@MOLECULE uridine 5'-triphosphate 44 45 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P 1.5447 2.3943 0.4679 P.3 1 UNL1 0.3911 2 P 4.0575 0.9418 -0.6164 P.3 1 UNL1 0.4082 3 P 3.3526 -1.8652 0.3465 P.3 1 UNL1 0.3907 4 O -1.7647 -0.5304 1.0604 O.3 1 UNL1 -0.4211 5 O -0.5042 -3.2101 -0.0152 O.3 1 UNL1 -0.5554 6 O -2.9398 -3.0679 -1.0966 O.3 1 UNL1 -0.4923 7 O 0.4948 1.2402 0.7325 O.3 1 UNL1 -0.1693 8 O -5.4970 -1.7242 0.7632 O.2 1 UNL1 -0.4934 9 O 2.9073 1.8517 -0.0763 O.3 1 UNL1 -0.3157 10 O 0.9662 3.1172 -0.8323 O.3 1 UNL1 -0.3803 11 O 1.7363 3.1801 1.6671 O.2 1 UNL1 -0.1928 12 O -6.9075 2.3605 -0.6174 O.2 1 UNL1 -0.4719 13 O 3.8022 -0.3657 0.2450 O.3 1 UNL1 -0.1839 14 O 5.2818 1.4976 0.2222 O.3 1 UNL1 -0.2580 15 O 4.2498 0.9529 -2.0457 O.2 1 UNL1 -0.2137 16 O 2.1319 -2.0085 -0.6702 O.3 1 UNL1 -0.4261 17 O 4.5017 -2.7369 -0.3121 O.3 1 UNL1 -0.3418 18 O 3.1395 -2.1836 1.7448 O.2 1 UNL1 -0.2207 19 N -3.8942 -0.1861 0.1979 N.ar 1 UNL1 -0.4875 20 N -6.2259 0.3271 0.0602 N.ar 1 UNL1 -0.6233 21 C -0.7980 -1.9578 -0.5888 C.3 1 UNL1 0.0428 22 C -2.3211 -1.8482 -0.8602 C.3 1 UNL1 0.0201 23 C -0.5294 -0.7999 0.3869 C.3 1 UNL1 0.0323 24 C -2.8560 -1.1931 0.4530 C.3 1 UNL1 0.2351 25 C -0.0445 0.4534 -0.3534 C.3 1 UNL1 -0.0693 26 C -5.2423 -0.6070 0.3724 C.ar 1 UNL1 0.7034 27 C -3.5798 1.1264 -0.1035 C.ar 1 UNL1 0.1743 28 C -4.5512 2.0296 -0.3793 C.ar 1 UNL1 -0.4459 29 C -5.9560 1.6674 -0.3489 C.ar 1 UNL1 0.6240 30 H -0.1813 -1.9537 -1.5125 H 1 UNL1 0.1771 31 H -2.5595 -1.2433 -1.7618 H 1 UNL1 0.1654 32 H 0.1557 -1.0640 1.2298 H 1 UNL1 0.1959 33 H -3.2370 -1.9478 1.1902 H 1 UNL1 0.1833 34 H -0.8860 1.0066 -0.8186 H 1 UNL1 0.1279 35 H 0.6815 0.1748 -1.1488 H 1 UNL1 0.1661 36 H -0.7354 -3.2370 0.9413 H 1 UNL1 0.3351 37 H -2.4297 -3.8108 -0.6880 H 1 UNL1 0.3318 38 H -2.5072 1.3883 -0.0947 H 1 UNL1 0.1923 39 H -7.2012 0.0292 0.1499 H 1 UNL1 0.3477 40 H -4.3273 3.0654 -0.6238 H 1 UNL1 0.2041 41 H 1.7386 3.5377 -1.3579 H 1 UNL1 0.3323 42 H 5.0439 1.4570 1.2310 H 1 UNL1 0.3275 43 H 1.5543 -2.8072 -0.3883 H 1 UNL1 0.3340 44 H 4.6146 -2.4716 -1.2954 H 1 UNL1 0.3197 @BOND 1 15 2 2 2 31 22 1 3 30 21 1 4 41 10 1 5 44 17 1 6 35 25 1 7 6 22 1 8 6 37 1 9 22 21 1 10 22 24 1 11 10 1 1 12 34 25 1 13 16 43 1 14 16 3 1 15 40 28 1 16 12 29 2 17 2 9 1 18 2 14 1 19 2 13 1 20 21 5 1 21 21 23 1 22 28 29 ar 23 28 27 ar 24 25 23 1 25 25 7 1 26 29 20 ar 27 17 3 1 28 27 38 1 29 27 19 ar 30 9 1 1 31 5 36 1 32 20 39 1 33 20 26 ar 34 19 26 ar 35 19 24 1 36 14 42 1 37 13 3 1 38 3 18 2 39 26 8 2 40 23 4 1 41 23 32 1 42 24 4 1 43 24 33 1 44 1 7 1 45 1 11 2