@MOLECULE 2'-deoxy-5-hexyluridine 46 47 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* -2.2050 -1.1581 -0.8075 O.3 1 UNL1 -0.4337 2 O3* -1.2401 -1.8910 2.2136 O.3 1 UNL1 -0.5638 3 O5* -1.9007 -3.7287 -1.9273 O.3 1 UNL1 -0.5254 4 O -3.2931 2.3916 -1.0352 O.2 1 UNL1 -0.5205 5 O 0.8805 3.9521 -0.2336 O.2 1 UNL1 -0.4725 6 N -1.8358 0.9782 0.0270 N.ar 1 UNL1 -0.4934 7 N -1.1886 3.1816 -0.6328 N.ar 1 UNL1 -0.6238 8 C1* -2.8089 -0.1275 -0.0593 C.3 1 UNL1 0.3246 9 C3* -2.4014 -2.0260 1.4209 C.3 1 UNL1 0.1173 10 C2* -3.1629 -0.6949 1.3284 C.3 1 UNL1 -0.4033 11 C4* -1.8683 -2.2861 -0.0023 C.3 1 UNL1 0.0350 12 C5* -2.5271 -3.4897 -0.6878 C.3 1 UNL1 -0.0363 13 C -0.5504 0.7451 0.4982 C.ar 1 UNL1 0.1274 14 C 0.4115 1.6999 0.4466 C.ar 1 UNL1 -0.2673 15 C -2.1779 2.2024 -0.5952 C.ar 1 UNL1 0.7045 16 C 1.7917 1.4510 0.9527 C.3 1 UNL1 -0.2414 17 C 2.5417 0.4896 0.0155 C.3 1 UNL1 -0.2591 18 C 3.9560 0.2188 0.5411 C.3 1 UNL1 -0.2711 19 C 0.1347 3.0071 -0.1331 C.ar 1 UNL1 0.6104 20 C 4.6947 -0.7564 -0.3844 C.3 1 UNL1 -0.2724 21 C 6.1132 -1.0293 0.1323 C.3 1 UNL1 -0.2552 22 C 6.8493 -2.0052 -0.7860 C.3 1 UNL1 -0.4400 23 H1* -3.6943 0.1971 -0.6689 H 1 UNL1 0.1866 24 H3* -3.0131 -2.8536 1.8289 H 1 UNL1 0.1288 25 H2*1 -2.8776 -0.0039 2.1427 H 1 UNL1 0.1830 26 H2*2 -4.2529 -0.8365 1.4233 H 1 UNL1 0.1686 27 H4* -0.7557 -2.3617 -0.0274 H 1 UNL1 0.1760 28 H5*1 -3.6077 -3.3313 -0.8553 H 1 UNL1 0.1300 29 H5*2 -2.3624 -4.4290 -0.1276 H 1 UNL1 0.1482 30 H -0.3649 -0.2533 0.9280 H 1 UNL1 0.1995 31 H 2.3560 2.4079 1.0347 H 1 UNL1 0.1719 32 H 1.7641 1.0391 1.9817 H 1 UNL1 0.1436 33 H3* -1.4618 -1.7619 3.1563 H 1 UNL1 0.3270 34 H 2.5894 0.9230 -1.0024 H 1 UNL1 0.1483 35 H 1.9842 -0.4596 -0.0840 H 1 UNL1 0.1333 36 H 4.5196 1.1677 0.6190 H 1 UNL1 0.1394 37 H 3.9099 -0.1935 1.5658 H 1 UNL1 0.1334 38 H -1.4324 4.0781 -1.0632 H 1 UNL1 0.3471 39 H 4.7400 -0.3454 -1.4104 H 1 UNL1 0.1394 40 H 4.1326 -1.7055 -0.4635 H 1 UNL1 0.1369 41 H5* -1.8978 -2.9008 -2.4603 H 1 UNL1 0.3273 42 H 6.0710 -1.4367 1.1597 H 1 UNL1 0.1315 43 H 6.6785 -0.0809 0.2056 H 1 UNL1 0.1349 44 H 7.8636 -2.2039 -0.4233 H 1 UNL1 0.1398 45 H 6.9353 -1.6091 -1.8041 H 1 UNL1 0.1437 46 H 6.3278 -2.9666 -0.8494 H 1 UNL1 0.1418 @BOND 1 41 3 1 2 3 12 1 3 45 22 1 4 39 20 1 5 38 7 1 6 4 15 2 7 34 17 1 8 28 12 1 9 46 22 1 10 1 8 1 11 1 11 1 12 22 44 1 13 22 21 1 14 12 29 1 15 12 11 1 16 23 8 1 17 7 15 ar 18 7 19 ar 19 15 6 ar 20 40 20 1 21 20 21 1 22 20 18 1 23 5 19 2 24 19 14 ar 25 35 17 1 26 8 6 1 27 8 10 1 28 27 11 1 29 11 9 1 30 17 18 1 31 17 16 1 32 6 13 ar 33 21 43 1 34 21 42 1 35 14 13 ar 36 14 16 1 37 13 30 1 38 18 36 1 39 18 37 1 40 16 31 1 41 16 32 1 42 10 9 1 43 10 26 1 44 10 25 1 45 9 24 1 46 9 2 1 47 2 33 1