HMDB0249246 RDKit 3D Bis(2-methoxyethyl) phthalate 38 38 0 0 0 0 0 0 0 0999 V2000 -3.7434 -2.7269 1.1984 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6153 -2.4924 -0.1552 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4893 -1.7614 -0.4858 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5251 -0.4314 0.1786 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3623 0.3504 -0.1538 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 1.6020 0.3217 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1147 2.0049 1.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0839 2.5375 0.1167 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1635 3.8041 0.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7941 4.7598 0.6137 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8709 4.4431 -0.1815 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9793 3.2319 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9928 2.2287 -0.6744 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1898 0.9718 -1.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 0.8921 -2.0614 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4296 -0.1478 -1.4048 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7132 -1.3339 -2.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9985 -1.9142 -1.5686 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9011 -2.2064 -0.2075 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0961 -2.7378 0.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8805 -3.2869 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9132 -1.8413 1.8115 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6844 -3.3511 1.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4216 -1.7068 -1.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -2.3177 -0.0741 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4428 -0.5739 1.2916 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4568 0.1013 -0.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0289 4.0037 1.3632 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7523 5.7284 1.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6557 5.2021 -0.3041 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8277 2.9992 -1.4247 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1035 -2.0577 -2.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9355 -1.0810 -3.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2112 -2.9094 -2.0659 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8872 -1.2865 -1.7254 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9325 -2.0214 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9987 -3.0383 1.3094 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3507 -3.6368 -0.3500 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 2 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 13 8 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 9 28 1 0 10 29 1 0 11 30 1 0 12 31 1 0 17 32 1 0 17 33 1 0 18 34 1 0 18 35 1 0 20 36 1 0 20 37 1 0 20 38 1 0 M END