.3828 28 C -5.1303 -1.6336 1.1296 C.3 1 UNL1 0.0390 29 N -5.9414 -1.1417 2.2676 N.3 1 UNL1 -0.6584 30 C -3.7419 -2.0263 1.6932 C.3 1 UNL1 0.0653 31 O -3.9876 -3.2412 2.3787 O.3 1 UNL1 -0.5657 32 C -2.6971 -2.2610 0.5764 C.3 1 UNL1 0.1042 33 O -2.7158 -1.1803 -0.3220 O.3 1 UNL1 -0.4879 34 C -2.8924 -3.5929 -0.1368 C.3 1 UNL1 -0.4959 35 H 7.7262 -2.8539 0.1046 H 1 UNL1 0.1637 36 H 6.9430 -3.0599 1.6831 H 1 UNL1 0.1503 37 H 6.4678 -4.0761 0.3119 H 1 UNL1 0.1768 38 H 5.9502 -0.7309 1.8650 H 1 UNL1 0.1737 39 H 3.6630 -1.4225 -2.3851 H 1 UNL1 0.3468 40 H 4.7142 1.0122 2.3242 H 1 UNL1 0.1412 41 H 4.3555 3.2214 1.4741 H 1 UNL1 0.1798 42 H 4.4295 2.5612 -0.1640 H 1 UNL1 0.1820 43 H 2.0749 2.8003 -0.3717 H 1 UNL1 0.1594 44 H 1.1616 4.0633 1.3163 H 1 UNL1 0.3438 45 H 1.2555 1.7382 2.3352 H 1 UNL1 0.1690 46 H 1.0292 0.7828 -0.6045 H 1 UNL1 0.1640 47 H 0.9718 -0.4731 0.6857 H 1 UNL1 0.1423 48 H -2.9527 0.7043 1.2371 H 1 UNL1 0.3214 49 H -1.2878 -0.9206 -1.6040 H 1 UNL1 0.3337 50 H -4.2724 -1.7787 -1.5725 H 1 UNL1 0.1148 51 H -4.7093 0.4528 0.6086 H 1 UNL1 0.1923 52 H -5.9575 -0.2612 -0.3722 H 1 UNL1 0.1652 53 H -5.5915 -2.5348 0.6474 H 1 UNL1 0.1246 54 H -6.9001 -0.9845 2.0082 H 1 UNL1 0.2507 55 H -5.9102 -1.7902 3.0416 H 1 UNL1 0.2641 56 H -3.3815 -1.2687 2.4247 H 1 UNL1 0.1445 57 H -3.1805 -3.5624 2.8233 H 1 UNL1 0.3211 58 H -1.6586 -2.1703 0.9836 H 1 UNL1 0.1484 59 H -2.4325 -3.5721 -1.1341 H 1 UNL1 0.1650 60 H -2.4408 -4.4202 0.4240 H 1 UNL1 0.1567 61 H -3.9501 -3.8528 -0.2646 H 1 UNL1 0.1579 @BOND 1 23 22 2 2 24 22 1 3 24 49 1 4 39 6 1 5 22 25 1 6 22 21 1 7 25 26 1 8 1 2 2 9 50 26 1 10 6 2 ar 11 6 7 ar 12 8 7 2 13 59 34 1 14 21 18 1 15 2 3 ar 16 26 33 1 17 26 27 1 18 7 9 ar 19 46 16 1 20 52 27 1 21 43 13 1 22 33 32 1 23 61 34 1 24 42 12 1 25 34 60 1 26 34 32 1 27 35 4 1 28 27 51 1 29 27 28 1 30 3 4 1 31 3 5 ar 32 37 4 1 33 18 20 2 34 18 17 1 35 18 19 1 36 9 5 ar 37 9 10 1 38 16 47 1 39 16 17 1 40 16 15 1 41 32 58 1 42 32 30 1 43 4 36 1 44 53 28 1 45 13 12 1 46 13 15 1 47 13 14 1 48 12 10 1 49 12 41 1 50 5 38 1 51 28 30 1 52 28 29 1 53 48 19 1 54 44 14 1 55 15 11 1 56 15 45 1 57 10 11 1 58 10 40 1 59 30 31 1 60 30 56 1 61 54 29 1 62 29 55 1 63 31 57 1