@MOLECULE 9-{5-o-[(2-ammonio-4-carboxylatobutoxy)phosphinato]pentofuranosyl}-9h-purin-6-amine 31 32 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P -0.7841 -1.6036 1.9432 P.3 1 UNL1 0.3899 2 O 1.9575 -1.1074 -0.2590 O.2 1 UNL1 -0.1774 3 O 3.4429 -4.2264 -1.0548 O.2 1 UNL1 -0.3540 4 O 4.9196 -1.8045 -1.9927 O.2 1 UNL1 -0.3049 5 O 0.0757 -2.9315 1.3663 O.2 1 UNL1 -0.1678 6 O -0.5001 -0.6206 0.5651 O.3 1 UNL1 -0.3861 7 O 0.0240 -0.9594 2.9469 O.3 1 UNL1 -0.1761 8 O -2.1550 -2.0056 1.7455 O.2 1 UNL1 -0.1698 9 O -7.3787 2.8719 -0.2620 O.co2 2 UNL2 -0.0414 10 O -5.2332 2.6941 -0.8379 O.co2 2 UNL2 -0.3846 11 N 3.4006 0.6026 -0.7249 N.ar 1 UNL1 -0.2405 12 N 4.6977 2.5144 -0.5266 N.ar 1 UNL1 -0.3218 13 N 1.2443 1.5839 0.0971 N.ar 1 UNL1 -0.3852 14 N -7.2534 -2.8737 -1.2763 N.1 2 UNL2 -0.1342 15 N 1.4359 3.9432 0.7411 N.ar 1 UNL1 -0.3222 16 N 3.4450 5.1686 0.5759 N.pl3 1 UNL1 -0.0514 17 C 3.1154 -3.0933 -0.8567 C.2 1 UNL1 0.4141 18 C 3.9048 -1.8555 -1.3653 C.2 1 UNL1 0.3113 19 C 2.0067 -2.5375 -0.1352 C.2 1 UNL1 -0.3469 20 C 3.0924 -0.7253 -0.8780 C.3 1 UNL1 0.0644 21 C 1.0701 -3.0557 0.6678 C.2 1 UNL1 0.3845 22 C 2.5533 1.6046 -0.2181 C.ar 1 UNL1 0.1648 23 C 4.6301 1.2472 -0.8671 C.ar 1 UNL1 0.4268 24 C 3.4090 2.8159 -0.0946 C.ar 1 UNL1 0.0097 25 C -7.0613 -1.7408 -1.1277 C.1 2 UNL2 0.1219 26 C -0.3309 0.0841 -0.3407 C.3 1 UNL1 0.7093 27 C -6.8273 -0.3976 -0.9550 C.1 2 UNL2 0.0354 28 C 2.8308 4.0295 0.4093 C.ar 1 UNL1 0.2080 29 C -6.6168 0.7878 -0.8061 C.1 2 UNL2 -0.1020 30 C 0.8865 2.8096 0.5504 C.ar 1 UNL1 0.3213 31 C -6.3125 2.1811 -0.6491 C.2 2 UNL2 0.5049 @BOND 1 4 18 2 2 18 20 1 3 18 17 1 4 14 25 3 5 25 27 1 6 3 17 2 7 27 29 3 8 20 11 1 9 20 2 1 10 23 11 ar 11 23 12 ar 12 17 19 1 13 10 31 ar 14 29 31 1 15 11 22 ar 16 31 9 ar 17 12 24 ar 18 26 6 1 19 2 19 1 20 22 24 ar 21 22 13 ar 22 19 21 2 23 24 28 ar 24 13 30 ar 25 28 16 1 26 28 15 ar 27 30 15 ar 28 6 1 1 29 21 5 1 30 5 1 1 31 8 1 2 32 1 7 1