HMDB0113840 RDKit 3D PE-NMe2(14:1(9Z)/15:0) 116115 0 0 0 0 0 0 0 0999 V2000 1.7801 6.1018 -5.3452 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1959 5.1008 -4.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2085 4.1915 -5.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3442 3.2088 -4.0249 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3097 2.3380 -4.7104 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5588 2.2481 -4.3837 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1738 3.0004 -3.2922 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 2.0035 -2.2775 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3659 2.7136 -1.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9329 1.7695 -0.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8323 0.8971 0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2996 -0.0672 1.4941 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8419 0.6715 2.7023 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7878 1.5325 3.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1534 2.4339 4.0834 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4487 1.3752 3.0307 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5375 2.2600 3.6401 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1046 2.0202 3.3123 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1519 2.2269 1.8082 C 0 0 0 0 0 0 0 0 0 0 0 0 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1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 1 47 1 0 1 48 1 0 1 49 1 0 2 50 1 0 2 51 1 0 3 52 1 0 3 53 1 0 4 54 1 0 4 55 1 0 5 56 1 0 6 57 1 0 7 58 1 0 7 59 1 0 8 60 1 0 8 61 1 0 9 62 1 0 9 63 1 0 10 64 1 0 10 65 1 0 11 66 1 0 11 67 1 0 12 68 1 0 12 69 1 0 13 70 1 0 13 71 1 0 17 72 1 0 17 73 1 0 18 74 1 0 19 75 1 0 19 76 1 0 23 77 1 0 25 78 1 0 25 79 1 0 26 80 1 0 26 81 1 0 28 82 1 0 28 83 1 0 28 84 1 0 29 85 1 0 29 86 1 0 29 87 1 0 33 88 1 0 33 89 1 0 34 90 1 0 34 91 1 0 35 92 1 0 35 93 1 0 36 94 1 0 36 95 1 0 37 96 1 0 37 97 1 0 38 98 1 0 38 99 1 0 39100 1 0 39101 1 0 40102 1 0 40103 1 0 41104 1 0 41105 1 0 42106 1 0 42107 1 0 43108 1 0 43109 1 0 44110 1 0 44111 1 0 45112 1 0 45113 1 0 46114 1 0 46115 1 0 46116 1 0 M END