@MOLECULE 6-amino-9-methyl-7-{(2e)-3-methyl-5-[(1s,2r,4ar,8ar)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]-2-penten-1-yl}-7h-purin-9-ium 32 34 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N 4.5038 -1.1190 0.2510 N.3 1 UNL1 -0.3001 2 N 4.9046 1.1624 -1.6652 N.1 1 UNL1 -0.6070 3 N 7.1375 0.8738 -1.3698 N.2 1 UNL1 -0.3791 4 N 9.3183 0.1079 -0.3977 N.1 1 UNL1 -0.2287 5 N 6.1549 0.9892 2.5281 N.1 1 UNL1 -0.1914 6 C -4.1358 1.8229 0.8632 C.1 1 UNL1 -0.1032 7 C -2.7827 -0.3966 0.5518 C.3 1 UNL1 0.2570 8 C -7.3415 -0.6239 -1.0716 C.2 1 UNL1 -0.4136 9 C -3.7028 -1.5274 0.3732 C.2 1 UNL1 -0.5025 10 C -6.0958 -1.0135 -0.5576 C.1 1 UNL1 -0.0443 11 C -4.9935 -1.2776 -0.1150 C.1 1 UNL1 -0.0572 12 C -5.1592 2.7720 1.0176 C.3 1 UNL1 0.2284 13 C -1.4665 -0.5425 0.5192 C.1 1 UNL1 -0.2212 14 C -8.0491 0.4796 -0.3932 C.2 1 UNL1 -0.4284 15 C -3.4106 0.8471 0.7489 C.1 1 UNL1 -0.0771 16 C -7.8020 -1.1555 -2.2040 C.2 1 UNL1 0.4670 17 C -6.3077 2.1986 0.4923 C.1 1 UNL1 -0.2151 18 C -3.3457 -2.7828 0.6742 C.2 1 UNL1 0.5519 19 C -7.2259 1.4984 0.0812 C.1 1 UNL1 0.0491 20 C -0.2075 -0.6599 0.4726 C.1 1 UNL1 0.1786 21 C -9.3618 0.4620 -0.1519 C.2 1 UNL1 0.5071 22 C 1.0851 -0.8190 0.4147 C.2 1 UNL1 -0.3988 23 C 2.0049 -2.0073 0.1689 C.3 1 UNL1 0.4291 24 C 2.2750 0.0538 0.5470 C.2 1 UNL1 0.0110 25 C 3.1496 -0.9680 0.3207 C.3 1 UNL1 -0.2033 26 C 5.5884 -0.1404 0.2893 C.3 1 UNL1 -0.3563 27 C 5.5420 -1.9080 0.2039 C.3 1 UNL1 0.5579 28 C 5.9417 0.6337 -0.9245 C.2 1 UNL1 0.5184 29 C 5.8977 0.4812 1.5209 C.1 1 UNL1 0.1051 30 C 4.0970 1.7054 -2.3564 C.1 1 UNL1 0.4477 31 C 8.2710 0.4268 -0.7861 C.1 1 UNL1 0.2363 32 H 2.3425 1.0992 0.7508 H 1 UNL1 0.1828 @BOND 1 30 2 3 2 16 8 2 3 2 28 1 4 3 28 2 5 3 31 1 6 8 10 1 7 8 14 1 8 28 26 1 9 31 4 3 10 10 11 3 11 14 21 2 12 14 19 1 13 11 9 1 14 19 17 3 15 23 25 1 16 23 22 1 17 27 1 1 18 27 26 1 19 1 26 1 20 1 25 1 21 26 29 1 22 25 24 1 23 9 7 1 24 9 18 2 25 22 20 1 26 22 24 2 27 20 13 3 28 17 12 1 29 13 7 1 30 24 32 1 31 7 15 1 32 15 6 3 33 6 12 1 34 29 5 3