@MOLECULE 7-{[(1,3-dihydroxy-2-propanyl)amino]methyl}-1,5-dihydro-4h-pyrrolo[3,2-d]pyrimidin-4-one 17 16 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.2642 -0.8906 2.8284 O.2 1 UNL1 -0.4384 2 O 5.5788 0.7590 -1.0645 O.3 1 UNL1 -0.2697 3 O -4.9394 -0.3945 0.8951 O.2 1 UNL1 -0.1118 4 N 2.0367 -0.2103 -0.8308 N.pl3 1 UNL1 0.3965 5 N -2.3880 -2.0869 -0.7348 N.pl3 1 UNL1 -0.1948 6 N -1.4122 1.3771 -0.3849 N.2 1 UNL1 -0.3509 7 N -3.0473 3.1145 0.3902 N.1 1 UNL1 -0.2350 8 C 3.2366 0.1064 -0.8901 C.1 1 UNL1 -0.6389 9 C 0.9166 -0.5239 -0.7635 C.3 1 UNL1 -0.1237 10 C -0.4108 -0.8624 -0.7029 C.2 1 UNL1 -0.0097 11 C -1.5687 0.1073 -0.4245 C.2 1 UNL1 0.3315 12 CA -2.7163 -0.8156 -0.1225 C.2 1 UNL1 -0.3466 13 C 3.8524 0.0333 2.5146 C.2 1 UNL1 0.4381 14 C 4.4616 0.4528 -0.9847 C.1 1 UNL1 0.6138 15 C -1.1062 -2.0337 -0.8045 C.2 1 UNL1 0.1770 16 C -3.9166 -0.5822 0.4075 C.1 1 UNL1 0.5458 17 C -2.3383 2.2596 0.0481 C.1 1 UNL1 0.2167 @BOND 1 2 14 1 2 14 8 3 3 8 4 1 4 4 9 1 5 15 5 1 6 15 10 2 7 9 10 1 8 5 12 1 9 10 11 1 10 11 6 2 11 11 12 1 12 6 17 1 13 12 16 2 14 17 7 3 15 16 3 2 16 13 1 2