HMDB0011154 RDKit 3D LysoPA(P-16:0/0:0) 65 64 0 0 0 0 0 0 0 0999 V2000 9.4241 0.8475 -2.6032 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7059 0.4777 -1.3466 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4081 -0.2919 -1.6277 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8086 -0.5884 -0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5111 -1.3546 -0.3687 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4903 -0.5844 -1.1384 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1675 0.7528 -0.5138 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 0.6081 0.8863 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3302 -0.2248 0.8719 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8525 -0.3229 2.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6071 -1.1294 2.3896 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4922 -0.4942 1.5778 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7199 -1.3760 1.7551 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8979 -0.8435 0.9861 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3044 0.5100 1.3905 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5113 0.7625 1.8623 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4514 -0.2279 2.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7703 -0.1645 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6878 0.0018 -0.0029 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0198 -1.0674 -0.5905 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0855 0.0218 -0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9325 0.1924 -1.9863 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4046 0.2324 -2.7890 P 0 0 0 0 0 5 0 0 0 0 0 0 -9.2032 -0.4494 -4.1402 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8851 1.8316 -2.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5899 -0.6802 -1.9795 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4986 0.9987 -2.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2906 0.0731 -3.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9843 1.8006 -2.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4299 1.4131 -0.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3108 -0.1205 -0.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7499 0.3803 -2.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6332 -1.2178 -2.1937 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6312 0.3888 0.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5644 -1.1949 0.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6531 -2.3278 -0.9018 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1126 -1.6163 0.6239 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8758 -0.3903 -2.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5698 -1.1949 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3751 1.2239 -1.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0364 1.4341 -0.5135 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3037 0.1304 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3956 1.6269 1.2602 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6209 0.2752 0.1828 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5382 -1.2449 0.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6342 0.7320 2.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6914 -0.7429 2.8978 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7586 -2.1663 2.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3114 -1.2131 3.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1779 -0.4840 0.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6819 0.5477 1.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9534 -1.4027 2.8324 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4744 -2.3661 1.3453 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5957 -0.8159 -0.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7309 -1.5591 1.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6105 1.3292 1.3059 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7486 1.7773 2.1419 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 0.6528 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2401 -1.1501 1.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2326 0.9769 -0.2134 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0494 -1.8826 -0.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6792 0.8475 -0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5235 -0.9793 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2769 2.4769 -2.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6253 -0.4858 -1.0229 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 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 23 26 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 5 36 1 0 5 37 1 0 6 38 1 0 6 39 1 0 7 40 1 0 7 41 1 0 8 42 1 0 8 43 1 0 9 44 1 0 9 45 1 0 10 46 1 0 10 47 1 0 11 48 1 0 11 49 1 0 12 50 1 0 12 51 1 0 13 52 1 0 13 53 1 0 14 54 1 0 14 55 1 0 15 56 1 0 16 57 1 0 18 58 1 0 18 59 1 0 19 60 1 1 20 61 1 0 21 62 1 0 21 63 1 0 25 64 1 0 26 65 1 0 M END