HMDB0034446 RDKit 3D Diphenyl ether 23 24 0 0 0 0 0 0 0 0999 V2000 4.0203 0.3483 -0.3908 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -0.9053 -0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2762 -1.2331 0.0964 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2686 -0.2673 -0.1493 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0373 -0.6290 -0.0173 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2533 -0.3279 -0.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8092 0.9002 -0.3487 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 1.1667 -0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0471 0.1618 -0.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5496 -1.0783 0.1862 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2098 -1.3462 0.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7153 0.9785 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0739 1.3010 -0.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 0.6204 -0.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3803 -1.6557 0.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9979 -2.2322 0.3836 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1611 1.7319 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5112 2.1683 -0.6194 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1212 0.3696 -0.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2775 -1.8755 0.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7985 -2.3092 0.4464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0683 1.8134 -0.7293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4033 2.2997 -0.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 4 12 1 0 12 13 2 0 13 1 1 0 11 6 1 0 1 14 1 0 2 15 1 0 3 16 1 0 7 17 1 0 8 18 1 0 9 19 1 0 10 20 1 0 11 21 1 0 12 22 1 0 13 23 1 0 M END