@MOLECULE n-[(1r,3r,5r,7r)-adamantan-2-yl]-n'-[(2e)-3,7-dimethyl-2,6-octadien-1-yl]-1,2-ethanediamine 62 64 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.9644 2.3913 -0.4344 C.3 1 UNL111111111 -0.4624 2 C 4.8689 4.0423 -0.3817 C.3 1 UNL111111111 -0.4584 3 C 5.4257 -2.7998 1.1984 C.3 1 UNL111111111 -0.4621 4 C 5.1495 1.8068 0.6289 C.2 1 UNL111111111 -0.2518 5 C 3.6159 -2.3824 -0.4282 C.2 1 UNL111111111 -0.2917 6 C 4.7393 0.4232 1.0127 C.3 1 UNL111111111 -0.2471 7 C 2.8314 -1.5815 -1.4262 C.3 1 UNL111111111 -0.1035 8 C 0.5096 -1.6181 -0.6058 C.3 1 UNL111111111 -0.1155 9 C -0.5468 -0.7309 0.0990 C.3 1 UNL111111111 -0.1190 10 C 5.3103 -0.5850 -0.0052 C.3 1 UNL111111111 -0.2927 11 C -5.8878 1.1631 -0.2876 C.3 1 UNL111111111 -0.2906 12 C -3.4472 1.3347 -0.8627 C.3 1 UNL111111111 -0.2901 13 C -4.1724 1.2784 1.5435 C.3 1 UNL111111111 -0.2910 14 C -4.6971 -0.8085 -1.2859 C.3 1 UNL111111111 -0.2918 15 C -5.4104 -0.8707 1.1165 C.3 1 UNL111111111 -0.2946 16 N 1.7328 -0.8063 -0.8036 N.3 1 UNL111111111 -0.5446 17 N -1.8811 -1.2798 -0.2263 N.3 1 UNL111111111 -0.5675 18 C 4.3670 2.6810 -0.0190 C.2 1 UNL111111111 0.0691 19 C 4.7089 -1.9404 0.2076 C.2 1 UNL111111111 0.0612 20 C -4.7977 0.7275 -1.2848 C.3 1 UNL111111111 -0.0844 21 C -5.5220 0.6661 1.1238 C.3 1 UNL111111111 -0.0822 22 C -3.0777 0.8517 0.5486 C.3 1 UNL111111111 -0.1426 23 C -4.3196 -1.3064 0.1206 C.3 1 UNL111111111 -0.1068 24 C -2.9675 -0.6996 0.5874 C.3 1 UNL111111111 0.0372 25 H 2.3307 2.1380 0.4268 H 1 UNL111111111 0.1554 26 H 2.4853 3.2336 -0.9481 H 1 UNL111111111 0.1514 27 H 2.9179 1.5336 -1.1273 H 1 UNL111111111 0.1765 28 H 4.2401 4.8275 0.0614 H 1 UNL111111111 0.1541 29 H 5.8966 4.2229 -0.0427 H 1 UNL111111111 0.1486 30 H 4.8565 4.1880 -1.4714 H 1 UNL111111111 0.1556 31 H 6.3707 -3.1745 0.7785 H 1 UNL111111111 0.1595 32 H 5.6746 -2.2414 2.1117 H 1 UNL111111111 0.1578 33 H 4.8404 -3.6761 1.5054 H 1 UNL111111111 0.1529 34 H 6.1691 2.0627 0.9074 H 1 UNL111111111 0.1462 35 H 3.2138 -3.3734 -0.2340 H 1 UNL111111111 0.1503 36 H 5.1027 0.1787 2.0308 H 1 UNL111111111 0.1396 37 H 3.6377 0.3253 1.0660 H 1 UNL111111111 0.1398 38 H 3.4767 -0.8387 -1.9547 H 1 UNL111111111 0.1462 39 H 2.4225 -2.2371 -2.2260 H 1 UNL111111111 0.1418 40 H 0.6796 -2.5451 -0.0223 H 1 UNL111111111 0.1240 41 H 0.1418 -1.9346 -1.6065 H 1 UNL111111111 0.1452 42 H -0.3995 -0.7607 1.1981 H 1 UNL111111111 0.1357 43 H -0.4245 0.3267 -0.2246 H 1 UNL111111111 0.1297 44 H 5.1170 -0.2167 -1.0345 H 1 UNL111111111 0.1551 45 H 6.4137 -0.6208 0.0836 H 1 UNL111111111 0.1487 46 H -5.9901 2.2619 -0.2904 H 1 UNL111111111 0.1338 47 H -6.8684 0.7596 -0.5929 H 1 UNL111111111 0.1339 48 H -2.6583 1.0593 -1.5840 H 1 UNL111111111 0.1340 49 H -3.5050 2.4375 -0.8818 H 1 UNL111111111 0.1358 50 H -4.2487 2.3793 1.5754 H 1 UNL111111111 0.1362 51 H -3.9084 0.9593 2.5667 H 1 UNL111111111 0.1336 52 H -5.6607 -1.2523 -1.5944 H 1 UNL111111111 0.1366 53 H -3.9598 -1.1480 -2.0331 H 1 UNL111111111 0.1319 54 H -5.1776 -1.2427 2.1292 H 1 UNL111111111 0.1346 55 H -6.3788 -1.3217 0.8381 H 1 UNL111111111 0.1367 56 H 2.0493 -0.4132 0.0844 H 1 UNL111111111 0.2531 57 H -2.0730 -1.1777 -1.2224 H 1 UNL111111111 0.2577 58 H -5.0627 1.0835 -2.3048 H 1 UNL111111111 0.1222 59 H -6.3114 0.9773 1.8429 H 1 UNL111111111 0.1220 60 H -2.1086 1.3024 0.8536 H 1 UNL111111111 0.1281 61 H -4.2310 -2.4162 0.1127 H 1 UNL111111111 0.1409 62 H -2.7760 -1.0172 1.6459 H 1 UNL111111111 0.1371 @BOND 1 1 18 1 2 1 25 1 3 1 26 1 4 1 27 1 5 2 28 1 6 2 29 1 7 2 30 1 8 3 19 1 9 3 31 1 10 3 32 1 11 3 33 1 12 4 6 1 13 4 18 2 14 4 34 1 15 5 7 1 16 5 19 2 17 5 35 1 18 6 36 1 19 6 37 1 20 7 16 1 21 7 38 1 22 7 39 1 23 8 16 1 24 8 9 1 25 8 40 1 26 8 41 1 27 9 42 1 28 9 43 1 29 10 6 1 30 10 44 1 31 10 45 1 32 11 46 1 33 11 47 1 34 12 20 1 35 12 48 1 36 12 49 1 37 13 21 1 38 13 50 1 39 13 51 1 40 14 52 1 41 14 53 1 42 15 54 1 43 15 55 1 44 16 56 1 45 17 9 1 46 17 24 1 47 17 57 1 48 18 2 1 49 19 10 1 50 20 11 1 51 20 14 1 52 20 58 1 53 21 11 1 54 21 15 1 55 21 59 1 56 22 12 1 57 22 13 1 58 22 24 1 59 22 60 1 60 23 14 1 61 23 15 1 62 23 61 1 63 24 23 1 64 24 62 1