@MOLECULE 2-amino-n-(3-aminopropyl)-4-oxo-4,7-dihydro-1h-pyrrolo[2,3-d]pyrimidine-5-carboxamide 18 17 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 0.2960 3.9158 0.7459 O.3 1 UNL1 -0.1431 2 O 1.2204 -0.5430 0.4732 O.2 1 UNL1 -0.4782 3 N -3.1271 0.9033 -0.8228 N.1 1 UNL1 -0.5813 4 N 2.7078 1.9672 -0.5032 N.1 2 UNL2 -0.2051 5 N -2.7201 -1.2473 -0.1724 N.2 1 UNL1 -0.4053 6 N -0.4819 -2.0114 0.5527 N.am 1 UNL1 -0.5453 7 N 3.5873 -2.4820 -1.0341 N.1 2 UNL2 -0.1373 8 N -2.3426 -3.3689 0.6873 N.pl3 1 UNL1 0.1072 9 C -0.9227 0.4202 0.1624 C.3 1 UNL1 -0.0435 10 C -0.5755 1.6602 0.3338 C.1 1 UNL1 -0.3430 11 C -2.2784 -0.0148 -0.2759 C.2 1 UNL1 0.4932 12 C 3.1097 0.9183 -0.2080 C.1 2 UNL2 0.0156 13 C 3.6009 -0.3004 0.3248 C.3 2 UNL2 0.3407 14 C -3.8744 1.6963 -1.3178 C.1 1 UNL1 0.4859 15 C -0.0767 2.8385 0.5535 C.1 1 UNL1 0.5207 16 C 0.0279 -0.7368 0.4106 C.2 1 UNL1 0.5813 17 C 3.5601 -1.4628 -0.4784 C.1 2 UNL2 -0.0237 18 C -1.8193 -2.2354 0.3783 C.2 1 UNL1 0.3614 @BOND 1 14 3 3 2 7 17 3 3 3 11 1 4 4 12 3 5 17 13 1 6 11 5 2 7 11 9 1 8 12 13 1 9 5 18 2 10 9 10 1 11 9 16 1 12 10 15 3 13 18 6 1 14 18 8 1 15 16 2 2 16 16 6 am 17 15 1 1