@MOLECULE p-quaterphenyl 42 45 0 0 0 SMALL USER_CHARGES @ATOM 1 C -7.0825 -1.2064 -0.0015 C.ar 1 UNL111111111 -0.1808 2 C -5.6900 -1.2095 0.0021 C.ar 1 UNL111111111 -0.1908 3 C -4.9904 0.0001 -0.0010 C.ar 1 UNL111111111 0.0921 4 C -5.6893 1.2101 -0.0074 C.ar 1 UNL111111111 -0.2426 5 C -7.0820 1.2080 -0.0148 C.ar 1 UNL111111111 -0.1940 6 C -7.7792 0.0010 -0.0115 C.ar 1 UNL111111111 -0.1768 7 C -3.5227 -0.0004 0.0030 C.ar 1 UNL111111111 -0.0440 8 C -2.8221 -0.6346 -1.0265 C.ar 1 UNL111111111 -0.1797 9 C -1.4310 -0.6356 -1.0237 C.ar 1 UNL111111111 -0.2474 10 C -0.7336 -0.0017 0.0080 C.ar 1 UNL111111111 0.0675 11 C -1.4341 0.6329 1.0371 C.ar 1 UNL111111111 -0.2424 12 C -2.8253 0.6332 1.0349 C.ar 1 UNL111111111 -0.1662 13 C 0.7339 -0.0011 0.0087 C.ar 1 UNL111111111 0.0332 14 C 1.4333 -1.2102 0.0435 C.ar 1 UNL111111111 -0.1756 15 C 2.8245 -1.2094 0.0467 C.ar 1 UNL111111111 -0.2575 16 C 3.5227 0.0003 0.0053 C.ar 1 UNL111111111 0.1009 17 C 2.8234 1.2094 -0.0337 C.ar 1 UNL111111111 -0.2536 18 C 1.4323 1.2087 -0.0267 C.ar 1 UNL111111111 -0.2376 19 C 4.9905 0.0007 -0.0002 C.ar 1 UNL111111111 0.0306 20 C 5.6942 -0.5616 1.0678 C.ar 1 UNL111111111 -0.2150 21 C 7.0868 -0.5578 1.0604 C.ar 1 UNL111111111 -0.1403 22 C 7.7789 0.0012 -0.0130 C.ar 1 UNL111111111 -0.2075 23 C 7.0771 0.5598 -1.0802 C.ar 1 UNL111111111 -0.1770 24 C 5.6845 0.5629 -1.0748 C.ar 1 UNL111111111 -0.2534 25 H -7.6269 -2.1486 0.0038 H 1 UNL111111111 0.1930 26 H -5.1439 -2.1511 0.0128 H 1 UNL111111111 0.2042 27 H -5.1426 2.1514 -0.0132 H 1 UNL111111111 0.1825 28 H -7.6258 2.1505 -0.0239 H 1 UNL111111111 0.1728 29 H -8.8668 0.0013 -0.0163 H 1 UNL111111111 0.1763 30 H -3.3677 -1.1220 -1.8328 H 1 UNL111111111 0.1783 31 H -0.8830 -1.1243 -1.8279 H 1 UNL111111111 0.1936 32 H -0.8886 1.1215 1.8430 H 1 UNL111111111 0.2087 33 H -3.3736 1.1214 1.8390 H 1 UNL111111111 0.1958 34 H 0.8871 -2.1517 0.0737 H 1 UNL111111111 0.2077 35 H 3.3721 -2.1501 0.0753 H 1 UNL111111111 0.2199 36 H 3.3703 2.1505 -0.0639 H 1 UNL111111111 0.1964 37 H 0.8851 2.1495 -0.0555 H 1 UNL111111111 0.1897 38 H 5.1512 -0.9959 1.9054 H 1 UNL111111111 0.2100 39 H 7.6349 -0.9923 1.8941 H 1 UNL111111111 0.1935 40 H 8.8665 0.0014 -0.0179 H 1 UNL111111111 0.1845 41 H 7.6174 0.9940 -1.9191 H 1 UNL111111111 0.1692 42 H 5.1341 0.9965 -1.9078 H 1 UNL111111111 0.1816 @BOND 1 41 23 1 2 42 24 1 3 30 8 1 4 31 9 1 5 23 24 ar 6 23 22 ar 7 24 19 ar 8 8 9 ar 9 8 7 ar 10 9 10 ar 11 36 17 1 12 37 18 1 13 17 18 ar 14 17 16 ar 15 18 13 ar 16 28 5 1 17 40 22 1 18 29 6 1 19 5 6 ar 20 5 4 ar 21 27 4 1 22 22 21 ar 23 6 1 ar 24 4 3 ar 25 1 2 ar 26 1 25 1 27 3 2 ar 28 3 7 1 29 19 16 1 30 19 20 ar 31 2 26 1 32 7 12 ar 33 16 15 ar 34 10 13 1 35 10 11 ar 36 13 14 ar 37 14 15 ar 38 14 34 1 39 15 35 1 40 12 11 ar 41 12 33 1 42 11 32 1 43 21 20 ar 44 21 39 1 45 20 38 1