@MOLECULE [({5-[4-(cyclopropyloxy)phenyl]-3-pyridinyl}amino)methylene]bis(phosphonic acid) 44 46 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.9552 -2.8024 0.8498 O.2 1 UNL1111111111 -0.2843 2 P 3.6928 -1.9392 -0.0613 P.3 1 UNL1111111111 0.3093 3 O 5.2429 -2.2891 -0.0232 O.3 1 UNL1111111111 -0.3429 4 O 3.2610 -2.0263 -1.6039 O.3 1 UNL1111111111 -0.4424 5 C 3.4304 -0.0446 0.1506 C.3 1 UNL1111111111 0.1251 6 P 4.6199 1.3265 -0.5093 P.3 1 UNL1111111111 0.3117 7 O 5.9025 0.9677 -1.1012 O.2 1 UNL1111111111 -0.2939 8 O 3.7932 2.2998 -1.4601 O.3 1 UNL1111111111 -0.3316 9 O 4.6844 2.1024 0.8932 O.3 1 UNL1111111111 -0.4436 10 N 2.0940 0.3249 -0.3682 N.pl3 1 UNL1111111111 -0.4640 11 C 0.9981 0.3562 0.5123 C.ar 1 UNL1111111111 0.1399 12 C -0.2949 0.1871 -0.0151 C.ar 1 UNL1111111111 -0.2335 13 C 1.1160 0.6988 1.8805 C.ar 1 UNL1111111111 -0.0597 14 N 0.0483 0.8762 2.6697 N.ar 1 UNL1111111111 -0.3142 15 C -1.1830 0.7302 2.1558 C.ar 1 UNL1111111111 -0.0440 16 C -1.3995 0.3876 0.8082 C.ar 1 UNL1111111111 -0.0150 17 C -2.7620 0.2603 0.2922 C.ar 1 UNL1111111111 -0.1018 18 C -3.6806 -0.5770 0.9285 C.ar 1 UNL1111111111 -0.0694 19 C -4.9873 -0.6807 0.4582 C.ar 1 UNL1111111111 -0.2862 20 C -3.1502 0.9980 -0.8349 C.ar 1 UNL1111111111 -0.0781 21 C -4.4465 0.9120 -1.3177 C.ar 1 UNL1111111111 -0.2452 22 C -5.3558 0.0705 -0.6573 C.ar 1 UNL1111111111 0.2573 23 O -6.5948 0.0870 -1.2222 O.3 1 UNL1111111111 -0.3209 24 C -7.5779 -0.7211 -0.6295 C.3 1 UNL1111111111 0.0541 25 C -8.2393 -0.2095 0.6291 C.3 1 UNL1111111111 -0.3565 26 C -8.9381 -0.0712 -0.7045 C.3 1 UNL1111111111 -0.3191 27 H 5.7728 -1.6490 -0.6311 H 1 UNL1111111111 0.3291 28 H 3.1223 -2.9954 -1.8734 H 1 UNL1111111111 0.3308 29 H 3.4869 0.0904 1.3092 H 1 UNL1111111111 0.2147 30 H 2.8224 2.3536 -1.1151 H 1 UNL1111111111 0.3232 31 H 5.3307 2.8824 0.8367 H 1 UNL1111111111 0.3304 32 H 1.8676 -0.0672 -1.2962 H 1 UNL1111111111 0.3088 33 H -0.4363 -0.1058 -1.0529 H 1 UNL1111111111 0.1675 34 H 2.0878 0.8439 2.3643 H 1 UNL1111111111 0.1802 35 H -2.0167 0.8996 2.8432 H 1 UNL1111111111 0.1764 36 H -3.3723 -1.1579 1.7991 H 1 UNL1111111111 0.1586 37 H -5.6981 -1.3298 0.9595 H 1 UNL1111111111 0.1687 38 H -2.4291 1.6511 -1.3270 H 1 UNL1111111111 0.1552 39 H -4.7692 1.4804 -2.1860 H 1 UNL1111111111 0.1733 40 H -7.4024 -1.7750 -0.8279 H 1 UNL1111111111 0.1569 41 H -8.6113 -0.9083 1.3717 H 1 UNL1111111111 0.1637 42 H -7.8436 0.6796 1.1165 H 1 UNL1111111111 0.1738 43 H -9.0300 0.9149 -1.1583 H 1 UNL1111111111 0.1745 44 H -9.8132 -0.6722 -0.9325 H 1 UNL1111111111 0.1630 @BOND 1 1 2 2 2 2 3 1 3 2 5 1 4 3 27 1 5 4 2 1 6 4 28 1 7 5 10 1 8 5 6 1 9 5 29 1 10 6 8 1 11 6 9 1 12 7 6 2 13 8 30 1 14 9 31 1 15 10 32 1 16 11 10 1 17 11 12 ar 18 12 33 1 19 13 11 ar 20 13 34 1 21 14 13 ar 22 14 15 ar 23 15 16 ar 24 15 35 1 25 16 12 ar 26 16 17 1 27 17 18 ar 28 17 20 ar 29 18 19 ar 30 18 36 1 31 19 22 ar 32 19 37 1 33 20 21 ar 34 20 38 1 35 21 22 ar 36 21 39 1 37 22 23 1 38 23 24 1 39 24 26 1 40 24 40 1 41 25 24 1 42 25 26 1 43 25 41 1 44 25 42 1 45 26 43 1 46 26 44 1