@MOLECULE 4-amino-1-cyclohexyl-2(1h)-pyrimidinone 29 30 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.7539 2.2551 0.0003 O.2 1 UNL1 -0.4779 2 N -0.3235 0.0127 -0.0002 N.ar 1 UNL1 -0.4773 3 N -2.5896 0.8753 -0.0048 N.ar 1 UNL1 -0.6261 4 N -4.3907 -0.5536 0.0046 N.pl3 1 UNL1 -0.5939 5 C 1.1313 0.2809 -0.0008 C.3 1 UNL1 0.0827 6 C 1.7864 -0.2937 1.2710 C.3 1 UNL1 -0.3022 7 C 1.7869 -0.2978 -1.2708 C.3 1 UNL1 -0.3022 8 C 3.2824 0.0395 1.2621 C.3 1 UNL1 -0.2568 9 C 3.2830 0.0361 -1.2615 C.3 1 UNL1 -0.2567 10 C 3.9543 -0.5195 0.0011 C.3 1 UNL1 -0.2680 11 C -0.7959 -1.2638 0.0005 C.ar 1 UNL1 0.1824 12 C -1.2477 1.1539 -0.0017 C.ar 1 UNL1 0.7096 13 C -2.1462 -1.5230 0.0006 C.ar 1 UNL1 -0.4962 14 C -3.0313 -0.3935 -0.0009 C.ar 1 UNL1 0.5094 15 H 1.2676 1.4030 -0.0026 H 1 UNL1 0.1873 16 H 1.6417 -1.3861 1.3349 H 1 UNL1 0.1375 17 H 1.3027 0.1339 2.1703 H 1 UNL1 0.1520 18 H 1.3036 0.1265 -2.1718 H 1 UNL1 0.1519 19 H 1.6430 -1.3905 -1.3309 H 1 UNL1 0.1375 20 H 3.7664 -0.3733 2.1664 H 1 UNL1 0.1348 21 H 3.4283 1.1359 1.3155 H 1 UNL1 0.1450 22 H 3.4282 1.1326 -1.3171 H 1 UNL1 0.1451 23 H 3.7678 -0.3782 -2.1647 H 1 UNL1 0.1348 24 H 5.0304 -0.2666 0.0013 H 1 UNL1 0.1326 25 H 3.9035 -1.6239 0.0028 H 1 UNL1 0.1348 26 H -0.0631 -2.0835 0.0013 H 1 UNL1 0.1636 27 H -2.5304 -2.5305 0.0021 H 1 UNL1 0.1827 28 H -4.9870 0.2526 -0.0004 H 1 UNL1 0.3249 29 H -4.8077 -1.4552 -0.0024 H 1 UNL1 0.3088 @BOND 1 18 7 1 2 23 9 1 3 19 7 1 4 22 9 1 5 7 9 1 6 7 5 1 7 9 10 1 8 3 12 ar 9 3 14 ar 10 15 5 1 11 29 4 1 12 12 2 ar 13 12 1 2 14 14 13 ar 15 14 4 1 16 5 2 1 17 5 6 1 18 28 4 1 19 2 11 ar 20 11 13 ar 21 11 26 1 22 13 27 1 23 10 24 1 24 10 25 1 25 10 8 1 26 8 6 1 27 8 21 1 28 8 20 1 29 6 16 1 30 6 17 1