@MOLECULE 5'-o-(dimethylamino)thymidine 39 40 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -3.7272 -2.9798 -0.2235 C.3 1 UNL1 -0.3062 2 N -3.3978 -1.5390 -0.1406 N.4 1 UNL1 -0.2052 3 C -4.5944 -0.7311 0.1813 C.3 1 UNL1 -0.3210 4 O -2.5610 -1.4418 1.0137 O.3 1 UNL1 -0.2357 5 C -1.3487 -0.7973 0.6552 C.3 1 UNL1 -0.1119 6 C -1.5195 0.7198 0.7962 C.3 1 UNL1 0.0580 7 O -0.3151 1.2354 1.3713 O.3 1 UNL1 -0.4343 8 C 0.4381 1.9419 0.4180 C.3 1 UNL1 0.3226 9 C -0.5277 2.4157 -0.6682 C.3 1 UNL1 -0.3864 10 C -1.7335 1.4591 -0.5428 C.3 1 UNL1 0.1360 11 O -2.9207 2.2076 -0.3745 O.3 1 UNL1 -0.5676 12 N 1.5262 1.0270 -0.0294 N.ar 1 UNL1 -0.4933 13 C 1.4064 0.2256 -1.1835 C.ar 1 UNL1 0.7137 14 N 2.3824 -0.7586 -1.3752 N.ar 1 UNL1 -0.6307 15 C 3.4261 -1.0510 -0.4587 C.ar 1 UNL1 0.6025 16 C 3.4167 -0.2472 0.7597 C.ar 1 UNL1 -0.2233 17 C 2.4840 0.7183 0.9395 C.ar 1 UNL1 0.1082 18 O 0.5350 0.3790 -2.0146 O.2 1 UNL1 -0.5307 19 O 4.2037 -1.9232 -0.7653 O.2 1 UNL1 -0.4741 20 C 4.4510 -0.5600 1.7755 C.3 1 UNL1 -0.4107 21 H -2.7912 -3.5448 -0.3754 H 1 UNL1 0.1577 22 H -4.2268 -3.3854 0.6676 H 1 UNL1 0.1336 23 H -4.3693 -3.1424 -1.1026 H 1 UNL1 0.1494 24 H -4.2951 0.3344 0.2135 H 1 UNL1 0.1718 25 H -5.3355 -0.8494 -0.6227 H 1 UNL1 0.1487 26 H -5.0648 -0.9779 1.1434 H 1 UNL1 0.1367 27 H -0.6410 -1.1880 1.4140 H 1 UNL1 0.1549 28 H -1.0059 -1.1005 -0.3497 H 1 UNL1 0.1578 29 H -2.3089 0.9760 1.5397 H 1 UNL1 0.1740 30 H 0.9151 2.7764 0.9912 H 1 UNL1 0.1480 31 H -0.8512 3.4552 -0.4641 H 1 UNL1 0.1718 32 H -0.0965 2.4250 -1.6834 H 1 UNL1 0.1910 33 H -1.8459 0.7752 -1.4099 H 1 UNL1 0.1582 34 H -3.2462 2.5377 -1.2332 H 1 UNL1 0.3210 35 H 2.3252 -1.3067 -2.2384 H 1 UNL1 0.3459 36 H 2.4427 1.3215 1.8573 H 1 UNL1 0.1786 37 H 5.3438 -1.0234 1.3184 H 1 UNL1 0.1771 38 H 4.7958 0.3281 2.3207 H 1 UNL1 0.1507 39 H 4.0751 -1.2829 2.5180 H 1 UNL1 0.1631 @BOND 1 35 14 1 2 18 13 2 3 32 9 1 4 33 10 1 5 14 13 ar 6 14 15 ar 7 34 11 1 8 13 12 ar 9 23 1 1 10 19 15 2 11 9 10 1 12 9 31 1 13 9 8 1 14 25 3 1 15 10 11 1 16 10 6 1 17 15 16 ar 18 21 1 1 19 28 5 1 20 1 2 1 21 1 22 1 22 2 3 1 23 2 4 1 24 12 8 1 25 12 17 ar 26 3 24 1 27 3 26 1 28 8 30 1 29 8 7 1 30 5 6 1 31 5 4 1 32 5 27 1 33 16 17 ar 34 16 20 1 35 6 7 1 36 6 29 1 37 17 36 1 38 37 20 1 39 20 38 1 40 20 39 1