HMDB0248439 RDKit 3D Anilofos 40 40 0 0 0 0 0 0 0 0999 V2000 5.1336 -1.4399 1.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -0.0744 1.2413 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5668 0.5117 0.5405 P 0 0 0 0 0 5 0 0 0 0 0 0 2.9063 1.6867 1.6522 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0055 1.3684 -0.8507 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2739 1.9559 -0.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1614 -0.9908 0.1548 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5182 -0.2395 0.1223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5485 -1.2350 -0.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3298 -2.4619 -0.3171 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8923 -0.7711 -0.1941 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1756 0.6217 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2693 1.4532 -1.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5396 2.7930 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7099 3.2590 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0529 4.9700 0.5371 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6218 2.4511 1.4717 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3477 1.0991 1.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0107 -1.6583 -0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9271 -2.3467 -1.7814 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -2.7214 0.6223 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -2.0140 1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1751 -1.7505 0.0094 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1074 -1.7134 1.5251 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5652 1.8143 0.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0313 1.3883 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2731 3.0303 -0.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4606 0.6009 -0.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2726 0.2387 1.0962 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1255 1.0341 -2.0772 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6186 3.4762 -1.7843 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7655 2.8673 2.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2802 0.4726 2.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9511 -1.0767 -0.4365 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -1.6582 -2.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9694 -2.6575 -2.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2871 -3.2347 -1.6574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7297 -2.3511 1.5008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7961 -3.5258 0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1828 -3.1715 0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 3 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 11 19 1 0 19 20 1 0 19 21 1 0 18 12 1 0 1 22 1 0 1 23 1 0 1 24 1 0 6 25 1 0 6 26 1 0 6 27 1 0 8 28 1 0 8 29 1 0 13 30 1 0 14 31 1 0 17 32 1 0 18 33 1 0 19 34 1 0 20 35 1 0 20 36 1 0 20 37 1 0 21 38 1 0 21 39 1 0 21 40 1 0 M END