@MOLECULE (e)-2'-deoxy-5-(2-chlorovinyl)uridine 32 33 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 CL -4.4552 1.8529 -0.0234 Cl 1 UNL1 -0.0971 2 O4* 1.8139 0.9937 1.1266 O.3 1 UNL1 -0.4002 3 O3* 4.5256 1.5835 -0.5295 O.3 1 UNL1 -0.5536 4 O5* 0.0350 2.7671 0.1093 O.3 1 UNL1 -0.5424 5 O 1.9304 -2.9822 0.1635 O.2 1 UNL1 -0.5237 6 O -2.5335 -2.9864 -0.6187 O.2 1 UNL1 -0.4623 7 N 0.8117 -1.0100 0.4543 N.ar 1 UNL1 -0.5040 8 N -0.3211 -2.9941 -0.2387 N.ar 1 UNL1 -0.6201 9 C3* 3.2614 1.0120 -0.7809 C.3 1 UNL1 0.1206 10 C1* 2.0913 -0.3567 0.8700 C.3 1 UNL1 0.3347 11 C2* 3.1623 -0.4194 -0.2310 C.3 1 UNL1 -0.3947 12 C4* 2.2807 1.8390 0.0773 C.3 1 UNL1 0.0304 13 C5* 1.0853 2.3498 -0.7332 C.3 1 UNL1 -0.0461 14 C -0.3832 -0.3267 0.4814 C.ar 1 UNL1 0.1666 15 C 0.8733 -2.3866 0.1275 C.ar 1 UNL1 0.7001 16 C -1.5535 -0.9204 0.1030 C.ar 1 UNL1 -0.3047 17 C -1.5820 -2.3261 -0.2799 C.ar 1 UNL1 0.6151 18 C -2.8188 -0.2133 0.0669 C.2 1 UNL1 -0.1070 19 C -2.9077 1.1170 0.0058 C.2 1 UNL1 -0.1442 20 H3* 3.0639 1.0745 -1.8702 H 1 UNL1 0.1314 21 H1* 2.4013 -0.7872 1.8552 H 1 UNL1 0.1671 22 H2*1 2.9288 -1.1591 -1.0181 H 1 UNL1 0.1883 23 H2*2 4.1289 -0.7517 0.1962 H 1 UNL1 0.1843 24 H4* 2.8026 2.6586 0.6258 H 1 UNL1 0.1733 25 H5*1 0.6097 1.5602 -1.3476 H 1 UNL1 0.1548 26 H5*2 1.3750 3.1963 -1.3847 H 1 UNL1 0.1359 27 H3* 5.2395 1.0760 -0.9648 H 1 UNL1 0.3262 28 H -0.3480 0.7270 0.8265 H 1 UNL1 0.2200 29 H -0.2908 -3.9889 -0.4799 H 1 UNL1 0.3479 30 H5* 0.3699 3.3062 0.8561 H 1 UNL1 0.3261 31 H -3.7119 -0.8571 0.0740 H 1 UNL1 0.1940 32 H -2.1079 1.8447 -0.0343 H 1 UNL1 0.1831 @BOND 1 20 9 1 2 26 13 1 3 25 13 1 4 22 11 1 5 27 3 1 6 9 3 1 7 9 11 1 8 9 12 1 9 13 12 1 10 13 4 1 11 6 17 2 12 29 8 1 13 17 8 ar 14 17 16 ar 15 8 15 ar 16 11 23 1 17 11 10 1 18 32 19 1 19 1 19 1 20 19 18 2 21 18 31 1 22 18 16 1 23 12 24 1 24 12 2 1 25 16 14 ar 26 4 30 1 27 15 5 2 28 15 7 ar 29 7 14 ar 30 7 10 1 31 14 28 1 32 10 2 1 33 10 21 1