@MOLECULE 2',5'-dideoxy-5'-(tritylamino)uridine 62 66 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N 3.1939 0.1648 0.6717 N.ar 1 UNL1 -0.5149 2 O 1.9204 4.6074 0.5120 O.3 1 UNL1 -0.5554 3 C 4.4119 -0.1789 0.0434 C.ar 1 UNL1 0.7030 4 N -0.6950 0.6747 0.7887 N.3 1 UNL1 -0.5549 5 O 5.3020 0.6400 -0.0802 O.2 1 UNL1 -0.5426 6 N 4.5311 -1.4810 -0.4302 N.ar 1 UNL1 -0.6285 7 C 3.5188 -2.4803 -0.2776 C.ar 1 UNL1 0.6278 8 O 3.7589 -3.5655 -0.7526 O.2 1 UNL1 -0.4928 9 C 2.3390 -2.0481 0.4337 C.ar 1 UNL1 -0.4580 10 C 2.1976 -0.7738 0.8775 C.ar 1 UNL1 0.1952 11 C 3.0792 1.5500 1.2224 C.3 1 UNL1 0.3323 12 C -1.7701 -0.0616 0.0617 C.3 1 UNL1 0.1789 13 C -2.7801 0.8768 -0.6015 C.ar 1 UNL1 -0.0587 14 C -3.1131 2.0887 0.0074 C.ar 1 UNL1 -0.1636 15 C 3.3210 2.6352 0.1577 C.3 1 UNL1 -0.3941 16 C -4.0436 2.9419 -0.5818 C.ar 1 UNL1 -0.1381 17 C -4.6611 2.5855 -1.7783 C.ar 1 UNL1 -0.1509 18 C -4.3524 1.3658 -2.3771 C.ar 1 UNL1 -0.1358 19 C -3.4203 0.5147 -1.7890 C.ar 1 UNL1 -0.1666 20 C -1.0806 -0.9751 -0.9493 C.ar 1 UNL1 -0.0147 21 C -0.6445 -0.4640 -2.1767 C.ar 1 UNL1 -0.1749 22 C 0.0390 -1.2751 -3.0771 C.ar 1 UNL1 -0.1451 23 C 0.2837 -2.6120 -2.7674 C.ar 1 UNL1 -0.1391 24 C -0.1641 -3.1312 -1.5563 C.ar 1 UNL1 -0.1335 25 C -0.8395 -2.3156 -0.6491 C.ar 1 UNL1 -0.1496 26 C 1.9567 3.3112 -0.0434 C.3 1 UNL1 0.1150 27 C -2.5279 -0.8963 1.0976 C.ar 1 UNL1 -0.0368 28 C -1.9086 -1.2813 2.2899 C.ar 1 UNL1 -0.1452 29 C -2.5990 -2.0469 3.2263 C.ar 1 UNL1 -0.1482 30 C -3.9099 -2.4461 2.9757 C.ar 1 UNL1 -0.1493 31 C -4.5247 -2.0820 1.7800 C.ar 1 UNL1 -0.1407 32 C -3.8362 -1.3130 0.8446 C.ar 1 UNL1 -0.1594 33 C 0.9767 2.4867 0.8224 C.3 1 UNL1 0.0797 34 O 1.7740 1.7064 1.7099 O.3 1 UNL1 -0.3909 35 C 0.1105 1.5761 -0.0602 C.3 1 UNL1 -0.1669 36 H 2.5946 5.1865 0.1065 H 1 UNL1 0.3225 37 H -1.0849 1.1783 1.5885 H 1 UNL1 0.2689 38 H 1.5590 -2.7940 0.5744 H 1 UNL1 0.2069 39 H 1.2865 -0.4251 1.4076 H 1 UNL1 0.2262 40 H 3.7390 1.6246 2.1218 H 1 UNL1 0.1586 41 H -2.6624 2.3772 0.9550 H 1 UNL1 0.1494 42 H 4.0849 3.3539 0.5086 H 1 UNL1 0.1786 43 H 3.7266 2.2271 -0.7864 H 1 UNL1 0.1885 44 H -4.2922 3.8864 -0.1012 H 1 UNL1 0.1509 45 H -5.3861 3.2525 -2.2392 H 1 UNL1 0.1498 46 H -4.8415 1.0746 -3.3053 H 1 UNL1 0.1526 47 H -3.2000 -0.4439 -2.2628 H 1 UNL1 0.1660 48 H -0.8429 0.5740 -2.4399 H 1 UNL1 0.1517 49 H 0.3835 -0.8642 -4.0235 H 1 UNL1 0.1470 50 H 0.8279 -3.2451 -3.4652 H 1 UNL1 0.1515 51 H 0.0240 -4.1754 -1.3093 H 1 UNL1 0.1547 52 H -1.1707 -2.7409 0.2989 H 1 UNL1 0.1643 53 H 1.6601 3.3859 -1.1089 H 1 UNL1 0.1312 54 H -0.8737 -0.9972 2.4914 H 1 UNL1 0.1714 55 H -2.1094 -2.3364 4.1540 H 1 UNL1 0.1485 56 H -4.4497 -3.0422 3.7075 H 1 UNL1 0.1464 57 H -5.5453 -2.3978 1.5726 H 1 UNL1 0.1508 58 H -4.3343 -1.0444 -0.0865 H 1 UNL1 0.1606 59 H 0.3814 3.1255 1.5123 H 1 UNL1 0.1684 60 H 0.7668 0.9360 -0.6991 H 1 UNL1 0.1708 61 H -0.5085 2.2003 -0.7431 H 1 UNL1 0.1385 62 H 5.4021 -1.7344 -0.9008 H 1 UNL1 0.3429 @BOND 1 49 22 1 2 50 23 1 3 46 18 1 4 22 23 ar 5 22 21 ar 6 23 24 ar 7 48 21 1 8 18 19 ar 9 18 17 ar 10 47 19 1 11 45 17 1 12 21 20 ar 13 19 13 ar 14 17 16 ar 15 24 51 1 16 24 25 ar 17 53 26 1 18 20 25 ar 19 20 12 1 20 62 6 1 21 43 15 1 22 8 7 2 23 61 35 1 24 60 35 1 25 25 52 1 26 13 14 ar 27 13 12 1 28 16 44 1 29 16 14 ar 30 6 7 ar 31 6 3 ar 32 7 9 ar 33 58 32 1 34 5 3 2 35 35 4 1 36 35 33 1 37 26 15 1 38 26 2 1 39 26 33 1 40 14 41 1 41 3 1 ar 42 12 4 1 43 12 27 1 44 36 2 1 45 15 42 1 46 15 11 1 47 9 38 1 48 9 10 ar 49 1 10 ar 50 1 11 1 51 4 37 1 52 33 59 1 53 33 34 1 54 32 27 ar 55 32 31 ar 56 10 39 1 57 27 28 ar 58 11 34 1 59 11 40 1 60 57 31 1 61 31 30 ar 62 28 54 1 63 28 29 ar 64 30 29 ar 65 30 56 1 66 29 55 1