@MOLECULE o-{(r)-hydroxy[(2r)-2-hydroxy-3-{[(1r)-1-hydroxypentadecyl]oxy}propoxy]phosphoryl}-l-serine 76 75 0 0 0 SMALL GASTEIGER @ATOM 1 O1 10.3895 0.1784 1.0112 O.3 1 <1> -0.5557 2 C1 9.1916 0.1580 1.6427 C.2 1 <1> 0.6259 3 O2 9.1135 0.1378 2.8414 O.2 1 <1> -0.5068 4 C2 8.0596 0.2115 0.6287 C.3 1 <1> -0.0433 5 N1 7.2443 -0.9852 0.8682 N.3 1 <1> -0.6218 6 C3 7.3290 1.5669 0.8227 C.3 1 <1> -0.0613 7 O3 6.7532 1.9668 -0.4258 O.3 1 <1> -0.2589 8 P1 5.2139 1.7034 -0.8059 P.3 1 <1> 0.3459 9 O4 4.1593 2.0206 0.1370 O.2 1 <1> -0.2523 10 O5 5.1478 2.5620 -2.1394 O.3 1 <1> -0.2814 11 O6 5.3693 0.1694 -1.2548 O.3 1 <1> -0.3510 12 C4 4.2779 -0.5638 -1.8391 C.3 1 <1> -0.0605 13 C5 4.2694 -1.9187 -1.0861 C.3 1 <1> 0.0837 14 O7 3.5710 -2.8265 -1.8932 O.3 1 <1> -0.5567 15 C6 3.6661 -1.8453 0.3299 C.3 1 <1> -0.0843 16 O8 2.2877 -2.1467 0.3879 O.3 1 <1> -0.4404 17 C7 1.3908 -1.2492 -0.2169 C.3 1 <1> 0.3556 18 O9 1.1410 -1.7310 -1.5248 O.3 1 <1> -0.6070 19 C8 0.1305 -1.3138 0.6480 C.3 1 <1> -0.3548 20 C9 -0.9849 -0.4650 0.0341 C.3 1 <1> -0.2658 21 C10 -2.2978 -0.6837 0.7952 C.3 1 <1> -0.2698 22 C11 -3.4572 0.0640 0.1238 C.3 1 <1> -0.2725 23 C12 -4.7764 -0.2551 0.8388 C.3 1 <1> -0.2744 24 C13 -5.9636 0.4199 0.1406 C.3 1 <1> -0.2724 25 C14 -7.2807 -0.0090 0.8008 C.3 1 <1> -0.2730 26 C15 -8.4857 0.6132 0.0847 C.3 1 <1> -0.2726 27 C16 -9.7956 0.1017 0.6985 C.3 1 <1> -0.2717 28 C17 -11.0076 0.6448 -0.0686 C.3 1 <1> -0.2722 29 C18 -12.3124 0.1093 0.5352 C.3 1 <1> -0.2746 30 C19 -13.5251 0.6215 -0.2521 C.3 1 <1> -0.2722 31 C20 -14.8299 0.0695 0.3380 C.3 1 <1> -0.2510 32 C21 -16.0386 0.5566 -0.4611 C.3 1 <1> -0.4398 33 H1 11.1660 0.1125 1.6204 H 1 <1> 0.3550 34 H2 8.4722 0.1521 -0.4203 H 1 <1> 0.1965 35 H3 6.8026 -0.9709 1.7769 H 1 <1> 0.2581 36 H4 6.5379 -1.0951 0.1540 H 1 <1> 0.2767 37 H5 8.0543 2.4018 0.9687 H 1 <1> 0.1495 38 H6 6.6535 1.5465 1.6997 H 1 <1> 0.1508 39 H7 5.9823 2.3590 -2.7097 H 1 <1> 0.3129 40 H8 3.2784 -0.0920 -1.8347 H 1 <1> 0.1431 41 H9 4.5791 -0.7251 -2.8981 H 1 <1> 0.1449 42 H10 5.2996 -2.3473 -1.0478 H 1 <1> 0.1508 43 H11 2.6101 -2.5834 -1.8939 H 1 <1> 0.3469 44 H12 4.0744 -2.6592 0.9660 H 1 <1> 0.1525 45 H13 3.8492 -0.8759 0.8220 H 1 <1> 0.1395 46 H14 1.8077 -0.2361 -0.3834 H 1 <1> 0.1468 47 H15 0.5948 -2.5443 -1.5192 H 1 <1> 0.3383 48 H16 -0.1928 -2.3666 0.7692 H 1 <1> 0.1595 49 H17 0.3685 -0.9677 1.6735 H 1 <1> 0.1649 50 H18 -0.7080 0.6067 0.0514 H 1 <1> 0.1437 51 H19 -1.1175 -0.7203 -1.0362 H 1 <1> 0.1492 52 H20 -2.5307 -1.7646 0.8454 H 1 <1> 0.1376 53 H21 -2.1892 -0.3494 1.8440 H 1 <1> 0.1377 54 H22 -3.2698 1.1533 0.1356 H 1 <1> 0.1372 55 H23 -3.5266 -0.2208 -0.9429 H 1 <1> 0.1381 56 H24 -4.9321 -1.3506 0.8667 H 1 <1> 0.1372 57 H25 -4.7243 0.0704 1.8944 H 1 <1> 0.1363 58 H26 -5.8560 1.5192 0.1804 H 1 <1> 0.1365 59 H27 -5.9746 0.1540 -0.9329 H 1 <1> 0.1372 60 H28 -7.3651 -1.1122 0.7886 H 1 <1> 0.1367 61 H29 -7.2826 0.2824 1.8675 H 1 <1> 0.1362 62 H30 -8.4400 1.7159 0.1491 H 1 <1> 0.1363 63 H31 -8.4528 0.3699 -0.9936 H 1 <1> 0.1370 64 H32 -9.8106 -1.0044 0.6895 H 1 <1> 0.1366 65 H33 -9.8558 0.3971 1.7624 H 1 <1> 0.1361 66 H34 -11.0056 1.7501 -0.0496 H 1 <1> 0.1364 67 H35 -10.9397 0.3594 -1.1351 H 1 <1> 0.1366 68 H36 -12.3026 -0.9966 0.5365 H 1 <1> 0.1364 69 H37 -12.3923 0.4135 1.5953 H 1 <1> 0.1362 70 H38 -13.5444 1.7270 -0.2429 H 1 <1> 0.1363 71 H39 -13.4386 0.3290 -1.3152 H 1 <1> 0.1366 72 H40 -14.8035 -1.0365 0.3459 H 1 <1> 0.1336 73 H41 -14.9265 0.3778 1.3960 H 1 <1> 0.1335 74 H42 -16.9742 0.1719 -0.0406 H 1 <1> 0.1400 75 H43 -16.1033 1.6502 -0.4630 H 1 <1> 0.1423 76 H44 -15.9869 0.2283 -1.5052 H 1 <1> 0.1423 @BOND 1 1 2 1 2 1 33 1 3 2 3 2 4 2 4 1 5 4 5 1 6 4 6 1 7 4 34 1 8 5 35 1 9 5 36 1 10 6 7 1 11 6 37 1 12 6 38 1 13 7 8 1 14 8 9 2 15 8 10 1 16 8 11 1 17 10 39 1 18 11 12 1 19 12 13 1 20 12 40 1 21 12 41 1 22 13 14 1 23 13 15 1 24 13 42 1 25 14 43 1 26 15 16 1 27 15 44 1 28 15 45 1 29 16 17 1 30 17 18 1 31 17 19 1 32 17 46 1 33 18 47 1 34 19 20 1 35 19 48 1 36 19 49 1 37 20 21 1 38 20 50 1 39 20 51 1 40 21 22 1 41 21 52 1 42 21 53 1 43 22 23 1 44 22 54 1 45 22 55 1 46 23 24 1 47 23 56 1 48 23 57 1 49 24 25 1 50 24 58 1 51 24 59 1 52 25 26 1 53 25 60 1 54 25 61 1 55 26 27 1 56 26 62 1 57 26 63 1 58 27 28 1 59 27 64 1 60 27 65 1 61 28 29 1 62 28 66 1 63 28 67 1 64 29 30 1 65 29 68 1 66 29 69 1 67 30 31 1 68 30 70 1 69 30 71 1 70 31 32 1 71 31 72 1 72 31 73 1 73 32 74 1 74 32 75 1 75 32 76 1