@MOLECULE 9-(3-hydroxy-2-hydroxymethylprop-1-yl)-guanine 30 31 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 4.3588 1.6507 0.8119 O.3 1 UNL1 -0.5335 2 O 3.5956 -1.6296 0.1034 O.3 1 UNL1 -0.5499 3 O -3.9650 -1.4580 0.7485 O.2 1 UNL1 -0.3631 4 N 0.3472 -0.6545 -0.7707 N.ar 1 UNL1 -0.3147 5 N -1.1274 1.3329 -0.3620 N.ar 1 UNL1 -0.5326 6 N -1.1041 -2.2695 -0.1143 N.ar 1 UNL1 -0.2733 7 N -3.3509 0.7011 0.3822 N.ar 1 UNL1 -0.6129 8 N -2.8658 2.9332 -0.1576 N.pl3 1 UNL1 -0.6106 9 C 2.3644 0.4505 0.1386 C.3 1 UNL1 -0.2418 10 C 1.6082 -0.0266 -1.1203 C.3 1 UNL1 -0.0809 11 C -0.8300 -0.0240 -0.4035 C.ar 1 UNL1 0.1936 12 C 3.5514 1.3242 -0.2960 C.3 1 UNL1 -0.0096 13 C 2.8633 -0.7639 0.9426 C.3 1 UNL1 0.0054 14 C -1.7316 -1.0419 -0.0102 C.ar 1 UNL1 -0.1606 15 C 0.1344 -2.0407 -0.5515 C.ar 1 UNL1 0.0842 16 C -3.0957 -0.7069 0.4049 C.ar 1 UNL1 0.6149 17 C -2.4914 1.5924 -0.0159 C.ar 1 UNL1 0.5702 18 H 1.6796 1.0452 0.7885 H 1 UNL1 0.1572 19 H 2.2384 -0.7745 -1.6713 H 1 UNL1 0.1862 20 H 1.4264 0.8187 -1.8215 H 1 UNL1 0.1420 21 H 4.2535 0.7806 -0.9582 H 1 UNL1 0.1482 22 H 3.2237 2.2513 -0.7986 H 1 UNL1 0.1169 23 H 3.4795 -0.4536 1.8055 H 1 UNL1 0.1341 24 H 2.0259 -1.3983 1.2958 H 1 UNL1 0.1530 25 H 0.9020 -2.7750 -0.7399 H 1 UNL1 0.2070 26 H -0.6010 1.9845 -0.9246 H 1 UNL1 0.3193 27 H 3.8637 2.1922 1.4594 H 1 UNL1 0.3148 28 H 4.5069 -1.2926 -0.0212 H 1 UNL1 0.3217 29 H -2.2067 3.6375 0.1188 H 1 UNL1 0.2925 30 H -3.8195 3.1373 0.1275 H 1 UNL1 0.3223 @BOND 1 20 10 1 2 19 10 1 3 10 4 1 4 10 9 1 5 21 12 1 6 26 5 1 7 22 12 1 8 4 15 ar 9 4 11 ar 10 25 15 1 11 15 6 ar 12 11 5 ar 13 11 14 ar 14 5 17 ar 15 12 9 1 16 12 1 1 17 8 17 1 18 8 29 1 19 8 30 1 20 6 14 ar 21 28 2 1 22 17 7 ar 23 14 16 ar 24 2 13 1 25 9 18 1 26 9 13 1 27 7 16 ar 28 16 3 2 29 1 27 1 30 13 24 1 31 13 23 1