@MOLECULE (3e)-4-(2-amino-4-oxo-1,4-dihydro-6-pteridinyl)-2-hydroxy-3-buten-1-yl dihydrogen phosphate 34 35 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P -3.9309 1.4073 0.0253 P.3 1 UNL1 0.3562 2 O -3.4067 -0.0679 -0.2573 O.3 1 UNL1 -0.2870 3 O -2.9172 -3.4938 0.4250 O.3 1 UNL1 -0.5468 4 O -3.1929 1.9288 1.3448 O.3 1 UNL1 -0.4288 5 O -5.4240 1.2962 0.5588 O.3 1 UNL1 -0.3065 6 O 2.8108 -0.3725 2.5643 O.2 1 UNL1 -0.3539 7 O -3.7782 2.1450 -1.2105 O.2 1 UNL1 -0.1955 8 N 1.3103 -0.5665 0.1461 N.ar 1 UNL1 -0.2379 9 N 4.6053 0.5885 -0.9731 N.ar 1 UNL1 -0.5214 10 N 2.6764 0.0796 -2.2235 N.ar 1 UNL1 -0.3860 11 N 4.6342 0.3557 1.4289 N.ar 1 UNL1 -0.6241 12 N 6.5779 0.9600 0.2830 N.pl3 1 UNL1 -0.6016 13 C -2.6777 -2.2319 -0.1510 C.3 1 UNL1 0.1139 14 C -3.4529 -1.1615 0.6729 C.3 1 UNL1 -0.0676 15 C -1.2223 -1.8922 -0.1822 C.2 1 UNL1 -0.1287 16 C 0.6988 -0.6407 -1.0480 C.ar 1 UNL1 0.0642 17 C 2.5926 -0.1839 0.1878 C.ar 1 UNL1 -0.1176 18 C -0.7070 -1.0406 -1.0779 C.2 1 UNL1 -0.1734 19 C 3.2838 0.1528 -1.0087 C.ar 1 UNL1 0.2872 20 C 1.3975 -0.3109 -2.2432 C.ar 1 UNL1 0.0370 21 C 3.3053 -0.0993 1.5078 C.ar 1 UNL1 0.5950 22 C 5.2305 0.6347 0.2941 C.ar 1 UNL1 0.5934 23 H -3.1275 -2.3421 -1.1696 H 1 UNL1 0.1698 24 H -4.4915 -1.5029 0.8457 H 1 UNL1 0.1390 25 H -2.9582 -0.9564 1.6377 H 1 UNL1 0.1305 26 H -0.6082 -2.3592 0.5935 H 1 UNL1 0.1693 27 H -1.3167 -0.5747 -1.8576 H 1 UNL1 0.1796 28 H 0.9187 -0.3674 -3.2304 H 1 UNL1 0.1961 29 H 5.1021 0.7390 -1.8452 H 1 UNL1 0.3428 30 H -2.4453 -3.6003 1.2747 H 1 UNL1 0.3153 31 H 7.0229 1.0510 1.1878 H 1 UNL1 0.3314 32 H 6.9490 1.5403 -0.4416 H 1 UNL1 0.3039 33 H -2.1819 1.9156 1.2091 H 1 UNL1 0.3377 34 H -5.4340 1.4382 1.5765 H 1 UNL1 0.3143 @BOND 1 28 20 1 2 20 10 ar 3 20 16 ar 4 10 19 ar 5 27 18 1 6 29 9 1 7 7 1 2 8 23 13 1 9 18 16 1 10 18 15 2 11 16 8 ar 12 19 9 ar 13 19 17 ar 14 9 22 ar 15 32 12 1 16 2 1 1 17 2 14 1 18 15 13 1 19 15 26 1 20 13 3 1 21 13 14 1 22 1 5 1 23 1 4 1 24 8 17 ar 25 17 21 ar 26 12 22 1 27 12 31 1 28 22 11 ar 29 3 30 1 30 5 34 1 31 14 24 1 32 14 25 1 33 33 4 1 34 11 21 ar 35 21 6 2