@MOLECULE 2-(4-nonylphenoxy)ethyl dihydrogen phosphate 52 52 0 0 0 SMALL GASTEIGER @ATOM 1 P -7.0810 0.3218 0.1476 P.3 1 UNL1111111111 0.3474 2 O -2.9833 0.2175 0.1205 O.3 1 UNL1111111111 -0.3658 3 O -5.9948 0.8327 -0.9027 O.3 1 UNL1111111111 -0.2551 4 O -6.3766 -0.6476 1.2080 O.3 1 UNL1111111111 -0.4080 5 O -7.3712 1.6212 1.0278 O.3 1 UNL1111111111 -0.3685 6 O -8.1876 -0.2694 -0.5734 O.2 1 UNL1111111111 -0.1808 7 C 5.5400 0.0187 0.0841 C.3 1 UNL1111111111 -0.2708 8 C 7.0167 -0.3896 0.0447 C.3 1 UNL1111111111 -0.2742 9 C 4.6259 -1.2121 0.0065 C.3 1 UNL1111111111 -0.2732 10 C 7.9295 0.8423 0.0887 C.3 1 UNL1111111111 -0.2744 11 C 3.1616 -0.7671 0.0212 C.3 1 UNL1111111111 -0.2624 12 C 9.4044 0.4198 0.0452 C.3 1 UNL1111111111 -0.2723 13 C 2.1960 -1.9606 -0.0584 C.3 1 UNL1111111111 -0.2774 14 C 10.3260 1.6458 0.0765 C.3 1 UNL1111111111 -0.2510 15 C 0.7892 -1.4450 -0.0564 C.ar 1 UNL1111111111 -0.0520 16 C 11.7939 1.2190 0.0446 C.3 1 UNL1111111111 -0.4397 17 C 0.1772 -1.1131 1.1586 C.ar 1 UNL1111111111 -0.1093 18 C 0.0991 -1.2565 -1.2540 C.ar 1 UNL1111111111 -0.1065 19 C -1.0927 -0.5577 1.1782 C.ar 1 UNL1111111111 -0.2455 20 C -1.1817 -0.7076 -1.2573 C.ar 1 UNL1111111111 -0.2904 21 C -1.7562 -0.3481 -0.0392 C.ar 1 UNL1111111111 0.2441 22 C -3.6387 0.6742 -1.0629 C.3 1 UNL1111111111 -0.0817 23 C -4.7955 1.5369 -0.5423 C.3 1 UNL1111111111 -0.0492 24 H 5.3150 0.7063 -0.7539 H 1 UNL1111111111 0.1371 25 H 5.3243 0.5879 1.0094 H 1 UNL1111111111 0.1371 26 H 7.2219 -0.9771 -0.8710 H 1 UNL1111111111 0.1364 27 H 7.2461 -1.0613 0.8927 H 1 UNL1111111111 0.1363 28 H 4.8325 -1.8963 0.8498 H 1 UNL1111111111 0.1367 29 H 4.8439 -1.7935 -0.9107 H 1 UNL1111111111 0.1368 30 H 7.7289 1.4325 1.0020 H 1 UNL1111111111 0.1367 31 H 7.7043 1.5107 -0.7624 H 1 UNL1111111111 0.1365 32 H 2.9516 -0.1819 0.9374 H 1 UNL1111111111 0.1408 33 H 2.9686 -0.0795 -0.8245 H 1 UNL1111111111 0.1409 34 H 9.6326 -0.2449 0.8989 H 1 UNL1111111111 0.1365 35 H 9.5997 -0.1772 -0.8645 H 1 UNL1111111111 0.1364 36 H 2.4059 -2.5623 -0.9638 H 1 UNL1111111111 0.1461 37 H 2.3665 -2.6494 0.7942 H 1 UNL1111111111 0.1481 38 H 10.1061 2.3070 -0.7835 H 1 UNL1111111111 0.1337 39 H 10.1294 2.2478 0.9799 H 1 UNL1111111111 0.1336 40 H 12.0469 0.5883 0.9049 H 1 UNL1111111111 0.1425 41 H 12.4612 2.0872 0.0609 H 1 UNL1111111111 0.1403 42 H 12.0208 0.6459 -0.8618 H 1 UNL1111111111 0.1423 43 H 0.7058 -1.2857 2.0949 H 1 UNL1111111111 0.1545 44 H 0.5670 -1.5284 -2.1989 H 1 UNL1111111111 0.1522 45 H -1.5793 -0.2801 2.1091 H 1 UNL1111111111 0.1697 46 H -1.7069 -0.5764 -2.1960 H 1 UNL1111111111 0.1621 47 H -3.9919 -0.2062 -1.6343 H 1 UNL1111111111 0.1560 48 H -2.9384 1.2605 -1.6804 H 1 UNL1111111111 0.1327 49 H -4.8878 2.4827 -1.1171 H 1 UNL1111111111 0.1448 50 H -4.6452 1.7976 0.5267 H 1 UNL1111111111 0.1539 51 H -5.3729 -0.6889 1.0297 H 1 UNL1111111111 0.3323 52 H -7.6604 1.3196 1.9646 H 1 UNL1111111111 0.3238 @BOND 1 1 3 1 2 1 4 1 3 1 5 1 4 1 6 2 5 2 21 1 6 2 22 1 7 3 23 1 8 4 51 1 9 5 52 1 10 7 8 1 11 7 9 1 12 7 24 1 13 7 25 1 14 8 10 1 15 8 26 1 16 8 27 1 17 9 11 1 18 9 28 1 19 9 29 1 20 10 12 1 21 10 30 1 22 10 31 1 23 11 13 1 24 11 32 1 25 11 33 1 26 12 14 1 27 12 34 1 28 12 35 1 29 13 15 1 30 13 36 1 31 13 37 1 32 14 16 1 33 14 38 1 34 14 39 1 35 15 17 ar 36 15 18 ar 37 16 40 1 38 16 41 1 39 16 42 1 40 17 19 ar 41 17 43 1 42 18 20 ar 43 18 44 1 44 19 21 ar 45 19 45 1 46 20 21 ar 47 20 46 1 48 22 23 1 49 22 47 1 50 22 48 1 51 23 49 1 52 23 50 1