@MOLECULE 3-(2-deoxy-5-o-phosphonopentofuranosyl)-4,6,7,8-tetrahydropyrimido[1,2-a]purin-10(3h)-one 26 27 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P -5.4720 -1.6714 -0.0505 P.3 1 UNL1 0.1938 2 O -2.4265 1.4142 -1.7089 O.2 2 UNL2 -0.1521 3 O -2.4358 3.3666 1.0394 O.2 2 UNL2 -0.3149 4 O -4.7985 0.7088 0.6006 O.2 2 UNL2 0.4300 5 O 6.2951 0.0381 -0.3087 O.2 2 UNL2 -0.2344 6 O -5.6655 -0.6099 -1.0516 O.3 1 UNL1 -0.4592 7 O -4.4464 -1.3682 0.9740 O.3 1 UNL1 -0.4747 8 O -6.2114 -2.9153 -0.0500 O.2 1 UNL1 -0.1843 9 N 2.0747 2.0803 0.0784 N.ar 2 UNL2 -0.4513 10 N 4.4336 -1.2801 -0.0295 N.ar 2 UNL2 -0.4793 11 N 2.1126 -0.3683 0.1596 N.ar 2 UNL2 -0.3101 12 N 4.3424 2.3830 -0.1470 N.ar 2 UNL2 -0.4040 13 N 2.4722 -2.7201 0.2350 N.ar 2 UNL2 -0.4495 14 C 0.7490 2.2483 0.1740 C.1 2 UNL2 0.2673 15 C -0.4573 2.3932 0.2443 C.1 2 UNL2 -0.2488 16 C -1.8455 2.5792 0.3492 C.2 2 UNL2 0.4442 17 C -2.6783 1.6605 -0.5719 C.2 2 UNL2 0.3126 18 C -3.8975 1.1555 0.0942 C.1 2 UNL2 0.2300 19 C 2.6738 0.7756 0.0548 C.ar 2 UNL2 0.2479 20 C 4.1634 1.1154 -0.1012 C.ar 2 UNL2 0.0899 21 C 3.0670 3.1094 -0.0377 C.ar 2 UNL2 0.5931 22 C 2.9033 -1.5237 0.1346 C.ar 2 UNL2 0.4897 23 C 5.0022 -2.4860 -0.0301 C.ar 2 UNL2 0.1074 24 C 5.1133 -0.0360 -0.1639 C.ar 2 UNL2 0.5309 25 C 4.4505 -3.6126 0.0792 C.ar 2 UNL2 -0.2820 26 C 3.0943 -4.0243 0.2320 C.ar 2 UNL2 0.5076 @BOND 1 2 17 1 2 6 1 1 3 17 18 2 4 17 16 1 5 5 24 2 6 24 20 ar 7 24 10 ar 8 12 20 ar 9 12 21 ar 10 20 19 ar 11 1 8 2 12 1 7 1 13 21 9 ar 14 23 10 ar 15 23 25 ar 16 10 22 ar 17 19 9 ar 18 19 11 ar 19 9 14 1 20 25 26 ar 21 18 4 2 22 22 11 ar 23 22 13 ar 24 14 15 3 25 26 13 ar 26 15 16 1 27 16 3 2