@MOLECULE 2'-deoxy-3-methyladenosine 34 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* -2.2135 -0.1939 1.0633 O.3 1 UNL1 -0.4157 2 O3* -3.8298 1.9836 -0.7025 O.3 1 UNL1 -0.5368 3 O5* -3.3622 -2.6269 -0.0892 O.3 1 UNL1 -0.5174 4 N 0.0619 -0.1376 0.6707 N.ar 1 UNL1 -0.3715 5 N 1.8278 1.5455 0.0161 N.pl3 1 UNL1 -0.4093 6 N 1.2974 -2.0179 0.3867 N.ar 1 UNL1 -0.2769 7 N 3.8896 0.4960 -0.6783 N.2 1 UNL1 -0.5259 8 N 4.2429 -1.8445 -0.5618 N.pl3 1 UNL1 -0.4736 9 C1* -1.1391 0.6907 0.8445 C.3 1 UNL1 0.3063 10 C2* -1.4626 1.5337 -0.4008 C.3 1 UNL1 -0.4128 11 C3* -2.8284 1.0236 -0.8958 C.3 1 UNL1 0.1334 12 C4* -3.0995 -0.2398 -0.0578 C.3 1 UNL1 -0.0018 13 C5* -2.8727 -1.5376 -0.8365 C.3 1 UNL1 -0.0462 14 C 1.3316 0.2628 0.2734 C.ar 1 UNL1 0.1567 15 C 0.0980 -1.5506 0.7403 C.ar 1 UNL1 0.0854 16 C 2.0834 -0.9244 0.0811 C.ar 1 UNL1 -0.0650 17 C 3.4604 -0.8504 -0.3934 C.2 1 UNL1 0.3937 18 C 3.1813 1.5431 -0.4443 C.3 1 UNL1 0.2843 19 C 1.4408 2.6354 0.9237 C.3 1 UNL1 -0.2472 20 H1* -1.0493 1.2701 1.7975 H 1 UNL1 0.1531 21 H2*1 -0.6888 1.4361 -1.1873 H 1 UNL1 0.1917 22 H2*2 -1.5134 2.6138 -0.1760 H 1 UNL1 0.1765 23 H3* -2.8664 0.8608 -1.9945 H 1 UNL1 0.1650 24 H4* -4.1078 -0.2347 0.4193 H 1 UNL1 0.1764 25 H5*1 -1.8090 -1.7020 -1.0900 H 1 UNL1 0.1421 26 H5*2 -3.4824 -1.5741 -1.7615 H 1 UNL1 0.1573 27 H -0.7421 -2.1367 1.0722 H 1 UNL1 0.2016 28 H3* -3.9548 2.1965 0.2455 H 1 UNL1 0.3203 29 H5* -2.8644 -2.7059 0.7531 H 1 UNL1 0.3160 30 H 3.5806 2.5468 -0.6707 H 1 UNL1 0.1890 31 H 2.1370 3.4887 0.8324 H 1 UNL1 0.1636 32 H 1.4337 2.3206 1.9823 H 1 UNL1 0.1532 33 H 0.4381 3.0079 0.6517 H 1 UNL1 0.1523 34 H 5.1833 -1.7063 -0.8968 H 1 UNL1 0.2822 @BOND 1 23 11 1 2 26 13 1 3 21 10 1 4 25 13 1 5 34 8 1 6 11 2 1 7 11 10 1 8 11 12 1 9 13 3 1 10 13 12 1 11 2 28 1 12 7 18 1 13 7 17 2 14 30 18 1 15 8 17 1 16 18 5 1 17 10 22 1 18 10 9 1 19 17 16 1 20 3 29 1 21 12 24 1 22 12 1 1 23 5 14 1 24 5 19 1 25 16 14 ar 26 16 6 ar 27 14 4 ar 28 6 15 ar 29 33 19 1 30 4 15 ar 31 4 9 1 32 15 27 1 33 31 19 1 34 9 1 1 35 9 20 1 36 19 32 1