@MOLECULE ({[(3as,4r,10as)-2-amino-5,10,10-trihydroxy-6-imino-3a,4,5,6,9,10-hexahydro-1h,8h-pyrrolo[1,2-c]purin-4-yl]methoxy}carbonyl)sulfamic acid 26 25 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 6.9452 -0.2072 0.0684 O.3 1 UNL1 -0.8091 2 O 5.8423 1.8983 0.7474 O.3 1 UNL1 -0.2851 3 S 5.8528 0.6346 -0.2882 S.3 1 UNL1 2.4537 4 O 5.6173 1.1294 -1.6031 O.3 1 UNL1 -0.8210 5 N 4.4012 -0.1424 0.2203 N.2 1 UNL1 -0.8465 6 C 3.4777 -0.8962 0.0052 C.1 1 UNL1 0.6963 7 O 2.5435 -1.6049 -0.0516 O.2 1 UNL1 -0.3879 8 O 0.5599 -3.2026 0.3112 O.2 2 UNL2 -0.0658 9 C -0.0163 -2.2174 0.2828 C.1 2 UNL2 0.6032 10 C -0.7419 -1.0666 0.2659 C.2 2 UNL2 -0.4138 11 C -2.1498 -1.1446 -0.1001 C.2 2 UNL2 0.3851 12 C -2.8939 0.1267 -0.1254 C.3 2 UNL2 -0.2073 13 N -3.2192 0.7338 -1.3684 N.2 2 UNL2 0.3866 14 O 0.9083 0.3644 0.8117 O.2 2 UNL2 -0.1770 15 N -0.2387 0.2239 0.5337 N.2 2 UNL2 0.1157 16 N -2.6523 -2.3116 -0.3624 N.2 2 UNL2 -0.3754 17 C -3.9460 -2.5152 -0.7092 C.1 2 UNL2 0.2318 18 N -5.0192 -2.8310 -1.0197 N.1 2 UNL2 -0.2213 19 N -2.7480 -0.2488 3.2712 N.1 2 UNL2 -0.0959 20 C -2.9459 0.2566 2.2521 C.1 2 UNL2 0.2001 21 N -3.1934 0.8455 1.0284 N.pl3 2 UNL2 -0.0286 22 C -3.7211 2.0557 0.9375 C.3 2 UNL2 0.0323 23 C -4.0586 2.8477 -0.2499 C.2 2 UNL2 0.4295 24 C -3.7409 1.9417 -1.2931 C.3 2 UNL2 -0.1561 25 O -4.4896 3.9668 -0.2624 O.2 2 UNL2 -0.2990 26 O -2.9959 0.1092 -2.4108 O.2 2 UNL2 -0.3447 @BOND 1 26 13 2 2 4 3 1 3 13 24 1 4 13 12 1 5 24 23 1 6 18 17 3 7 17 16 1 8 16 11 2 9 3 1 1 10 3 5 1 11 3 2 1 12 25 23 2 13 23 22 1 14 12 11 1 15 12 21 1 16 11 10 1 17 7 6 2 18 6 5 2 19 10 9 2 20 10 15 1 21 9 8 2 22 15 14 2 23 22 21 1 24 21 20 1 25 20 19 3