@MOLECULE n~2~-allyl-n-(2-methylphenyl)alaninamide 34 34 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.6471 0.7434 1.6539 O.2 1 UNL1111111111 -0.4532 2 N 3.0047 0.4714 -0.0895 N.3 1 UNL1111111111 -0.5355 3 N -0.3908 0.6638 -0.3841 N.am 1 UNL1111111111 -0.5973 4 C 1.9287 1.4646 -0.2796 C.3 1 UNL1111111111 -0.0094 5 C 0.6887 0.9241 0.4661 C.2 1 UNL1111111111 0.5665 6 C 2.3190 2.7817 0.3942 C.3 1 UNL1111111111 -0.4520 7 C -1.6407 0.1270 -0.0033 C.ar 1 UNL1111111111 0.1965 8 C -2.6250 -0.0064 -1.0105 C.ar 1 UNL1111111111 -0.0692 9 C 2.6827 -0.8390 -0.7004 C.3 1 UNL1111111111 -0.1240 10 C -1.9251 -0.2809 1.3058 C.ar 1 UNL1111111111 -0.2101 11 C -3.8715 -0.5261 -0.6757 C.ar 1 UNL1111111111 -0.1349 12 C -2.3565 0.3852 -2.4272 C.3 1 UNL1111111111 -0.4453 13 C -3.1795 -0.8008 1.6134 C.ar 1 UNL1111111111 -0.1155 14 C -4.1567 -0.9198 0.6298 C.ar 1 UNL1111111111 -0.1913 15 C 3.8477 -1.7683 -0.5010 C.2 1 UNL1111111111 -0.1332 16 C 3.7318 -2.9086 0.1779 C.2 1 UNL1111111111 -0.2979 17 H 1.7071 1.6450 -1.3627 H 1 UNL1111111111 0.1142 18 H 3.9006 0.8316 -0.4053 H 1 UNL1111111111 0.2651 19 H 2.5232 2.6168 1.4674 H 1 UNL1111111111 0.1868 20 H 3.2218 3.2129 -0.0450 H 1 UNL1111111111 0.1481 21 H 1.5161 3.5252 0.3224 H 1 UNL1111111111 0.1548 22 H -0.2905 0.8886 -1.3693 H 1 UNL1111111111 0.3096 23 H 2.4329 -0.7709 -1.7820 H 1 UNL1111111111 0.1150 24 H 1.7724 -1.2364 -0.1843 H 1 UNL1111111111 0.1625 25 H -1.1733 -0.1970 2.0948 H 1 UNL1111111111 0.1977 26 H -4.6368 -0.6288 -1.4440 H 1 UNL1111111111 0.1484 27 H -3.2408 0.2495 -3.0671 H 1 UNL1111111111 0.1594 28 H -2.0788 1.4452 -2.5161 H 1 UNL1111111111 0.1526 29 H -1.5609 -0.2294 -2.8741 H 1 UNL1111111111 0.1540 30 H -3.3971 -1.1131 2.6341 H 1 UNL1111111111 0.1520 31 H -5.1359 -1.3219 0.8751 H 1 UNL1111111111 0.1516 32 H 4.7848 -1.4436 -0.9457 H 1 UNL1111111111 0.1382 33 H 4.5415 -3.6063 0.3227 H 1 UNL1111111111 0.1440 34 H 2.8154 -3.2333 0.6497 H 1 UNL1111111111 0.1518 @BOND 1 1 5 2 2 2 4 1 3 2 9 1 4 2 18 1 5 3 5 am 6 3 7 1 7 3 22 1 8 4 5 1 9 4 6 1 10 4 17 1 11 6 19 1 12 6 20 1 13 6 21 1 14 7 8 ar 15 7 10 ar 16 8 11 ar 17 8 12 1 18 9 15 1 19 9 23 1 20 9 24 1 21 10 13 ar 22 10 25 1 23 11 14 ar 24 11 26 1 25 12 27 1 26 12 28 1 27 12 29 1 28 13 14 ar 29 13 30 1 30 14 31 1 31 15 16 2 32 15 32 1 33 16 33 1 34 16 34 1