@MOLECULE isobutyl [(1r)-3-oxo-1-phenylpropyl]carbamate 37 37 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.6599 -4.1405 0.5996 O.2 1 UNL111111111 -0.4514 2 C 0.6492 -3.0940 0.0014 C.2 1 UNL111111111 0.3615 3 C 1.6020 -1.9864 0.3842 C.3 1 UNL111111111 -0.4355 4 C 1.2783 -0.6582 -0.3252 C.3 1 UNL111111111 0.1137 5 N 0.0382 -0.0756 0.2130 N.am 1 UNL111111111 -0.6110 6 C -1.1472 -0.2977 -0.4452 C.2 1 UNL111111111 0.7254 7 O -2.1522 0.3766 0.1805 O.3 1 UNL111111111 -0.4334 8 C -3.4543 0.1609 -0.3959 C.3 1 UNL111111111 -0.0154 9 O -1.2902 -1.0024 -1.4234 O.2 1 UNL111111111 -0.5783 10 C 2.4069 0.3303 -0.1287 C.ar 1 UNL111111111 -0.0570 11 C 3.0314 0.8831 -1.2469 C.ar 1 UNL111111111 -0.1446 12 C 4.0738 1.7932 -1.0826 C.ar 1 UNL111111111 -0.1424 13 C 4.4895 2.1568 0.1969 C.ar 1 UNL111111111 -0.1425 14 C 3.8616 1.6085 1.3143 C.ar 1 UNL111111111 -0.1418 15 C 2.8223 0.6954 1.1529 C.ar 1 UNL111111111 -0.1549 16 C -4.3863 0.9714 0.5151 C.3 1 UNL111111111 -0.0871 17 C -4.2344 2.4682 0.2371 C.3 1 UNL111111111 -0.4488 18 C -5.8288 0.5159 0.2819 C.3 1 UNL111111111 -0.4534 19 H -0.0429 -2.9177 -0.8336 H 1 UNL111111111 0.1424 20 H 1.5971 -1.8628 1.4868 H 1 UNL111111111 0.1839 21 H 2.6401 -2.3012 0.1447 H 1 UNL111111111 0.1860 22 H 1.1257 -0.8619 -1.4270 H 1 UNL111111111 0.1723 23 H 0.0944 0.5423 1.0061 H 1 UNL111111111 0.3295 24 H -3.4417 0.5190 -1.4385 H 1 UNL111111111 0.1391 25 H -3.6705 -0.9214 -0.3796 H 1 UNL111111111 0.1393 26 H -4.1024 0.7711 1.5794 H 1 UNL111111111 0.1502 27 H 2.7072 0.6092 -2.2504 H 1 UNL111111111 0.1573 28 H 2.3423 0.2661 2.0310 H 1 UNL111111111 0.1535 29 H 4.5631 2.2219 -1.9556 H 1 UNL111111111 0.1523 30 H 5.3036 2.8681 0.3239 H 1 UNL111111111 0.1518 31 H 4.1854 1.8927 2.3141 H 1 UNL111111111 0.1522 32 H -4.8355 3.0657 0.9308 H 1 UNL111111111 0.1438 33 H -3.1893 2.7836 0.3504 H 1 UNL111111111 0.1536 34 H -4.5481 2.7283 -0.7793 H 1 UNL111111111 0.1448 35 H -5.9653 -0.5425 0.5310 H 1 UNL111111111 0.1469 36 H -6.5262 1.0890 0.9045 H 1 UNL111111111 0.1498 37 H -6.1352 0.6563 -0.7609 H 1 UNL111111111 0.1480 @BOND 1 1 2 2 2 2 3 1 3 2 19 1 4 3 4 1 5 3 20 1 6 3 21 1 7 4 5 1 8 4 10 1 9 4 22 1 10 5 6 am 11 5 23 1 12 6 7 1 13 6 9 2 14 7 8 1 15 8 16 1 16 8 24 1 17 8 25 1 18 10 11 ar 19 10 15 ar 20 11 12 ar 21 11 27 1 22 12 13 ar 23 12 29 1 24 13 14 ar 25 13 30 1 26 14 15 ar 27 14 31 1 28 15 28 1 29 16 17 1 30 16 18 1 31 16 26 1 32 17 32 1 33 17 33 1 34 17 34 1 35 18 35 1 36 18 36 1 37 18 37 1