@MOLECULE deoxycytidine diphosphate 39 40 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 2.8092 -1.3888 -1.1996 C.3 1 UNL1 0.3112 2 C 0.5266 -1.0628 -0.7518 C.3 1 UNL1 0.0487 3 C 0.9938 -2.1747 0.2107 C.3 1 UNL1 0.1368 4 C 0.0952 0.2346 -0.0465 C.3 1 UNL1 -0.0461 5 H 0.2541 -3.9764 0.6126 H 1 UNL1 0.3286 6 H 5.5856 3.2132 1.7578 H 1 UNL1 0.3272 7 H 6.3444 3.4700 0.2379 H 1 UNL1 0.3111 8 O -1.9844 -0.3345 2.4503 O.2 1 UNL1 -0.2142 9 O -5.6691 1.6302 0.1864 O.2 1 UNL1 -0.1587 10 O 2.7595 -0.4953 1.4734 O.2 1 UNL1 -0.5018 11 C 2.4275 -2.5203 -0.2374 C.3 1 UNL1 -0.3834 12 O -2.6400 -1.7603 0.3673 O.3 1 UNL1 -0.4106 13 O 0.1139 -3.2575 -0.0325 O.3 1 UNL1 -0.5889 14 O -4.7578 -0.0309 -1.5669 O.3 1 UNL1 -0.3864 15 O -3.6450 2.1760 -1.2259 O.3 1 UNL1 -0.3223 16 O -3.6201 0.4868 0.7505 O.3 1 UNL1 -0.1024 17 O -1.3258 0.3275 -0.0444 O.3 1 UNL1 -0.3396 18 C 3.5124 0.1223 0.7588 C.ar 1 UNL1 0.7264 19 C 5.0493 1.8587 0.3016 C.ar 1 UNL1 0.5064 20 H -1.7767 -2.3013 0.2555 H 1 UNL1 0.3344 21 H -4.3359 -0.9198 -1.2816 H 1 UNL1 0.3374 22 H -2.7364 1.7751 -1.4954 H 1 UNL1 0.3228 23 O 1.6251 -0.7465 -1.6081 O.3 1 UNL1 -0.4403 24 N 5.7194 2.9391 0.8008 N.pl3 1 UNL1 -0.5820 25 C 4.4865 0.3583 -1.4822 C.ar 1 UNL1 0.1882 26 C 5.2117 1.4431 -1.0664 C.ar 1 UNL1 -0.4750 27 P -2.3058 -0.3489 1.0399 P.3 1 UNL1 0.3431 28 P -4.4973 1.0826 -0.4627 P.3 1 UNL1 0.3823 29 N 3.6842 -0.3438 -0.6177 N.ar 1 UNL1 -0.5181 30 N 4.2329 1.2207 1.1541 N.ar 1 UNL1 -0.6273 31 H 3.2689 -1.7590 -2.1507 H 1 UNL1 0.1398 32 H -0.2538 -1.4324 -1.4616 H 1 UNL1 0.1736 33 H 0.9371 -1.9018 1.2871 H 1 UNL1 0.1652 34 H 2.4432 -3.4951 -0.7589 H 1 UNL1 0.1681 35 H 3.1191 -2.6108 0.6187 H 1 UNL1 0.1862 36 H 0.5767 0.3685 0.9431 H 1 UNL1 0.1585 37 H 0.3558 1.1191 -0.6736 H 1 UNL1 0.1478 38 H 4.5371 0.0085 -2.5244 H 1 UNL1 0.1671 39 H 5.8698 1.9791 -1.7345 H 1 UNL1 0.1864 @BOND 1 38 25 1 2 31 1 1 3 39 26 1 4 23 1 1 5 23 2 1 6 14 21 1 7 14 28 1 8 22 15 1 9 25 26 ar 10 25 29 ar 11 32 2 1 12 15 28 1 13 1 29 1 14 1 11 1 15 26 19 ar 16 34 11 1 17 2 4 1 18 2 3 1 19 37 4 1 20 29 18 ar 21 28 9 2 22 28 16 1 23 11 3 1 24 11 35 1 25 4 17 1 26 4 36 1 27 17 27 1 28 13 3 1 29 13 5 1 30 3 33 1 31 7 24 1 32 20 12 1 33 19 24 1 34 19 30 ar 35 12 27 1 36 16 27 1 37 18 30 ar 38 18 10 2 39 24 6 1 40 27 8 2