@MOLECULE 2-deoxy-n-(2,5-diamino-6-oxo-3,6-dihydro-4-pyrimidinyl)-n-formyl-alpha-d-erythro-pentofuranosylamine 35 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* -1.4476 0.5102 0.8179 O.3 1 UNL1 -0.4438 2 O3* -1.1722 0.3445 -2.4858 O.3 1 UNL1 -0.5872 3 O5* -1.5074 3.3959 1.0359 O.3 1 UNL1 -0.5228 4 O -1.5799 -3.5027 0.9628 O.2 1 UNL1 -0.5128 5 O 2.9784 1.4114 1.6332 O.2 1 UNL1 -0.4395 6 N -0.5545 -1.5837 0.3952 N.am 1 UNL1 -0.5555 7 N 1.1101 -0.8447 -1.1525 N.ar 1 UNL1 -0.5242 8 N 0.9795 -0.2896 2.5328 N.pl3 1 UNL1 -0.5472 9 N 3.0105 0.4820 -0.4559 N.ar 1 UNL1 -0.6221 10 N 2.7684 -0.1226 -2.6901 N.pl3 1 UNL1 -0.6046 11 C3* -2.1317 0.6329 -1.4847 C.3 1 UNL1 0.1318 12 C2* -2.5174 -0.7337 -0.9081 C.3 1 UNL1 -0.3699 13 C1* -1.8063 -0.8076 0.4519 C.3 1 UNL1 0.3281 14 C4* -1.4849 1.3933 -0.3073 C.3 1 UNL1 -0.0031 15 C5* -2.2964 2.5990 0.1810 C.3 1 UNL1 -0.0326 16 C 0.6467 -0.8651 0.1937 C.ar 1 UNL1 0.1679 17 C -0.5343 -2.9399 0.7284 C.2 1 UNL1 0.5011 18 C 1.3143 -0.2064 1.1893 C.ar 1 UNL1 -0.0144 19 C 2.3068 -0.1528 -1.3798 C.ar 1 UNL1 0.5695 20 C 2.5152 0.6336 0.8347 C.ar 1 UNL1 0.5811 21 H3* -2.9768 1.1705 -1.9572 H 1 UNL1 0.1340 22 H1* -2.4466 -1.1930 1.2847 H 1 UNL1 0.1674 23 H2*1 -3.6093 -0.8462 -0.7999 H 1 UNL1 0.1694 24 H2*2 -2.2029 -1.5537 -1.5865 H 1 UNL1 0.1937 25 H4* -0.4271 1.6688 -0.5159 H 1 UNL1 0.1637 26 H5*1 -3.2022 2.2835 0.7322 H 1 UNL1 0.1390 27 H5*2 -2.5707 3.2892 -0.6375 H 1 UNL1 0.1469 28 H3* -0.8703 1.1566 -2.9388 H 1 UNL1 0.3324 29 H 0.4531 -3.4208 0.7383 H 1 UNL1 0.1556 30 H 0.3875 -0.8940 -1.8764 H 1 UNL1 0.3492 31 H5* -1.0035 2.8237 1.6550 H 1 UNL1 0.3235 32 H 1.4534 0.3669 3.1381 H 1 UNL1 0.3085 33 H 0.0022 -0.4154 2.7332 H 1 UNL1 0.2897 34 H 3.6993 0.2532 -2.8218 H 1 UNL1 0.3258 35 H 2.5145 -0.8663 -3.3119 H 1 UNL1 0.3015 @BOND 1 35 10 1 2 28 2 1 3 34 10 1 4 10 19 1 5 2 11 1 6 21 11 1 7 30 7 1 8 24 12 1 9 11 12 1 10 11 14 1 11 19 7 ar 12 19 9 ar 13 7 16 ar 14 12 23 1 15 12 13 1 16 27 15 1 17 25 14 1 18 9 20 ar 19 14 15 1 20 14 1 1 21 15 26 1 22 15 3 1 23 16 6 1 24 16 18 ar 25 6 13 1 26 6 17 am 27 13 1 1 28 13 22 1 29 17 29 1 30 17 4 2 31 20 18 ar 32 20 5 2 33 3 31 1 34 18 8 1 35 8 33 1 36 8 32 1