HMDB0041887 RDKit 3D Endalin 28 29 0 0 0 0 0 0 0 0999 V2000 4.9992 0.4437 -0.2926 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7249 0.3037 -0.1453 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2057 -0.8966 0.1623 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9025 -1.1078 0.3276 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -2.3842 0.6498 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0567 -0.0819 0.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3747 -0.2133 0.3428 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8727 -1.5965 -0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3236 -1.2855 -0.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3024 0.1898 -0.6772 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 0.9792 0.3785 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9204 2.3341 0.0172 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9885 0.6176 -0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5287 1.1396 -0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8823 1.3826 -0.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3386 2.6227 -0.6122 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 1.3685 -0.5301 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5545 -2.7032 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6629 0.0289 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9245 -2.2387 0.8821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3419 -2.0364 -0.8641 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9961 -1.4418 0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6427 -1.8361 -1.2916 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6768 0.4396 -1.6923 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1333 0.6840 0.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5948 0.8670 1.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0161 2.4330 -0.3566 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8483 1.9882 -0.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 2 0 4 5 1 0 4 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 10 13 1 0 6 14 1 0 14 15 2 0 15 16 1 0 15 2 1 0 13 7 1 0 1 17 1 0 5 18 1 0 7 19 1 0 8 20 1 0 8 21 1 0 9 22 1 0 9 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 12 27 1 0 14 28 1 0 M END