HMDB0033610 RDKit 3D Pandamarilactam 3x 34 35 0 0 0 0 0 0 0 0999 V2000 5.6749 0.2428 -0.8986 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5071 -0.5524 -0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3822 0.0119 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4347 -1.0301 0.4071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2244 -0.8340 0.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6619 0.5174 1.1606 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6007 0.7594 0.3722 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6457 -0.2737 0.7641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8278 0.0271 -0.0372 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0697 -0.5438 -1.3401 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9833 0.4871 -1.9665 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8389 0.9242 -0.7977 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8902 0.9000 0.3275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9909 1.5275 1.4089 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0704 -2.2384 0.1256 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3362 -1.9990 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2122 -2.8185 -0.7623 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5915 -0.3221 -0.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5898 0.5084 -1.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7439 1.2150 -0.3525 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1985 1.0757 0.1308 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6293 -1.6997 1.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 1.3214 1.0216 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3904 0.5276 2.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0053 1.7468 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4207 0.7834 -0.7037 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3022 -1.3069 0.6118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9289 -0.1642 1.8211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -1.5293 -1.2229 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1515 -0.7130 -1.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5702 0.0563 -2.7859 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3418 1.3326 -2.2934 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2896 1.9213 -0.9779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 0.1393 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 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 14 2 0 4 15 1 0 15 16 1 0 16 17 2 0 16 2 1 0 13 9 1 0 1 18 1 0 1 19 1 0 1 20 1 0 3 21 1 0 5 22 1 0 6 23 1 0 6 24 1 0 7 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 10 29 1 0 10 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 M END