HMDB0037517 RDKit 3D 2-Tetradecylcyclobutanone 53 53 0 0 0 0 0 0 0 0999 V2000 7.5685 1.6211 0.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3855 1.5191 1.3958 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4651 0.4504 0.8236 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0154 0.8347 -0.5587 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1146 -0.2045 -1.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8828 -0.3953 -0.2946 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0477 -1.4546 -0.9647 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7647 -1.7674 -0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0633 -0.5301 -0.1496 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3749 -0.7356 0.5644 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -1.7667 -0.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5182 -2.0276 0.5004 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3783 -0.7930 0.5684 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6467 -0.2758 -0.8163 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5069 0.9658 -0.8076 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8763 0.7985 -0.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 2.2030 0.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 1.9234 0.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2244 2.3417 0.8752 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7354 0.6341 -0.0379 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4144 2.4307 -0.2622 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4517 1.8903 1.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8791 2.4991 1.3943 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6981 1.1927 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5727 0.4478 1.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9836 -0.5169 0.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8804 1.0499 -1.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4543 1.8006 -0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7939 0.1688 -2.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6552 -1.1506 -1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1396 -0.7618 0.7117 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3514 0.5879 -0.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6563 -2.3821 -1.0281 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -1.1498 -2.0056 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2674 -2.5717 -0.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0126 -2.1100 0.7977 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5072 0.2089 0.4728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2363 -0.1118 -1.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -1.0730 1.6032 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8859 0.2482 0.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2882 -1.4832 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6165 -2.7401 -0.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3207 -2.3945 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0252 -2.8129 -0.0934 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9251 -0.0575 1.2285 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3438 -1.1012 1.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6748 0.0143 -1.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0833 -1.0648 -1.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5925 1.4947 -1.7551 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9513 0.0952 0.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7167 0.7524 -0.9051 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0205 2.9453 -0.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0268 2.3142 1.4266 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 17 18 1 0 18 19 2 0 18 15 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 9 37 1 0 9 38 1 0 10 39 1 0 10 40 1 0 11 41 1 0 11 42 1 0 12 43 1 0 12 44 1 0 13 45 1 0 13 46 1 0 14 47 1 0 14 48 1 0 15 49 1 0 16 50 1 0 16 51 1 0 17 52 1 0 17 53 1 0 M END