@MOLECULE (6e)-5-amino-6-[(3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxydihydro-2(3h)-furanylidene]norleucine 27 28 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 1.8722 1.2249 -0.0526 C.3 1 UNL1 0.0826 2 C 1.3950 2.6006 -0.1272 C.2 1 UNL1 0.2953 3 O 2.0154 3.6201 -0.2140 O.2 1 UNL1 -0.2562 4 C -0.1317 2.4489 -0.0652 C.2 1 UNL1 0.3358 5 O -0.9575 3.3037 -0.0958 O.2 1 UNL1 -0.2555 6 C -0.3526 0.9710 0.0433 C.2 1 UNL1 0.0257 7 O 0.8842 0.2864 0.0423 O.2 1 UNL1 -0.1164 8 C -1.4571 0.3059 0.1311 C.1 1 UNL1 -0.0309 9 C -2.6015 -0.5155 0.2297 C.2 1 UNL1 0.1779 10 C -3.8452 0.1676 0.2432 C.1 1 UNL1 -0.0157 11 C -4.9034 0.7659 0.2530 C.1 1 UNL1 0.0069 12 C -6.1028 1.4333 0.2630 C.1 1 UNL1 0.1457 13 C -6.8548 -2.4582 -0.3438 C.1 1 UNL1 0.6623 14 O -7.5714 -3.3775 -0.3956 O.2 1 UNL1 -0.3060 15 O -6.1411 -1.5326 -0.2905 O.2 1 UNL1 -0.3578 16 N -2.4970 -1.7913 0.3012 N.pl3 1 UNL1 -0.1187 17 N -7.1171 1.9933 0.2711 N.1 1 UNL1 -0.1652 18 C 3.5226 -0.6009 0.0208 C.ar 1 UNL1 0.2421 19 C 5.0873 -0.5388 -0.0584 C.ar 1 UNL1 0.1295 20 N 5.4667 0.6849 -0.1732 N.ar 1 UNL1 -0.4524 21 N 3.1665 0.7624 -0.0670 N.ar 1 UNL1 -0.4471 22 C 4.3269 1.6079 -0.1835 C.ar 1 UNL1 0.5952 23 N 2.8466 -1.7017 0.1407 N.ar 1 UNL1 -0.3197 24 N 4.9460 -3.0008 0.1502 N.ar 1 UNL1 -0.3298 25 C 3.7163 -2.7811 0.1864 C.ar 1 UNL1 0.3496 26 C 5.8180 -1.8198 0.0188 C.ar 1 UNL1 0.1636 27 N 7.0713 -1.9853 -0.0129 N.pl3 1 UNL1 -0.0408 @BOND 1 14 13 2 2 13 15 2 3 3 2 2 4 22 20 ar 5 22 21 ar 6 20 19 ar 7 2 4 1 8 2 1 1 9 5 4 2 10 21 1 1 11 21 18 ar 12 4 6 1 13 19 26 ar 14 19 18 ar 15 1 7 1 16 27 26 1 17 26 24 ar 18 18 23 ar 19 7 6 1 20 6 8 2 21 8 9 2 22 23 25 ar 23 24 25 ar 24 9 10 1 25 9 16 1 26 10 11 3 27 11 12 1 28 12 17 3