@MOLECULE 1-methylcarbostyril 21 22 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 1.4499 2.1213 -0.0018 C.3 1 UNL1 -0.2453 2 N 1.0104 0.7212 -0.0007 N.ar 1 UNL1 -0.4144 3 C -0.3453 0.4230 -0.0002 C.ar 1 UNL1 0.2461 4 C -1.3295 1.4433 -0.0001 C.ar 1 UNL1 -0.2677 5 C -2.6679 1.1092 0.0008 C.ar 1 UNL1 -0.0581 6 C -3.0772 -0.2353 0.0009 C.ar 1 UNL1 -0.2261 7 C -2.1301 -1.2391 0.0003 C.ar 1 UNL1 -0.0629 8 C -0.7568 -0.9324 -0.0007 C.ar 1 UNL1 -0.1707 9 C 0.2356 -1.9729 -0.0013 C.ar 1 UNL1 -0.0322 10 C 1.5492 -1.6673 -0.0011 C.ar 1 UNL1 -0.3085 11 C 2.0092 -0.2843 0.0013 C.ar 1 UNL1 0.5813 12 O 3.1721 0.0642 0.0024 O.2 1 UNL1 -0.5125 13 H 2.5600 2.1787 -0.0056 H 1 UNL1 0.1917 14 H 1.0898 2.6465 -0.9031 H 1 UNL1 0.1495 15 H 1.0961 2.6470 0.9016 H 1 UNL1 0.1495 16 H -1.0356 2.4893 -0.0005 H 1 UNL1 0.1666 17 H -3.4247 1.8952 0.0016 H 1 UNL1 0.1511 18 H -4.1378 -0.4732 0.0021 H 1 UNL1 0.1580 19 H -2.4387 -2.2856 0.0013 H 1 UNL1 0.1530 20 H -0.1086 -3.0100 -0.0027 H 1 UNL1 0.1607 21 H 2.3393 -2.4178 -0.0009 H 1 UNL1 0.1908 @BOND 1 14 1 1 2 13 1 1 3 20 9 1 4 1 2 1 5 1 15 1 6 9 10 ar 7 9 8 ar 8 10 21 1 9 10 11 ar 10 8 3 ar 11 8 7 ar 12 2 3 ar 13 2 11 ar 14 16 4 1 15 3 4 ar 16 4 5 ar 17 7 6 ar 18 7 19 1 19 5 6 ar 20 5 17 1 21 6 18 1 22 11 12 2