@MOLECULE [(1r,2r,3s,4r,5s)-4-(6-amino-2-chloro-9h-purin-9-yl)-2,3-dihydroxybicyclo[3.1.0]hex-1-yl]methyl dihydrogen phosphate 40 43 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -0.6084 -0.1459 -1.1523 C.3 1 UNL1 -0.2111 2 C -1.9405 -0.0164 -0.4159 C.3 1 UNL1 -0.1225 3 C 0.4624 -0.6225 -0.1817 C.3 1 UNL1 0.0558 4 C -1.7556 -0.4361 1.0355 C.3 1 UNL1 0.1149 5 C -0.2771 -0.9461 1.1605 C.3 1 UNL1 0.0611 6 C 1.2347 1.7878 0.3035 C.ar 1 UNL1 0.1183 7 C -2.8858 1.1223 -0.7158 C.3 1 UNL1 0.0073 8 H -2.3983 -2.3110 0.9834 H 1 UNL1 0.3423 9 H -0.2451 -2.6753 2.1356 H 1 UNL1 0.3352 10 H 6.4904 2.8217 0.3812 H 1 UNL1 0.3280 11 H 4.9805 3.6457 0.5821 H 1 UNL1 0.3301 12 C 4.8180 1.6393 0.1954 C.ar 1 UNL1 0.4743 13 C 4.8893 -0.6526 -0.2549 C.ar 1 UNL1 0.3836 14 O -5.5878 1.3743 0.9564 O.2 1 UNL1 -0.2443 15 C -1.7332 -1.1066 -1.4492 C.3 1 UNL1 -0.2765 16 O -2.6485 -1.4535 1.4170 O.3 1 UNL1 -0.5374 17 O -0.2984 -2.3538 1.2102 O.3 1 UNL1 -0.5446 18 O -5.1270 -1.1429 0.4167 O.3 1 UNL1 -0.4035 19 O -6.5580 0.2031 -1.0804 O.3 1 UNL1 -0.2337 20 O -4.1600 0.6132 -1.1103 O.3 1 UNL1 -0.3338 21 H -4.1980 -1.2321 0.8601 H 1 UNL1 0.3541 22 H -6.3443 -0.5888 -1.7093 H 1 UNL1 0.3039 23 CL 5.8767 -2.0082 -0.5380 Cl 1 UNL1 0.0430 24 N 5.4874 2.7988 0.4030 N.pl3 1 UNL1 -0.5380 25 N 2.3750 2.4628 0.4161 N.ar 1 UNL1 -0.3220 26 N 3.5620 -0.8793 -0.2718 N.ar 1 UNL1 -0.4909 27 N 5.5520 0.5084 -0.0422 N.ar 1 UNL1 -0.5599 28 P -5.3543 0.3574 -0.0529 P.3 1 UNL1 0.3136 29 C 2.8339 0.2440 -0.0342 C.ar 1 UNL1 0.2913 30 C 3.3994 1.5434 0.2120 C.ar 1 UNL1 -0.2108 31 N 1.4619 0.4118 0.0285 N.ar 1 UNL1 -0.3372 32 H -0.2812 0.5594 -1.9136 H 1 UNL1 0.1773 33 H 0.9765 -1.5580 -0.5580 H 1 UNL1 0.2133 34 H -2.2647 -1.0371 -2.3982 H 1 UNL1 0.1741 35 H -1.6604 -2.1480 -1.1421 H 1 UNL1 0.1676 36 H -1.9841 0.3765 1.7591 H 1 UNL1 0.1594 37 H 0.2405 -0.5279 2.0420 H 1 UNL1 0.1393 38 H -2.9036 1.8751 0.0998 H 1 UNL1 0.1374 39 H -2.5951 1.6536 -1.6552 H 1 UNL1 0.1405 40 H 0.2394 2.1936 0.3988 H 1 UNL1 0.2009 @BOND 1 34 15 1 2 32 1 1 3 22 19 1 4 39 7 1 5 15 1 1 6 15 35 1 7 15 2 1 8 1 2 1 9 1 3 1 10 20 7 1 11 20 28 1 12 19 28 1 13 7 2 1 14 7 38 1 15 33 3 1 16 23 13 1 17 2 4 1 18 26 13 ar 19 26 29 ar 20 13 27 ar 21 3 31 1 22 3 5 1 23 28 18 1 24 28 14 2 25 27 12 ar 26 29 31 ar 27 29 30 ar 28 31 6 ar 29 12 30 ar 30 12 24 1 31 30 25 ar 32 6 40 1 33 6 25 ar 34 10 24 1 35 24 11 1 36 18 21 1 37 8 16 1 38 4 5 1 39 4 16 1 40 4 36 1 41 5 17 1 42 5 37 1 43 17 9 1