@MOLECULE 4-amino-5-oxo-8-(beta-d-ribofuranosyl)-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxamide 39 41 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* -1.9612 0.9235 1.0296 O.3 1 UNL1 -0.4029 2 O2* -3.1052 1.7689 -1.8478 O.3 1 UNL1 -0.5248 3 O3* -4.8467 0.4288 -0.5488 O.3 1 UNL1 -0.5261 4 O5* -1.8729 -1.0157 2.8690 O.3 1 UNL1 -0.5118 5 O 3.4199 -1.4424 -0.0744 O.2 1 UNL1 -0.5778 6 O -0.0888 -3.5417 -0.8682 O.2 1 UNL1 -0.5951 7 N -0.1733 0.5098 -0.3832 N.ar 1 UNL1 -0.3757 8 N 0.8719 2.5869 -0.0067 N.ar 1 UNL1 -0.5747 9 N 3.2374 2.7784 0.3265 N.ar 1 UNL1 -0.5721 10 N 4.6350 0.9270 0.2653 N.pl3 1 UNL1 -0.5205 11 N 2.0986 -3.7918 -0.3876 N.am 1 UNL1 -0.6506 12 C2* -2.5342 0.6195 -1.2745 C.3 1 UNL1 0.0224 13 C1* -1.4923 1.1742 -0.2699 C.3 1 UNL1 0.2592 14 C3* -3.5764 -0.1338 -0.3938 C.3 1 UNL1 0.0495 15 C4* -3.0649 0.0186 1.0497 C.3 1 UNL1 -0.0058 16 C5* -2.5981 -1.2950 1.6942 C.3 1 UNL1 -0.0478 17 C 0.9950 1.2407 -0.1347 C.ar 1 UNL1 0.4642 18 C -0.0887 -0.8624 -0.4963 C.ar 1 UNL1 0.1800 19 C 2.2402 0.5775 -0.0487 C.ar 1 UNL1 -0.4827 20 C 1.0849 -1.5541 -0.4114 C.ar 1 UNL1 -0.3853 21 C 2.3440 -0.8660 -0.1717 C.ar 1 UNL1 0.5669 22 C 3.3798 1.4143 0.1834 C.ar 1 UNL1 0.4971 23 C 0.9823 -3.0239 -0.5795 C.2 1 UNL1 0.6387 24 C 2.0061 3.2943 0.2245 C.ar 1 UNL1 0.3481 25 H2* -2.1050 -0.0041 -2.0833 H 1 UNL1 0.1528 26 H1* -1.3732 2.2953 -0.3373 H 1 UNL1 0.2252 27 H3* -3.7342 -1.1881 -0.7068 H 1 UNL1 0.1674 28 H4* -3.8028 0.5356 1.7071 H 1 UNL1 0.1707 29 H5*1 -3.4547 -1.9009 2.0488 H 1 UNL1 0.1550 30 H5*2 -1.9727 -1.9156 1.0272 H 1 UNL1 0.1327 31 H -1.0384 -1.4033 -0.6823 H 1 UNL1 0.2014 32 H2* -3.8748 1.5200 -2.4142 H 1 UNL1 0.3365 33 H3* -4.8400 1.3887 -0.3125 H 1 UNL1 0.3332 34 H5* -1.1655 -0.3612 2.6623 H 1 UNL1 0.3240 35 H 1.8942 4.3887 0.3366 H 1 UNL1 0.2037 36 H 5.4105 1.5302 0.4699 H 1 UNL1 0.3238 37 H 4.7875 -0.0743 0.1761 H 1 UNL1 0.3533 38 H 2.0592 -4.7799 -0.5245 H 1 UNL1 0.3101 39 H 2.9872 -3.3690 -0.1736 H 1 UNL1 0.3380 @BOND 1 32 2 1 2 25 12 1 3 2 12 1 4 12 14 1 5 12 13 1 6 6 23 2 7 27 14 1 8 31 18 1 9 23 20 1 10 23 11 am 11 3 14 1 12 3 33 1 13 38 11 1 14 18 20 ar 15 18 7 ar 16 20 21 ar 17 14 15 1 18 11 39 1 19 7 13 1 20 7 17 ar 21 26 13 1 22 13 1 1 23 21 5 2 24 21 19 ar 25 17 19 ar 26 17 8 ar 27 19 22 ar 28 8 24 ar 29 37 10 1 30 22 10 1 31 22 9 ar 32 24 9 ar 33 24 35 1 34 10 36 1 35 30 16 1 36 1 15 1 37 15 16 1 38 15 28 1 39 16 29 1 40 16 4 1 41 34 4 1