@MOLECULE (3s,4as,8as)-2-methyldecahydro-3-isoquinolinecarboxylic acid 33 34 0 0 0 SMALL GASTEIGER @ATOM 1 N 1.0037 1.1367 -0.2088 N.3 1 UNL1111111111 -0.4293 2 C 2.2294 1.9685 -0.2234 C.3 1 UNL1111111111 -0.1677 3 C 1.2315 -0.1338 0.5265 C.3 1 UNL1111111111 1.1097 4 C 2.3073 -0.9143 -0.2148 C.2 1 UNL1111111111 0.5448 5 O 2.2061 -1.6983 -1.1162 O.2 1 UNL1111111111 -0.7812 6 C -0.0421 -0.9995 0.5013 C.3 1 UNL1111111111 -0.2720 7 C -1.2213 -0.2419 1.1215 C.3 1 UNL1111111111 -0.2271 8 C -2.5078 -1.0842 1.0675 C.3 1 UNL1111111111 0.4816 9 C -3.0232 -1.2642 -0.3660 C.3 1 UNL1111111111 -0.5484 10 C -3.2364 0.0956 -1.0424 C.3 1 UNL1111111111 -0.1953 11 C -1.9371 0.9080 -1.0380 C.3 1 UNL1111111111 0.2983 12 C -1.4290 1.1036 0.3981 C.3 1 UNL1111111111 -0.3465 13 C -0.1093 1.9051 0.4055 C.3 1 UNL1111111111 0.0918 14 O 3.5252 -0.6498 0.3376 O.3 1 UNL1111111111 -0.6466 15 H 2.6456 2.1891 0.7704 H 1 UNL1111111111 -0.0800 16 H 3.0068 1.4544 -0.8158 H 1 UNL1111111111 0.1678 17 H 2.0157 2.9189 -0.7388 H 1 UNL1111111111 0.1525 18 H 1.5606 0.0393 1.5860 H 1 UNL1111111111 -0.2373 19 H 0.1336 -1.9521 1.0319 H 1 UNL1111111111 0.0051 20 H -0.2790 -1.2740 -0.5507 H 1 UNL1111111111 0.2248 21 H -0.9863 -0.0325 2.1938 H 1 UNL1111111111 0.0711 22 H -3.2884 -0.5967 1.6819 H 1 UNL1111111111 0.0058 23 H -2.3298 -2.0721 1.5306 H 1 UNL1111111111 -0.0381 24 H -3.9677 -1.8378 -0.3577 H 1 UNL1111111111 0.1182 25 H -2.3070 -1.8679 -0.9558 H 1 UNL1111111111 0.0259 26 H -4.0360 0.6554 -0.5238 H 1 UNL1111111111 0.0914 27 H -3.5874 -0.0483 -2.0807 H 1 UNL1111111111 0.0601 28 H -2.0953 1.8877 -1.5224 H 1 UNL1111111111 0.0116 29 H -1.1588 0.4007 -1.6445 H 1 UNL1111111111 -0.0082 30 H -2.1925 1.6921 0.9627 H 1 UNL1111111111 0.1008 31 H 0.1227 2.2273 1.4435 H 1 UNL1111111111 -0.0287 32 H -0.2423 2.8300 -0.2002 H 1 UNL1111111111 0.0429 33 H 4.2704 -1.1402 -0.0836 H 1 UNL1111111111 0.4021 @BOND 1 1 2 1 2 1 3 1 3 1 13 1 4 2 15 1 5 2 16 1 6 2 17 1 7 3 4 1 8 3 6 1 9 3 18 1 10 4 5 2 11 4 14 1 12 6 7 1 13 6 19 1 14 6 20 1 15 7 8 1 16 7 12 1 17 7 21 1 18 8 9 1 19 8 22 1 20 8 23 1 21 9 10 1 22 9 24 1 23 9 25 1 24 10 11 1 25 10 26 1 26 10 27 1 27 11 12 1 28 11 28 1 29 11 29 1 30 12 13 1 31 12 30 1 32 13 31 1 33 13 32 1 34 14 33 1