@MOLECULE 6-azauridine 28 29 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O4* 1.2753 0.5018 1.1112 O.3 1 UNL1 -0.3643 2 O2* 1.8839 -2.4432 -0.3789 O.3 1 UNL1 -0.5371 3 O3* 3.8878 -0.8243 -0.2821 O.3 1 UNL1 -0.5231 4 O5* 1.3046 3.0925 0.4572 O.3 1 UNL1 -0.5187 5 O -1.4383 -2.4069 0.5914 O.2 1 UNL1 -0.4977 6 O -4.5735 0.7293 -0.4651 O.2 1 UNL1 -0.4158 7 N -0.7584 -0.2621 0.1650 N.ar 1 UNL1 -0.3994 8 N -1.0273 1.0129 -0.1376 N.ar 1 UNL1 -0.0399 9 N -3.0669 -0.8752 0.0633 N.ar 1 UNL1 -0.6111 10 C3* 2.6988 -0.2156 -0.6933 C.3 1 UNL1 0.0924 11 C2* 1.4481 -1.1350 -0.6381 C.3 1 UNL1 0.0278 12 C4* 2.3574 0.9370 0.2769 C.3 1 UNL1 0.0050 13 C1* 0.6358 -0.6128 0.5829 C.3 1 UNL1 0.2571 14 C5* 1.9353 2.2199 -0.4519 C.3 1 UNL1 -0.0421 15 C -1.7520 -1.2722 0.3087 C.ar 1 UNL1 0.6699 16 C -2.2579 1.3661 -0.3682 C.ar 1 UNL1 -0.2081 17 C -3.4171 0.4565 -0.2796 C.ar 1 UNL1 0.5634 18 H2* 0.8749 -1.1223 -1.5868 H 1 UNL1 0.1520 19 H3* 2.9264 0.1308 -1.7244 H 1 UNL1 0.1561 20 H4* 3.1701 1.1279 1.0148 H 1 UNL1 0.1798 21 H1* 0.5631 -1.3504 1.4282 H 1 UNL1 0.1835 22 H5*1 1.2490 2.0198 -1.2944 H 1 UNL1 0.1265 23 H5*2 2.8117 2.7916 -0.8099 H 1 UNL1 0.1477 24 H2* 1.1040 -3.0310 -0.2247 H 1 UNL1 0.3465 25 H3* 3.7099 -1.6434 0.2380 H 1 UNL1 0.3441 26 H5* 0.5053 2.6328 0.8113 H 1 UNL1 0.3297 27 H -3.8067 -1.5761 0.1668 H 1 UNL1 0.3512 28 H -2.4577 2.4109 -0.6421 H 1 UNL1 0.2248 @BOND 1 19 10 1 2 18 11 1 3 22 14 1 4 23 14 1 5 10 11 1 6 10 3 1 7 10 12 1 8 28 16 1 9 11 2 1 10 11 13 1 11 6 17 2 12 14 12 1 13 14 4 1 14 2 24 1 15 16 17 ar 16 16 8 ar 17 3 25 1 18 17 9 ar 19 8 7 ar 20 9 27 1 21 9 15 ar 22 7 15 ar 23 7 13 1 24 12 20 1 25 12 1 1 26 15 5 2 27 4 26 1 28 13 1 1 29 13 21 1