HMDB0252265 RDKit 3D Fipronil 30 31 0 0 0 0 0 0 0 0999 V2000 -3.9758 1.9196 -2.6074 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1763 1.4246 -1.9264 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1889 0.8071 -1.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9332 0.4745 -1.3517 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2945 -0.1036 -0.3272 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0994 -0.3654 -0.3514 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9081 0.5040 -1.1514 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0488 1.7332 -2.1242 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 0.4479 -1.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9258 -0.4383 -0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3946 -0.4295 -0.2786 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8809 0.7775 -0.7965 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -1.3934 -1.1272 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8506 -0.5251 1.0212 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1608 -1.2692 0.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7529 -1.2583 0.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9481 -2.4883 1.4218 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1656 -0.1572 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1118 -0.6816 1.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3849 0.4080 0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8557 0.6642 1.1767 S 0 0 0 0 0 4 0 0 0 0 0 0 -4.1729 2.1136 1.4448 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2344 -0.2398 0.5932 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5466 0.1071 -0.7376 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3804 -0.1562 1.3133 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8881 -1.6082 0.4790 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8348 1.1420 -1.7862 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6587 -1.9433 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7563 -1.5321 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5751 -0.3664 2.7773 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 11 13 1 0 11 14 1 0 10 15 1 0 15 16 2 0 16 17 1 0 5 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 20 3 1 0 16 6 1 0 9 27 1 0 15 28 1 0 19 29 1 0 19 30 1 0 M END