@MOLECULE n-phenylacrylamide 20 20 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.7020 1.2549 0.0039 O.2 1 UNL1111111111 -0.5004 2 N -0.6640 -0.7807 -0.0016 N.am 1 UNL1111111111 -0.5748 3 C 0.6808 -0.3440 -0.0007 C.ar 1 UNL1111111111 0.2273 4 C 1.6698 -1.3470 0.0014 C.ar 1 UNL1111111111 -0.2639 5 C 1.0532 1.0060 -0.0023 C.ar 1 UNL1111111111 -0.2209 6 C 3.0125 -0.9893 0.0016 C.ar 1 UNL1111111111 -0.0927 7 C 2.4040 1.3421 -0.0017 C.ar 1 UNL1111111111 -0.0947 8 C 3.3859 0.3538 0.0001 C.ar 1 UNL1111111111 -0.2040 9 C -1.7896 0.0469 0.0007 C.2 1 UNL1111111111 0.5909 10 C -3.0894 -0.6725 -0.0011 C.2 1 UNL1111111111 -0.2780 11 C -4.2252 0.0272 -0.0007 C.2 1 UNL1111111111 -0.1730 12 H 1.3917 -2.3965 0.0028 H 1 UNL1111111111 0.1521 13 H 0.3025 1.7988 -0.0039 H 1 UNL1111111111 0.1982 14 H -0.8010 -1.7868 -0.0036 H 1 UNL1111111111 0.3102 15 H 3.7772 -1.7649 0.0030 H 1 UNL1111111111 0.1467 16 H 2.6921 2.3935 -0.0028 H 1 UNL1111111111 0.1513 17 H 4.4373 0.6275 0.0004 H 1 UNL1111111111 0.1521 18 H -3.0667 -1.7582 -0.0025 H 1 UNL1111111111 0.1597 19 H -5.2075 -0.4248 -0.0019 H 1 UNL1111111111 0.1451 20 H -4.2479 1.1146 0.0008 H 1 UNL1111111111 0.1689 @BOND 1 1 9 2 2 2 3 1 3 2 9 am 4 2 14 1 5 3 4 ar 6 3 5 ar 7 4 6 ar 8 4 12 1 9 5 7 ar 10 5 13 1 11 6 8 ar 12 6 15 1 13 7 8 ar 14 7 16 1 15 8 17 1 16 9 10 1 17 10 11 2 18 10 18 1 19 11 19 1 20 11 20 1