@MOLECULE urea 8 7 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -1.1819 0.6492 -0.0002 N.am 1 UNL1 -0.7225 2 C 0.0000 -0.0826 -0.0001 C.2 1 UNL1 0.7388 3 N 1.1823 0.6485 0.0005 N.am 1 UNL1 -0.7224 4 O -0.0004 -1.2996 0.0000 O.2 1 UNL1 -0.5505 5 H -1.2193 1.6391 0.0019 H 1 UNL1 0.3033 6 H -2.0496 0.1516 -0.0003 H 1 UNL1 0.3250 7 H 2.0498 0.1506 -0.0025 H 1 UNL1 0.3250 8 H 1.2200 1.6384 -0.0031 H 1 UNL1 0.3033 @BOND 1 8 3 1 2 7 3 1 3 6 1 1 4 1 2 am 5 1 5 1 6 2 4 2 7 2 3 am