@MOLECULE n,n,n-trimethyl-3-(2,2,2-trifluoro-1,1-dihydroxyethyl)anilinium 17 17 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 F 2.8193 0.0641 0.3149 F 1 UNL1 -0.1952 2 F 1.9396 1.6817 1.3596 F 1 UNL1 -0.1549 3 F 2.6770 1.9612 -0.6056 F 1 UNL1 -0.1858 4 O 0.5306 -2.3734 0.4728 O.2 1 UNL1 -0.3549 5 O 2.8488 -2.6020 0.2955 O.2 1 UNL1 -0.3007 6 N -2.9240 0.4052 0.6029 N.pl3 1 UNL1 -0.2531 7 C -1.7848 0.3443 -0.1593 C.ar 1 UNL1 0.0987 8 C -3.6147 0.6990 1.6660 C.3 1 UNL1 0.5790 9 C -5.2435 -0.6531 -0.1831 C.2 1 UNL1 0.3803 10 C -4.2183 -0.0989 0.3340 C.2 1 UNL1 -0.8112 11 C -0.5150 0.7216 0.2411 C.ar 1 UNL1 -0.1385 12 C 0.6849 0.7181 -0.4037 C.ar 1 UNL1 -0.1960 13 C 1.6913 -2.4981 0.3934 C.1 1 UNL1 0.6553 14 C -1.6497 -0.0894 -1.4783 C.ar 1 UNL1 0.2588 15 C 0.4330 0.2284 -1.6852 C.ar 1 UNL1 0.3147 16 C -0.6386 -0.1897 -2.3065 C.ar 1 UNL1 -0.2772 17 C 2.0020 1.1091 0.1644 C.3 1 UNL1 0.5806 @BOND 1 16 15 ar 2 16 14 ar 3 15 12 ar 4 14 7 ar 5 3 17 1 6 12 17 1 7 12 11 ar 8 9 10 2 9 7 11 ar 10 7 6 1 11 17 1 1 12 17 2 1 13 5 13 2 14 10 6 1 15 10 8 1 16 13 4 2 17 6 8 1