@MOLECULE n,n,n,n',n',n'-hexamethyl-1,10-decanediaminium 56 55 0 0 0 SMALL USER_CHARGES @ATOM 1 N -7.0012 -0.0420 0.0475 N.4 1 UNL11111111 -0.1287 2 N 6.9970 0.0251 0.0304 N.4 1 UNL11111111 -0.0687 3 C -5.6589 0.7868 -0.0080 C.3 1 UNL11111111 -0.3254 4 C 5.6488 -0.8102 0.0222 C.3 1 UNL11111111 -0.1181 5 C -4.4343 -0.1168 -0.0621 C.3 1 UNL11111111 -0.2390 6 C 4.4356 0.1092 0.0139 C.3 1 UNL11111111 -0.3188 7 C -3.1251 0.6904 -0.0641 C.3 1 UNL11111111 -0.2926 8 C 3.1180 -0.6820 -0.0071 C.3 1 UNL11111111 -0.2633 9 C -1.9203 -0.2587 -0.1270 C.3 1 UNL11111111 -0.2656 10 C 1.9297 0.2921 -0.0238 C.3 1 UNL11111111 -0.2718 11 C -0.5932 0.5104 -0.0662 C.3 1 UNL11111111 -0.2751 12 C 0.5957 -0.4620 -0.0743 C.3 1 UNL11111111 -0.2721 13 C -7.1435 -0.9413 -1.1995 C.3 1 UNL11111111 -0.4410 14 C -7.0484 -0.9220 1.3161 C.3 1 UNL11111111 -0.4424 15 C -8.1953 0.9477 0.0861 C.3 1 UNL11111111 -0.4595 16 C 7.1268 0.8810 -1.2528 C.3 1 UNL11111111 -0.2967 17 C 7.0764 0.9550 1.2646 C.3 1 UNL11111111 -0.2965 18 C 8.1894 -0.9591 0.0835 C.3 1 UNL11111111 -0.3034 19 H -5.6483 1.4259 0.8830 H 1 UNL11111111 0.0835 20 H -5.7238 1.4368 -0.8958 H 1 UNL11111111 0.0831 21 H 5.6777 -1.4532 -0.8658 H 1 UNL11111111 0.1665 22 H 5.6581 -1.4511 0.9177 H 1 UNL11111111 0.1676 23 H -4.4404 -0.8057 0.8030 H 1 UNL11111111 0.1183 24 H -4.4683 -0.7537 -0.9671 H 1 UNL11111111 0.1161 25 H 4.4480 0.7696 0.8984 H 1 UNL11111111 0.1557 26 H 4.4723 0.7783 -0.8650 H 1 UNL11111111 0.1551 27 H -3.1085 1.3838 -0.9247 H 1 UNL11111111 0.1211 28 H -3.0681 1.3188 0.8441 H 1 UNL11111111 0.1212 29 H 3.0578 -1.3464 0.8740 H 1 UNL11111111 0.1482 30 H 3.0854 -1.3434 -0.8922 H 1 UNL11111111 0.1479 31 H -1.9604 -0.8587 -1.0562 H 1 UNL11111111 0.1299 32 H -1.9680 -0.9839 0.7068 H 1 UNL11111111 0.1315 33 H 2.0130 0.9713 -0.8926 H 1 UNL11111111 0.1377 34 H 1.9648 0.9402 0.8717 H 1 UNL11111111 0.1390 35 H -0.5607 1.1392 0.8417 H 1 UNL11111111 0.1326 36 H -0.5199 1.2072 -0.9216 H 1 UNL11111111 0.1310 37 H 0.5509 -1.0961 -0.9789 H 1 UNL11111111 0.1384 38 H 0.5214 -1.1535 0.7840 H 1 UNL11111111 0.1393 39 H -7.0143 -0.3318 -2.0986 H 1 UNL11111111 0.0886 40 H -6.3752 -1.7241 -1.1808 H 1 UNL11111111 0.0842 41 H -8.1307 -1.4046 -1.2090 H 1 UNL11111111 0.0876 42 H -6.8496 -0.3040 2.1874 H 1 UNL11111111 0.0889 43 H -8.0365 -1.3807 1.4114 H 1 UNL11111111 0.0875 44 H -6.2954 -1.7100 1.2488 H 1 UNL11111111 0.0841 45 H -8.1102 1.5766 0.9683 H 1 UNL11111111 0.0887 46 H -8.1650 1.5592 -0.8144 H 1 UNL11111111 0.0897 47 H -9.1259 0.3923 0.1269 H 1 UNL11111111 0.0887 48 H 6.9995 0.2386 -2.1263 H 1 UNL11111111 0.1818 49 H 6.3599 1.6568 -1.2555 H 1 UNL11111111 0.1858 50 H 8.1115 1.3507 -1.2829 H 1 UNL11111111 0.1756 51 H 6.8821 0.3690 2.1644 H 1 UNL11111111 0.1821 52 H 8.0674 1.4043 1.3247 H 1 UNL11111111 0.1755 53 H 6.3294 1.7453 1.1756 H 1 UNL11111111 0.1860 54 H 8.1206 -1.5609 0.9902 H 1 UNL11111111 0.1810 55 H 8.1590 -1.6084 -0.7931 H 1 UNL11111111 0.1809 56 H 9.1297 -0.4018 0.0894 H 1 UNL11111111 0.1781 @BOND 1 48 16 1 2 39 13 1 3 50 16 1 4 49 16 1 5 16 2 1 6 41 13 1 7 13 40 1 8 13 1 1 9 31 9 1 10 37 12 1 11 24 5 1 12 27 7 1 13 36 11 1 14 30 8 1 15 20 3 1 16 33 10 1 17 21 4 1 18 26 6 1 19 46 15 1 20 55 18 1 21 9 11 1 22 9 7 1 23 9 32 1 24 12 11 1 25 12 10 1 26 12 38 1 27 11 35 1 28 7 5 1 29 7 28 1 30 5 3 1 31 5 23 1 32 10 8 1 33 10 34 1 34 8 6 1 35 8 29 1 36 3 1 1 37 3 19 1 38 6 4 1 39 6 25 1 40 4 2 1 41 4 22 1 42 2 18 1 43 2 17 1 44 1 15 1 45 1 14 1 46 18 56 1 47 18 54 1 48 15 47 1 49 15 45 1 50 53 17 1 51 44 14 1 52 17 52 1 53 17 51 1 54 14 43 1 55 14 42 1