@MOLECULE 5'-o-(l-lysylsulfamoyl)adenosine 58 60 0 0 0 SMALL GASTEIGER @ATOM 1 S 3.6552 -0.5439 1.2181 S.O2 1 UNL11 2.5111 2 O -0.5599 -2.4217 1.0119 O.3 1 UNL11 -0.3478 3 O -0.2070 -4.4654 -1.2760 O.3 1 UNL11 -0.5598 4 O -2.3338 -3.1028 -1.9750 O.3 1 UNL11 -0.5210 5 O 2.2854 -1.4593 1.2072 O.3 1 UNL11 -0.6619 6 O 3.9828 -0.2602 2.5855 O.2 1 UNL11 -0.8594 7 O 4.5968 -1.1340 0.3204 O.2 1 UNL11 -0.8588 8 O 2.7883 0.4103 -1.5625 O.2 1 UNL11 -0.5288 9 N -2.5067 -1.1970 0.6225 N.ar 1 UNL11 -0.3741 10 N -4.3805 0.0279 1.0657 N.ar 1 UNL11 -0.3301 11 N -0.8100 0.5248 1.2561 N.ar 1 UNL11 -0.5020 12 N 3.1245 1.0106 0.5979 N.am 1 UNL11 -0.8822 13 N -1.8121 2.5768 2.0597 N.ar 1 UNL11 -0.5752 14 N 3.7096 3.3861 -1.4576 N.3 1 UNL11 -0.6445 15 N -4.1197 2.9444 2.1260 N.pl3 1 UNL11 -0.5470 16 N -3.2810 1.0708 -2.9312 N.3 1 UNL11 -0.6399 17 C 0.0299 -3.0759 -1.2239 C.3 1 UNL11 0.0429 18 C -1.3692 -2.4123 -1.2496 C.3 1 UNL11 0.0636 19 C 0.5682 -2.6944 0.1736 C.3 1 UNL11 0.0434 20 C -1.7511 -2.3920 0.2635 C.3 1 UNL11 0.2304 21 C 1.4523 -1.4521 0.0622 C.3 1 UNL11 -0.0195 22 C -2.0632 0.0304 1.0887 C.ar 1 UNL11 0.3068 23 C -3.9304 -1.1465 0.6400 C.ar 1 UNL11 0.1306 24 C -3.2562 0.7926 1.3628 C.ar 1 UNL11 -0.2207 25 C -3.0816 2.1098 1.8617 C.ar 1 UNL11 0.4645 26 C 2.4435 2.7442 -1.0668 C.3 1 UNL11 -0.0261 27 C 1.3559 2.7319 -2.1597 C.3 1 UNL11 -0.3199 28 C 0.0007 2.3480 -1.5563 C.3 1 UNL11 -0.2786 29 C 2.8116 1.2861 -0.7282 C.2 1 UNL11 0.6129 30 C -1.0277 2.0234 -2.6434 C.3 1 UNL11 -0.2733 31 C -0.7624 1.7739 1.7607 C.ar 1 UNL11 0.2878 32 C -2.4282 1.8663 -2.0183 C.3 1 UNL11 -0.1107 33 H 0.6738 -2.7692 -2.0692 H 1 UNL11 0.1483 34 H -1.3515 -1.3972 -1.7028 H 1 UNL11 0.1661 35 H 1.0811 -3.5296 0.7012 H 1 UNL11 0.1798 36 H -2.3444 -3.2958 0.5640 H 1 UNL11 0.1670 37 H 0.8368 -0.5257 0.0990 H 1 UNL11 0.1777 38 H 2.0689 -1.4913 -0.8618 H 1 UNL11 0.1561 39 H 0.5880 -4.9481 -1.5819 H 1 UNL11 0.3358 40 H -2.1332 -4.0725 -1.9920 H 1 UNL11 0.3465 41 H -4.5334 -1.9842 0.3190 H 1 UNL11 0.2059 42 H 2.0550 3.2803 -0.1612 H 1 UNL11 0.1589 43 H 1.6306 2.0194 -2.9651 H 1 UNL11 0.1689 44 H 1.2896 3.7218 -2.6445 H 1 UNL11 0.1393 45 H -0.3721 3.1677 -0.9126 H 1 UNL11 0.1384 46 H 0.1200 1.4647 -0.8949 H 1 UNL11 0.1517 47 H 3.2215 1.8012 1.2392 H 1 UNL11 0.3350 48 H -1.0554 2.8125 -3.4173 H 1 UNL11 0.1495 49 H -0.7429 1.0997 -3.1825 H 1 UNL11 0.1512 50 H 0.2401 2.1953 1.9513 H 1 UNL11 0.1974 51 H -2.3522 1.4091 -1.0099 H 1 UNL11 0.1091 52 H -2.8902 2.8668 -1.8769 H 1 UNL11 0.1370 53 H 3.5957 4.3691 -1.6447 H 1 UNL11 0.2575 54 H 4.1306 2.9461 -2.2633 H 1 UNL11 0.2627 55 H -5.0623 2.6122 2.0413 H 1 UNL11 0.3293 56 H -3.9553 3.8553 2.5096 H 1 UNL11 0.3236 57 H -4.2580 1.1841 -2.7120 H 1 UNL11 0.2491 58 H -3.0563 0.0907 -2.8763 H 1 UNL11 0.2458 @BOND 1 1 5 1 2 1 6 2 3 1 7 2 4 1 12 1 5 2 19 1 6 2 20 1 7 3 17 1 8 3 39 1 9 4 18 1 10 4 40 1 11 5 21 1 12 8 29 2 13 9 20 1 14 9 22 ar 15 9 23 ar 16 10 23 ar 17 10 24 ar 18 11 22 ar 19 11 31 ar 20 12 29 am 21 12 47 1 22 13 25 ar 23 13 31 ar 24 14 26 1 25 14 53 1 26 14 54 1 27 15 25 1 28 15 55 1 29 15 56 1 30 16 32 1 31 16 57 1 32 16 58 1 33 17 18 1 34 17 19 1 35 17 33 1 36 18 20 1 37 18 34 1 38 19 21 1 39 19 35 1 40 20 36 1 41 21 37 1 42 21 38 1 43 22 24 ar 44 23 41 1 45 24 25 ar 46 26 27 1 47 26 29 1 48 26 42 1 49 27 28 1 50 27 43 1 51 27 44 1 52 28 30 1 53 28 45 1 54 28 46 1 55 30 32 1 56 30 48 1 57 30 49 1 58 31 50 1 59 32 51 1 60 32 52 1