HMDB0015274 RDKit 3D Amifostine 27 26 0 0 0 0 0 0 0 0999 V2000 2.9766 2.1566 0.1239 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3094 1.0643 -0.7282 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8057 -0.2747 -0.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2852 -0.2639 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7653 -1.5377 0.0841 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6666 -1.5423 0.1558 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1745 -0.7773 1.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -0.7810 1.5412 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0342 0.2453 0.1161 P 0 0 0 0 0 5 0 0 0 0 0 0 -5.2726 0.9147 0.7316 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6605 -0.8498 -1.0372 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1747 1.4442 -0.7124 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5709 2.2792 0.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9526 2.2781 0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4259 1.0822 -0.8416 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8964 1.2879 -1.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1743 -0.5281 0.7099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1648 -1.0383 -1.0258 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8711 0.0452 -1.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0283 0.4833 0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1783 -1.8796 0.9797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -1.1531 -0.7975 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0381 -2.6028 0.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7259 0.2378 1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7514 -1.3181 2.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9716 -1.0357 -1.7051 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8706 2.0636 -1.0794 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 2 0 9 11 1 0 9 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 6 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 11 26 1 0 12 27 1 0 M END