HMDB0012273 RDKit 3D Palmitic amide 51 50 0 0 0 0 0 0 0 0999 V2000 5.9938 -1.1261 -0.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9676 -1.8397 0.5468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7024 -2.1146 -0.2049 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0231 -0.8882 -0.7126 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6314 0.0666 0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9499 1.2825 -0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 2.2403 0.9136 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6243 1.6347 1.8952 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6444 1.1863 1.1653 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2893 2.3500 0.5375 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5489 2.0780 -0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6017 1.2297 -1.3735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1789 -0.1794 -1.2796 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -1.0147 -0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3997 -1.0673 -0.5624 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0651 -1.8982 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4840 -2.1255 0.4346 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3831 -2.4176 1.3868 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4617 -1.8677 -0.9653 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8048 -0.7664 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5961 -0.2565 -0.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.3446 1.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4206 -2.8422 0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0248 -2.6797 0.4673 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -2.7756 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6527 -0.4081 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0736 -1.2054 -1.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5727 0.3984 0.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -0.4037 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6265 1.8000 -0.9103 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0353 0.9572 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2667 3.1805 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5298 2.4092 1.4785 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2584 2.4100 2.6246 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0311 0.8000 2.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3486 0.7931 1.9508 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3637 0.3340 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 3.0616 1.3893 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5997 2.9297 -0.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2733 1.6937 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9501 3.0995 -0.4945 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0244 1.6736 -2.2456 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6624 1.2088 -1.8186 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.3512 -1.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5374 -0.6428 -2.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -2.0378 -0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8147 -0.6796 0.7695 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7814 -0.0298 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5783 -1.4600 -1.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9557 -1.9765 -0.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0226 -2.4184 1.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 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 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 2 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 14 46 1 0 14 47 1 0 15 48 1 0 15 49 1 0 17 50 1 0 17 51 1 0 M END