HMDB0258822 RDKit 3D Triethylenephosphoramide 23 25 0 0 0 0 0 0 0 0999 V2000 0.3027 0.1520 1.4411 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.0417 -0.0603 P 0 0 0 0 0 5 0 0 0 0 0 0 0.1154 1.6857 -0.6843 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4984 2.6857 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0693 2.3422 -1.1259 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3744 -0.8174 -0.7526 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6356 -0.0676 -0.6298 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3931 -1.3612 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4858 -0.6970 -0.2853 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6919 -2.0697 -0.5583 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9252 -1.5969 0.8461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0549 2.3228 1.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1631 3.5560 0.3521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0284 1.8203 -1.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 3.0785 -1.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2973 -0.0245 -1.5135 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6753 0.8138 0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2854 -1.3788 1.1747 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9796 -2.2152 -0.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.2838 -1.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -2.7845 -0.7317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9327 -1.3357 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -1.8662 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 2 6 1 0 6 7 1 0 7 8 1 0 2 9 1 0 9 10 1 0 10 11 1 0 5 3 1 0 8 6 1 0 11 9 1 0 4 12 1 0 4 13 1 0 5 14 1 0 5 15 1 0 7 16 1 0 7 17 1 0 8 18 1 0 8 19 1 0 10 20 1 0 10 21 1 0 11 22 1 0 11 23 1 0 M END