@MOLECULE 4-[difluoro(phosphono)methyl]-l-phenylalanine 31 31 0 0 0 SMALL GASTEIGER @ATOM 1 N 1.5819 0.5239 3.9173 N.3 1 UNL11 -0.6287 2 CA 0.1247 0.3937 4.0285 C.3 1 UNL11 0.0043 3 C -0.1659 -0.0122 5.4660 C.2 1 UNL11 0.6264 4 O 0.3038 -0.9258 6.0868 O.2 1 UNL11 -0.4954 5 OXT -1.1154 0.7973 5.9933 O.3 1 UNL11 -0.5557 6 C -0.5138 -0.6825 3.1162 C.3 1 UNL11 -0.3567 7 C -0.2718 -0.3456 1.6804 C.ar 1 UNL11 0.0290 8 C 0.7105 -1.0237 0.9562 C.ar 1 UNL11 -0.1950 9 C -1.0214 0.6569 1.0609 C.ar 1 UNL11 -0.1870 10 C 0.9399 -0.7056 -0.3795 C.ar 1 UNL11 -0.0897 11 C -0.7917 0.9819 -0.2729 C.ar 1 UNL11 -0.1107 12 C 0.1897 0.2998 -0.9940 C.ar 1 UNL11 -0.0988 13 C 0.4217 0.6103 -2.4523 C.3 1 UNL11 0.4017 14 F 0.0685 1.8576 -2.7865 F 1 UNL11 -0.1696 15 F 1.7146 0.5418 -2.7925 F 1 UNL11 -0.1655 16 P -0.4025 -0.4135 -3.7814 P.3 1 UNL11 0.3000 17 O -0.1803 -0.0664 -5.1737 O.2 1 UNL11 -0.2261 18 O 0.1525 -1.8215 -3.2555 O.3 1 UNL11 -0.4510 19 O -1.9616 -0.4382 -3.4495 O.3 1 UNL11 -0.3604 20 H1 1.8632 0.8228 2.9958 H 1 UNL11 0.2665 21 H2 2.0680 -0.3276 4.1600 H 1 UNL11 0.2665 22 HA -0.3296 1.4007 3.8080 H 1 UNL11 0.1841 23 HXT -1.3352 0.5954 6.9368 H 1 UNL11 0.3568 24 H -0.1122 -1.6856 3.3725 H 1 UNL11 0.1709 25 H -1.6033 -0.7525 3.3221 H 1 UNL11 0.1712 26 H 1.2939 -1.8121 1.4287 H 1 UNL11 0.1577 27 H -1.7908 1.1873 1.6203 H 1 UNL11 0.1594 28 H 1.6994 -1.2608 -0.9376 H 1 UNL11 0.1750 29 H -1.3895 1.7704 -0.7356 H 1 UNL11 0.1694 30 H 0.1036 -2.5215 -3.9911 H 1 UNL11 0.3396 31 H -2.1307 -0.8715 -2.5396 H 1 UNL11 0.3119 @BOND 1 1 2 1 2 1 20 1 3 1 21 1 4 2 3 1 5 2 6 1 6 2 22 1 7 3 4 2 8 3 5 1 9 5 23 1 10 6 7 1 11 6 24 1 12 6 25 1 13 7 8 ar 14 7 9 ar 15 8 10 ar 16 8 26 1 17 9 11 ar 18 9 27 1 19 10 12 ar 20 10 28 1 21 11 12 ar 22 11 29 1 23 12 13 1 24 13 14 1 25 13 15 1 26 13 16 1 27 16 17 2 28 16 18 1 29 16 19 1 30 18 30 1 31 19 31 1