@MOLECULE (2r,6r)-6-(iodomethyl)-2-phenoxy-1,2-oxaphosphinane 2-oxide 30 31 0 0 0 SMALL USER_CHARGES @ATOM 1 I -2.6461 0.4615 0.1305 I 1 UNL111111 -0.0512 2 P 2.0580 -1.3349 0.5982 P.3 1 UNL111111 0.2176 3 O 0.4567 -1.2592 0.7264 O.3 1 UNL111111 -0.2791 4 O 2.4597 -0.2239 -0.5109 O.3 1 UNL111111 -0.3327 5 O 2.6175 -1.1420 1.9312 O.2 1 UNL111111 -0.2274 6 C -0.1160 -3.0316 -0.9146 C.3 1 UNL111111 -0.3280 7 C 1.3095 -3.1339 -1.4842 C.3 1 UNL111111 -0.2214 8 C -0.3837 -1.6027 -0.3967 C.3 1 UNL111111 0.1313 9 C 2.4263 -2.7920 -0.4592 C.3 1 UNL111111 -0.1904 10 C -1.7705 -1.5125 0.2572 C.3 1 UNL111111 -0.3316 11 C 2.2486 1.1219 -0.3304 C.ar 1 UNL111111 0.2909 12 C 3.1377 1.9000 0.4192 C.ar 1 UNL111111 -0.2280 13 C 1.2229 1.7000 -1.0911 C.ar 1 UNL111111 -0.2440 14 C 2.9891 3.2834 0.3951 C.ar 1 UNL111111 -0.1035 15 C 1.0976 3.0852 -1.0963 C.ar 1 UNL111111 -0.0986 16 C 1.9749 3.8772 -0.3557 C.ar 1 UNL111111 -0.2086 17 H -0.8502 -3.2891 -1.6995 H 1 UNL111111 0.1423 18 H -0.2645 -3.7723 -0.1048 H 1 UNL111111 0.1556 19 H 1.4847 -4.1673 -1.8478 H 1 UNL111111 0.1341 20 H 1.3982 -2.4893 -2.3857 H 1 UNL111111 0.1495 21 H -0.2565 -0.8668 -1.2281 H 1 UNL111111 0.1395 22 H 2.5877 -3.6723 0.2319 H 1 UNL111111 0.1852 23 H 3.4005 -2.6280 -1.0044 H 1 UNL111111 0.1874 24 H -1.6974 -1.7522 1.3367 H 1 UNL111111 0.1853 25 H -2.4861 -2.2044 -0.2057 H 1 UNL111111 0.1573 26 H 3.9248 1.4372 1.0107 H 1 UNL111111 0.1746 27 H 0.5433 1.0787 -1.6646 H 1 UNL111111 0.1577 28 H 3.6701 3.9067 0.9726 H 1 UNL111111 0.1450 29 H 0.3045 3.5518 -1.6780 H 1 UNL111111 0.1448 30 H 1.8656 4.9577 -0.3607 H 1 UNL111111 0.1468 @BOND 1 20 7 1 2 19 7 1 3 17 6 1 4 29 15 1 5 27 13 1 6 7 6 1 7 7 9 1 8 21 8 1 9 15 13 ar 10 15 16 ar 11 13 11 ar 12 23 9 1 13 6 8 1 14 6 18 1 15 4 11 1 16 4 2 1 17 9 22 1 18 9 2 1 19 8 10 1 20 8 3 1 21 30 16 1 22 16 14 ar 23 11 12 ar 24 25 10 1 25 1 10 1 26 10 24 1 27 14 12 ar 28 14 28 1 29 12 26 1 30 2 3 1 31 2 5 2