HMDB0255106 RDKit 3D N-Cyclohexyltaurine 30 30 0 0 0 0 0 0 0 0999 V2000 -4.6317 0.7875 0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9542 -0.3911 0.2218 S 0 0 0 0 0 6 0 0 0 0 0 0 -3.5849 -1.4484 1.2302 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9456 -1.0655 -0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4345 0.2093 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6273 0.8013 0.6333 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3731 1.3355 0.2187 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 0.3466 -0.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9211 -0.5439 0.8972 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2411 -1.2059 0.8988 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1902 -0.7937 -0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0778 0.6903 -0.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7212 1.0796 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0488 -2.0302 -0.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6149 0.9993 -1.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9353 -0.6413 -0.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5653 0.0398 1.4156 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2156 1.6715 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5099 2.1218 -0.4288 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.2382 -1.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7937 0.0152 1.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1268 -1.3454 0.9554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7822 -1.0510 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -2.3291 0.8262 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -1.3673 -1.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2296 -1.0043 0.1466 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8579 1.0052 -1.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2965 1.1998 0.5859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6411 2.1952 -0.7141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7227 0.9574 -1.9723 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 2 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 8 1 0 4 14 1 0 5 15 1 0 5 16 1 0 6 17 1 0 6 18 1 0 7 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 10 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 12 27 1 0 12 28 1 0 13 29 1 0 13 30 1 0 M END