@MOLECULE [4-(6-amino-9h-purin-9-yl)-2,3-dihydroxycyclopentyl]methionine 26 26 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N 2.9029 0.8792 -0.6639 N.ar 1 UNL1 -0.4371 2 C 4.0673 0.3537 0.0068 C.ar 1 UNL1 0.2921 3 C 3.1883 1.9796 -1.4689 C.ar 1 UNL1 0.5243 4 C 5.1600 1.3252 -0.5058 C.ar 1 UNL1 0.1758 5 N 4.0140 -0.6774 0.7564 N.pl3 1 UNL1 -0.3127 6 N 4.6411 2.1956 -1.3042 N.ar 1 UNL1 -0.4307 7 C 6.5169 1.2093 -0.1215 C.1 1 UNL1 0.0544 8 C 5.0549 -1.2483 1.4023 C.1 1 UNL1 0.2022 9 N 5.8431 -1.8463 2.0097 N.1 1 UNL1 -0.1685 10 N 7.6281 1.1219 0.1849 N.1 1 UNL1 -0.0880 11 S -3.0102 -0.2057 1.4980 S.3 1 UNL1 0.7138 12 C -1.6205 -0.2354 1.0389 C.3 1 UNL1 -0.3718 13 C -0.3365 -0.2959 0.6355 C.3 1 UNL1 -0.0519 14 C 0.2041 -1.5730 -0.1084 C.2 1 UNL1 0.3707 15 C 1.1640 -0.8893 -1.2129 C.2 1 UNL1 0.3798 16 C 1.6356 0.3427 -0.4556 C.2 1 UNL1 -0.0702 17 C 0.7073 0.5431 0.4848 C.2 1 UNL1 0.0260 18 O 1.3725 -1.3099 -2.2935 O.2 1 UNL1 -0.2823 19 O -0.0011 -2.7105 0.0991 O.2 1 UNL1 -0.2697 20 C -4.1490 -0.7046 0.3643 C.1 1 UNL1 -0.2168 21 C -5.0140 -1.0509 -0.4151 C.1 1 UNL1 -0.0068 22 C -5.9916 -1.4381 -1.2983 C.1 1 UNL1 0.1330 23 N -6.8167 -1.7617 -2.0458 N.1 1 UNL1 -0.1645 24 C -6.9922 2.1009 0.4951 C.1 1 UNL1 0.6580 25 O -6.0394 1.4552 0.2832 O.2 1 UNL1 -0.3574 26 O -7.9428 2.7404 0.7101 O.2 1 UNL1 -0.3017 @BOND 1 18 15 2 2 23 22 3 3 3 6 ar 4 3 1 ar 5 6 4 ar 6 22 21 1 7 15 16 1 8 15 14 1 9 1 16 1 10 1 2 ar 11 4 7 1 12 4 2 ar 13 16 17 2 14 21 20 3 15 7 10 3 16 14 19 2 17 14 13 1 18 2 5 1 19 25 24 2 20 20 11 1 21 17 13 1 22 24 26 2 23 13 12 1 24 5 8 1 25 12 11 1 26 8 9 3