@MOLECULE (s)-n-methylsalsolinol 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.1164 -1.6666 0.4619 O.3 1 UNL1111111111 -0.4479 2 O 3.6735 0.9607 -0.0263 O.3 1 UNL1111111111 -0.4903 3 N -2.7433 0.0489 0.0504 N.3 1 UNL1111111111 -0.4313 4 C -1.6426 -0.9496 -0.0697 C.3 1 UNL1111111111 0.0697 5 C -0.2409 -0.3859 -0.0119 C.ar 1 UNL1111111111 -0.0503 6 C -2.3084 1.3936 0.4869 C.3 1 UNL1111111111 -0.0986 7 C -1.1678 1.8744 -0.4283 C.3 1 UNL1111111111 -0.2880 8 C 0.0030 0.9713 -0.2305 C.ar 1 UNL1111111111 0.0067 9 C -1.8242 -1.6184 -1.4506 C.3 1 UNL1111111111 -0.4410 10 C 0.8199 -1.2643 0.2274 C.ar 1 UNL1111111111 -0.2150 11 C -3.8144 -0.4536 0.9379 C.3 1 UNL1111111111 -0.2772 12 C 1.3088 1.4693 -0.2427 C.ar 1 UNL1111111111 -0.2580 13 C 2.1213 -0.7744 0.2229 C.ar 1 UNL1111111111 0.1982 14 C 2.3596 0.5909 -0.0219 C.ar 1 UNL1111111111 0.1429 15 H -1.7377 -1.7338 0.7305 H 1 UNL1111111111 0.1282 16 H -1.9800 1.4232 1.5482 H 1 UNL1111111111 0.1194 17 H -3.1836 2.0734 0.3916 H 1 UNL1111111111 0.1367 18 H -0.9268 2.9311 -0.2170 H 1 UNL1111111111 0.1461 19 H -1.5003 1.8373 -1.4903 H 1 UNL1111111111 0.1712 20 H -2.8220 -2.0596 -1.5421 H 1 UNL1111111111 0.1486 21 H -1.7297 -0.8756 -2.2525 H 1 UNL1111111111 0.1585 22 H -1.0770 -2.3993 -1.6169 H 1 UNL1111111111 0.1446 23 H 0.6481 -2.3234 0.4118 H 1 UNL1111111111 0.1784 24 H -4.1803 -1.4184 0.5483 H 1 UNL1111111111 0.1462 25 H -4.6646 0.2478 0.9060 H 1 UNL1111111111 0.1441 26 H -3.5110 -0.5889 1.9873 H 1 UNL1111111111 0.1198 27 H 1.4929 2.5236 -0.4230 H 1 UNL1111111111 0.1631 28 H 4.0022 -1.2164 0.4445 H 1 UNL1111111111 0.3388 29 H 3.7744 1.9371 -0.1247 H 1 UNL1111111111 0.3361 @BOND 1 1 13 1 2 1 28 1 3 2 14 1 4 2 29 1 5 3 4 1 6 3 6 1 7 3 11 1 8 4 5 1 9 4 9 1 10 4 15 1 11 5 8 ar 12 5 10 ar 13 6 7 1 14 6 16 1 15 6 17 1 16 7 8 1 17 7 18 1 18 7 19 1 19 8 12 ar 20 9 20 1 21 9 21 1 22 9 22 1 23 10 13 ar 24 10 23 1 25 11 24 1 26 11 25 1 27 11 26 1 28 12 14 ar 29 12 27 1 30 13 14 ar