@MOLECULE (2r,3r,4s,5r,6r)-4-formamido-3,5-dihydroxy-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) 64 66 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.5848 -1.7119 2.5812 O.2 1 UNL1 -0.5951 2 C 3.5772 -1.3096 3.1694 C.2 1 UNL1 0.5015 3 N 4.2795 -0.2131 2.7431 N.am 1 UNL1 -0.5673 4 C 3.9173 0.4678 1.5038 C.3 1 UNL1 -0.0302 5 C 4.8785 0.0903 0.3489 C.3 1 UNL1 0.0548 6 O 4.9522 -1.2810 0.1289 O.3 1 UNL1 -0.5360 7 C 4.0212 2.0036 1.7045 C.3 1 UNL1 0.0578 8 O 5.3367 2.3111 2.1052 O.3 1 UNL1 -0.5608 9 C 3.6378 2.7152 0.3874 C.3 1 UNL1 0.0988 10 C 3.9371 4.2080 0.4326 C.3 1 UNL1 -0.4660 11 O 4.4553 2.2283 -0.6693 O.3 1 UNL1 -0.4610 12 C 4.3762 0.8463 -0.9254 C.3 1 UNL1 0.3209 13 O 3.0430 0.4272 -1.0183 O.3 1 UNL1 -0.4079 14 P 2.1453 0.2700 -2.3398 P.3 1 UNL1 0.3697 15 O 2.7532 0.2139 -3.6500 O.2 1 UNL1 -0.1757 16 O 1.0945 1.4476 -2.1826 O.3 1 UNL1 -0.3163 17 O 1.4144 -1.0919 -1.9917 O.3 1 UNL1 -0.1221 18 P 0.8166 -1.9973 -0.8265 P.3 1 UNL1 0.3674 19 O 0.0904 -3.0485 -1.5151 O.2 1 UNL1 -0.2161 20 O 2.0168 -2.4917 0.0634 O.3 1 UNL1 -0.3174 21 O 0.1040 -0.9955 0.2003 O.3 1 UNL1 -0.3409 22 C -1.2644 -0.5891 0.1611 C.3 1 UNL1 -0.0320 23 C -2.1458 -1.6155 0.8898 C.3 1 UNL1 0.0279 24 O -3.1216 -0.8636 1.6211 O.3 1 UNL1 -0.4415 25 C -2.9058 -2.5950 -0.0341 C.3 1 UNL1 0.1468 26 O -2.5529 -3.9234 0.2868 O.3 1 UNL1 -0.5742 27 C -4.3870 -2.4503 0.3583 C.3 1 UNL1 -0.3646 28 C -4.4338 -1.2192 1.2665 C.3 1 UNL1 0.3239 29 N -5.0482 -0.0308 0.6174 N.ar 1 UNL1 -0.4926 30 C -4.6211 0.3600 -0.6675 C.ar 1 UNL1 0.7128 31 O -3.9107 -0.3373 -1.3624 O.2 1 UNL1 -0.5278 32 C -5.8232 0.8246 1.3973 C.ar 1 UNL1 0.1034 33 C -6.2784 2.0127 0.9311 C.ar 1 UNL1 -0.2242 34 C -7.1587 2.9101 1.7172 C.3 1 UNL1 -0.4051 35 C -5.9119 2.4774 -0.4039 C.ar 1 UNL1 0.6000 36 N -5.0850 1.5903 -1.1426 N.ar 1 UNL1 -0.6330 37 O -6.2232 3.5161 -0.9356 O.2 1 UNL1 -0.4688 38 H 3.9188 -1.7792 4.1038 H 1 UNL1 0.1347 39 H 5.1459 0.0846 3.1699 H 1 UNL1 0.3231 40 H 2.8563 0.1953 1.2362 H 1 UNL1 0.1989 41 H 5.9339 0.3594 0.5733 H 1 UNL1 0.1486 42 H 4.0620 -1.6616 -0.0696 H 1 UNL1 0.3514 43 H 3.4041 2.3492 2.5613 H 1 UNL1 0.1521 44 H 5.9107 2.4551 1.3193 H 1 UNL1 0.3317 45 H 2.5687 2.5281 0.1406 H 1 UNL1 0.1494 46 H 4.9685 4.4136 0.7462 H 1 UNL1 0.1591 47 H 3.8124 4.6532 -0.5659 H 1 UNL1 0.1696 48 H 3.2690 4.7308 1.1241 H 1 UNL1 0.1518 49 H 5.0252 0.7161 -1.8175 H 1 UNL1 0.1553 50 H 0.5687 1.3264 -1.3104 H 1 UNL1 0.3148 51 H 2.0651 -1.9994 0.9835 H 1 UNL1 0.3660 52 H -1.1993 0.3510 0.7589 H 1 UNL1 0.1444 53 H -1.6491 -0.3417 -0.8484 H 1 UNL1 0.1557 54 H -1.5786 -2.1609 1.6814 H 1 UNL1 0.1691 55 H -2.7297 -2.4201 -1.1173 H 1 UNL1 0.1607 56 H -1.6653 -4.1310 -0.0816 H 1 UNL1 0.3420 57 H -5.0375 -2.3653 -0.5289 H 1 UNL1 0.1801 58 H -4.7217 -3.3607 0.8958 H 1 UNL1 0.1806 59 H -4.9586 -1.3951 2.2385 H 1 UNL1 0.1417 60 H -6.0643 0.4651 2.4061 H 1 UNL1 0.1744 61 H -6.7234 3.9211 1.8031 H 1 UNL1 0.1708 62 H -8.1362 3.0415 1.2212 H 1 UNL1 0.1695 63 H -7.3510 2.5475 2.7344 H 1 UNL1 0.1487 64 H -4.8024 1.8627 -2.0886 H 1 UNL1 0.3466 @BOND 1 15 14 2 2 14 16 1 3 14 17 1 4 14 13 1 5 16 50 1 6 64 36 1 7 17 18 1 8 49 12 1 9 19 18 2 10 31 30 2 11 36 30 ar 12 36 35 ar 13 55 25 1 14 13 12 1 15 37 35 2 16 12 11 1 17 12 5 1 18 53 22 1 19 18 20 1 20 18 21 1 21 11 9 1 22 30 29 ar 23 47 10 1 24 57 27 1 25 35 33 ar 26 56 26 1 27 42 6 1 28 25 26 1 29 25 27 1 30 25 23 1 31 20 51 1 32 6 5 1 33 45 9 1 34 22 21 1 35 22 52 1 36 22 23 1 37 5 41 1 38 5 4 1 39 27 58 1 40 27 28 1 41 9 10 1 42 9 7 1 43 10 46 1 44 10 48 1 45 29 28 1 46 29 32 ar 47 23 24 1 48 23 54 1 49 33 32 ar 50 33 34 1 51 62 34 1 52 40 4 1 53 28 24 1 54 28 59 1 55 44 8 1 56 32 60 1 57 4 7 1 58 4 3 1 59 7 8 1 60 7 43 1 61 34 61 1 62 34 63 1 63 1 2 2 64 3 2 am 65 3 39 1 66 2 38 1