HMDB0258294 RDKit 3D Simazine 25 25 0 0 0 0 0 0 0 0999 V2000 2.7855 3.0640 0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8673 1.6721 -0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5827 1.1825 -0.4858 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0372 0.1285 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6755 -0.5405 0.9698 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1431 -1.6485 1.5172 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9713 -2.5239 2.7690 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0639 -2.0718 1.0675 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7315 -1.4270 0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8587 -1.8459 -0.2934 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -1.2981 -1.2895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -0.5419 -0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1803 -0.3287 -0.4195 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 3.0444 1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7507 3.4619 0.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5585 3.6988 0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6143 1.5649 -0.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2142 0.9811 0.7678 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4631 -2.9329 1.5025 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2267 -2.1519 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2331 -0.6913 -2.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6912 -0.4158 -1.2507 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1401 -1.0674 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3792 0.4641 -0.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 0.2233 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 2 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 2 3 10 11 1 0 11 12 1 0 9 13 1 0 13 4 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 8 19 1 0 11 20 1 0 11 21 1 0 12 22 1 0 12 23 1 0 12 24 1 0 13 25 1 0 M END