@MOLECULE 5-(trifluoromethyl)uracil 15 15 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F -2.3279 -1.4213 -0.0171 F 1 UNL1 -0.2177 2 F -2.2750 0.3899 1.0601 F 1 UNL1 -0.1822 3 F -2.2655 0.4130 -1.0530 F 1 UNL1 -0.1817 4 O -0.1525 2.1265 0.0036 O.2 1 UNL1 -0.4187 5 O 3.7705 -0.1745 -0.0068 O.2 1 UNL1 -0.4666 6 N 1.8092 1.0191 0.0009 N.ar 1 UNL1 -0.6134 7 N 1.8346 -1.3737 0.0042 N.ar 1 UNL1 -0.5116 8 C -0.2619 -0.2562 0.0043 C.ar 1 UNL1 -0.4357 9 C 0.3834 1.0496 0.0036 C.ar 1 UNL1 0.6235 10 C 0.4648 -1.4104 0.0073 C.ar 1 UNL1 0.2324 11 C -1.7492 -0.2176 -0.0009 C.3 1 UNL1 0.5931 12 C 2.5630 -0.1446 -0.0017 C.ar 1 UNL1 0.6925 13 H 0.0082 -2.4151 0.0106 H 1 UNL1 0.1883 14 H 2.3132 1.9126 -0.0008 H 1 UNL1 0.3537 15 H 2.3885 -2.2303 0.0061 H 1 UNL1 0.3442 @BOND 1 3 11 1 2 1 11 1 3 5 12 2 4 12 6 ar 5 12 7 ar 6 11 8 1 7 11 2 1 8 14 6 1 9 6 9 ar 10 4 9 2 11 9 8 ar 12 7 15 1 13 7 10 ar 14 8 10 ar 15 10 13 1