@MOLECULE n-methyl-n-[(1r)-1-phenylethyl]-2-propyn-1-amine 28 28 0 0 0 SMALL GASTEIGER @ATOM 1 N -1.3039 -0.0075 -0.0574 N.3 1 UNL111111111 -0.4046 2 C -0.2231 -1.0318 -0.1910 C.3 1 UNL111111111 0.0459 3 C 1.1254 -0.3511 -0.0701 C.ar 1 UNL111111111 -0.0172 4 C -0.3151 -2.0714 0.9418 C.3 1 UNL111111111 -0.4579 5 C -2.6525 -0.6426 -0.1153 C.3 1 UNL111111111 -0.0896 6 C -1.1781 1.0175 -1.1183 C.3 1 UNL111111111 -0.2882 7 C 1.3675 0.5534 0.9664 C.ar 1 UNL111111111 -0.1408 8 C 2.1384 -0.6543 -0.9801 C.ar 1 UNL111111111 -0.1817 9 C 2.6172 1.1528 1.0921 C.ar 1 UNL111111111 -0.1494 10 C 3.3899 -0.0544 -0.8500 C.ar 1 UNL111111111 -0.1444 11 C 3.6309 0.8480 0.1841 C.ar 1 UNL111111111 -0.1568 12 C -3.6891 0.3433 0.0668 C.1 1 UNL111111111 -0.0605 13 C -4.5701 1.1567 0.2305 C.1 1 UNL111111111 -0.2255 14 H -0.2959 -1.5617 -1.1781 H 1 UNL111111111 0.1188 15 H 0.6300 -2.6195 1.0411 H 1 UNL111111111 0.1554 16 H -1.1040 -2.8073 0.7659 H 1 UNL111111111 0.1430 17 H -0.5098 -1.5811 1.9056 H 1 UNL111111111 0.1668 18 H -2.8181 -1.2116 -1.0648 H 1 UNL111111111 0.1347 19 H -2.7118 -1.3899 0.7211 H 1 UNL111111111 0.1662 20 H -0.1978 1.5168 -1.0301 H 1 UNL111111111 0.1565 21 H -1.9448 1.7956 -0.9583 H 1 UNL111111111 0.1572 22 H -1.2806 0.6285 -2.1412 H 1 UNL111111111 0.1209 23 H 0.5635 0.7921 1.6655 H 1 UNL111111111 0.1723 24 H 1.9583 -1.3568 -1.7902 H 1 UNL111111111 0.1487 25 H 2.8019 1.8592 1.8986 H 1 UNL111111111 0.1497 26 H 4.1798 -0.2923 -1.5587 H 1 UNL111111111 0.1476 27 H 4.6081 1.3146 0.2826 H 1 UNL111111111 0.1476 28 H -5.3176 1.8470 0.3704 H 1 UNL111111111 0.1853 @BOND 1 1 2 1 2 1 5 1 3 1 6 1 4 2 3 1 5 2 4 1 6 2 14 1 7 3 7 ar 8 3 8 ar 9 4 15 1 10 4 16 1 11 4 17 1 12 5 12 1 13 5 18 1 14 5 19 1 15 6 20 1 16 6 21 1 17 6 22 1 18 7 9 ar 19 7 23 1 20 8 10 ar 21 8 24 1 22 9 11 ar 23 9 25 1 24 10 11 ar 25 10 26 1 26 11 27 1 27 12 13 3 28 13 28 1