HMDB0062666 RDKit 3D Triethylene Glycol Monomethyl Ether 27 26 0 0 0 0 0 0 0 0999 V2000 4.0605 0.1552 0.6789 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4105 1.2832 0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8188 1.1052 -1.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7816 0.0084 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8296 0.3930 -0.0229 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1901 -0.5387 0.1253 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1412 0.0120 1.1687 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2123 -0.8017 1.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9795 -1.0273 0.3073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5604 0.2153 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -0.1824 -1.4263 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4454 -0.7267 0.8261 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8804 -0.0922 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5661 0.4462 1.6257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3017 2.0662 -1.2789 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5573 0.9433 -1.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2562 -0.9537 -0.7784 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2764 -0.0915 -1.9682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6851 -0.6005 -0.8881 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -1.5410 0.3566 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4252 1.0435 0.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 0.1263 2.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8312 -1.7054 0.5943 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4302 -1.5748 -0.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7739 0.8873 -0.6856 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1592 0.7612 0.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1162 0.3896 -1.4327 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 1 12 1 0 1 13 1 0 1 14 1 0 3 15 1 0 3 16 1 0 4 17 1 0 4 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 9 23 1 0 9 24 1 0 10 25 1 0 10 26 1 0 11 27 1 0 M END