HMDB0000888 RDKit 3D Undecanedioic acid 35 34 0 0 0 0 0 0 0 0999 V2000 -4.8357 0.2911 1.3495 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3308 -0.0165 0.2531 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6543 -0.4426 0.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5543 0.0602 -0.9892 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1342 0.4439 -0.7333 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3653 -0.5272 0.1012 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9316 -0.1053 0.3583 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 0.0214 -0.9468 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2272 0.4268 -0.7903 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0263 -0.5543 0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4446 -0.0230 0.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3401 -0.9485 0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7207 -0.4027 0.9308 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9879 0.6826 0.3576 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7227 -1.0778 1.6058 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3798 0.2669 0.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0337 0.7642 -1.7308 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6261 -0.9343 -1.5316 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1347 1.4551 -0.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 0.5881 -1.7465 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8949 -0.7778 1.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3339 -1.4928 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9957 0.8837 0.8931 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4948 -0.8669 1.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6961 0.8565 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3116 -0.9042 -1.5128 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6613 0.4181 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3383 1.4476 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0829 -1.4964 -0.5866 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -0.7795 0.9936 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 0.9780 0.5631 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8812 0.0698 -0.9202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9994 -1.0340 1.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3483 -1.9697 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7337 -1.1944 2.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 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 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 3 16 1 0 4 17 1 0 4 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 7 23 1 0 7 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 9 28 1 0 10 29 1 0 10 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 15 35 1 0 M END