@MOLECULE 4-(methylamino)-1-(beta-d-ribofuranosyl)-1,3,5-triazin-2(1h)-one 32 33 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* -1.6171 0.7209 -0.9058 O.3 1 UNL1 -0.4534 2 O2* -1.6194 -2.5730 0.2296 O.3 1 UNL1 -0.5541 3 O3* -3.9218 -1.3472 -0.0809 O.3 1 UNL1 -0.5360 4 O5* -2.7175 3.1460 0.1429 O.3 1 UNL1 -0.5211 5 O 1.0371 -2.2825 -0.1485 O.2 1 UNL1 -0.5201 6 N 0.5129 -0.0738 -0.3979 N.ar 1 UNL1 -0.5837 7 N 2.7729 -0.7836 0.0528 N.ar 1 UNL1 -0.6443 8 N 2.1989 1.5644 -0.2467 N.ar 1 UNL1 -0.5828 9 N 4.3797 0.9204 0.2686 N.pl3 1 UNL1 -0.4303 10 C2* -1.5236 -1.2081 0.5204 C.3 1 UNL1 0.0401 11 C3* -2.9477 -0.6097 0.6074 C.3 1 UNL1 0.0890 12 C4* -2.8103 0.7510 -0.1088 C.3 1 UNL1 0.0316 13 C1* -0.8821 -0.4580 -0.6854 C.3 1 UNL1 0.2573 14 C5* -2.6766 1.9301 0.8568 C.3 1 UNL1 -0.0480 15 C 1.4768 -1.1544 -0.1526 C.ar 1 UNL1 0.7362 16 C 0.9391 1.2300 -0.4560 C.ar 1 UNL1 0.3524 17 C 3.1091 0.5278 0.0184 C.ar 1 UNL1 0.5711 18 C 5.4478 -0.0575 0.4730 C.3 1 UNL1 -0.2300 19 H2* -0.6948 -2.9148 0.0695 H 1 UNL1 0.3743 20 H3* -3.5492 -2.2081 -0.3907 H 1 UNL1 0.3516 21 H5* -2.0347 3.1378 -0.5621 H 1 UNL1 0.3160 22 H 4.6263 1.8982 0.1823 H 1 UNL1 0.3323 23 H2* -0.9537 -1.0758 1.4638 H 1 UNL1 0.1496 24 H3* -3.3211 -0.5316 1.6495 H 1 UNL1 0.1511 25 H4* -3.6231 0.9127 -0.8558 H 1 UNL1 0.1850 26 H1* -0.9158 -1.0478 -1.6380 H 1 UNL1 0.1754 27 H5*1 -3.5465 2.0062 1.5384 H 1 UNL1 0.1560 28 H5*2 -1.7437 1.8885 1.4467 H 1 UNL1 0.1264 29 H 0.2115 2.0343 -0.6813 H 1 UNL1 0.2121 30 H 5.0530 -0.9985 0.9158 H 1 UNL1 0.1920 31 H 6.2055 0.3550 1.1601 H 1 UNL1 0.1499 32 H 5.9268 -0.3266 -0.4869 H 1 UNL1 0.1545 @BOND 1 26 13 1 2 1 13 1 3 1 12 1 4 25 12 1 5 13 6 1 6 13 10 1 7 29 16 1 8 21 4 1 9 32 18 1 10 16 6 ar 11 16 8 ar 12 6 15 ar 13 20 3 1 14 8 17 ar 15 15 5 2 16 15 7 ar 17 12 11 1 18 12 14 1 19 3 11 1 20 17 7 ar 21 17 9 1 22 19 2 1 23 4 14 1 24 22 9 1 25 2 10 1 26 9 18 1 27 18 30 1 28 18 31 1 29 10 11 1 30 10 23 1 31 11 24 1 32 14 28 1 33 14 27 1