HMDB0258842 RDKit 3D Tert-Butyl ethyl ether 21 20 0 0 0 0 0 0 0 0999 V2000 2.8562 -0.5147 -0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5314 0.1621 0.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5465 -0.4687 -0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7226 -0.0142 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9557 1.4188 -0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6513 -0.8534 -1.0534 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2241 -0.2323 1.2569 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8802 -0.7650 -1.1082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9939 -1.4580 0.5252 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 0.1521 0.2106 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3714 -0.0685 1.4313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6103 1.2455 0.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2039 2.1189 -0.1431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1612 1.5542 -1.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9252 1.7201 -0.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0756 -1.0843 -1.9704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5993 -0.3332 -1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7995 -1.8157 -0.5145 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3167 -0.0313 1.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0835 -1.2630 1.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7922 0.5305 1.9486 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 4 6 1 0 4 7 1 0 1 8 1 0 1 9 1 0 1 10 1 0 2 11 1 0 2 12 1 0 5 13 1 0 5 14 1 0 5 15 1 0 6 16 1 0 6 17 1 0 6 18 1 0 7 19 1 0 7 20 1 0 7 21 1 0 M END