@MOLECULE 3-[(1e)-1-{4-[2-(methylamino)ethoxy]phenyl}-2-phenyl-1-buten-1-yl]phenol 55 57 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.6498 -1.3141 0.5191 O.3 1 UNL1111111111 -0.3580 2 O 3.9540 -3.7035 -1.7693 O.3 1 UNL1111111111 -0.4767 3 N -6.9990 -1.0999 -0.8277 N.3 1 UNL1111111111 -0.5194 4 C 1.7306 0.1686 0.2165 C.2 1 UNL1111111111 -0.0733 5 C 2.1386 1.4473 0.1323 C.2 1 UNL1111111111 -0.0008 6 C 3.5835 1.8452 0.0757 C.3 1 UNL1111111111 -0.2611 7 C 0.3154 -0.2185 0.2483 C.ar 1 UNL1111111111 -0.0788 8 C 2.6708 -0.9621 0.2829 C.ar 1 UNL1111111111 0.1050 9 C 1.1770 2.5596 0.0985 C.ar 1 UNL1111111111 -0.0060 10 C -0.5449 0.1738 -0.7779 C.ar 1 UNL1111111111 -0.0728 11 C -0.1738 -0.9802 1.3184 C.ar 1 UNL1111111111 -0.0816 12 C 4.1645 1.5815 -1.3159 C.3 1 UNL1111111111 -0.4260 13 C 2.8366 -1.7829 -0.8342 C.ar 1 UNL1111111111 -0.3249 14 C 3.3728 -1.2191 1.4633 C.ar 1 UNL1111111111 -0.2479 15 C 0.3958 2.8348 1.2243 C.ar 1 UNL1111111111 -0.1484 16 C 1.0361 3.3333 -1.0557 C.ar 1 UNL1111111111 -0.1631 17 C -2.3659 -0.9079 0.3408 C.ar 1 UNL1111111111 0.2661 18 C -1.8953 -0.1666 -0.7422 C.ar 1 UNL1111111111 -0.2980 19 C -1.5139 -1.3268 1.3764 C.ar 1 UNL1111111111 -0.2475 20 C 3.7248 -2.8532 -0.7344 C.ar 1 UNL1111111111 0.3018 21 C 4.2552 -2.2979 1.5311 C.ar 1 UNL1111111111 -0.0707 22 C -0.5277 3.8760 1.1905 C.ar 1 UNL1111111111 -0.1413 23 C 0.1097 4.3727 -1.0849 C.ar 1 UNL1111111111 -0.1457 24 C 4.4456 -3.1279 0.4329 C.ar 1 UNL1111111111 -0.2632 25 C -4.6203 -0.8460 -0.4198 C.3 1 UNL1111111111 -0.0435 26 C -0.6731 4.6438 0.0361 C.ar 1 UNL1111111111 -0.1546 27 C -5.9464 -1.3537 0.1800 C.3 1 UNL1111111111 -0.1380 28 C -8.3500 -1.2095 -0.2425 C.3 1 UNL1111111111 -0.2730 29 H 3.7069 2.9151 0.3403 H 1 UNL1111111111 0.1483 30 H 4.1661 1.2837 0.8372 H 1 UNL1111111111 0.1553 31 H -0.1583 0.7617 -1.6111 H 1 UNL1111111111 0.1553 32 H 0.5081 -1.2970 2.1084 H 1 UNL1111111111 0.1580 33 H 4.0956 0.5172 -1.5774 H 1 UNL1111111111 0.1535 34 H 5.2216 1.8642 -1.3618 H 1 UNL1111111111 0.1420 35 H 3.6338 2.1478 -2.0883 H 1 UNL1111111111 0.1421 36 H 2.2788 -1.5916 -1.7440 H 1 UNL1111111111 0.1694 37 H 3.2285 -0.5777 2.3284 H 1 UNL1111111111 0.1608 38 H 0.5030 2.2241 2.1193 H 1 UNL1111111111 0.1592 39 H 1.6463 3.1189 -1.9303 H 1 UNL1111111111 0.1534 40 H -2.5508 0.1507 -1.5450 H 1 UNL1111111111 0.1635 41 H -1.9145 -1.9108 2.2000 H 1 UNL1111111111 0.1701 42 H 4.7997 -2.4923 2.4547 H 1 UNL1111111111 0.1477 43 H -1.1405 4.0858 2.0648 H 1 UNL1111111111 0.1494 44 H -0.0041 4.9724 -1.9851 H 1 UNL1111111111 0.1466 45 H 5.1270 -3.9724 0.4632 H 1 UNL1111111111 0.1730 46 H -4.5973 0.2557 -0.4793 H 1 UNL1111111111 0.1434 47 H -4.4103 -1.2856 -1.4087 H 1 UNL1111111111 0.1295 48 H -1.3985 5.4534 0.0097 H 1 UNL1111111111 0.1471 49 H -6.1736 -0.7907 1.1112 H 1 UNL1111111111 0.1533 50 H -5.8511 -2.4215 0.4707 H 1 UNL1111111111 0.1298 51 H -6.9010 -1.7385 -1.6165 H 1 UNL1111111111 0.2501 52 H 3.3963 -3.4927 -2.5561 H 1 UNL1111111111 0.3278 53 H -9.0935 -1.0075 -1.0321 H 1 UNL1111111111 0.1456 54 H -8.4783 -0.4316 0.5295 H 1 UNL1111111111 0.1493 55 H -8.5747 -2.1874 0.2083 H 1 UNL1111111111 0.1179 @BOND 1 1 17 1 2 1 25 1 3 2 20 1 4 2 52 1 5 3 27 1 6 3 28 1 7 3 51 1 8 4 5 2 9 4 7 1 10 4 8 1 11 5 6 1 12 5 9 1 13 6 12 1 14 6 29 1 15 6 30 1 16 7 10 ar 17 7 11 ar 18 8 13 ar 19 8 14 ar 20 9 15 ar 21 9 16 ar 22 10 18 ar 23 10 31 1 24 11 19 ar 25 11 32 1 26 12 33 1 27 12 34 1 28 12 35 1 29 13 20 ar 30 13 36 1 31 14 21 ar 32 14 37 1 33 15 22 ar 34 15 38 1 35 16 23 ar 36 16 39 1 37 17 18 ar 38 17 19 ar 39 18 40 1 40 19 41 1 41 20 24 ar 42 21 24 ar 43 21 42 1 44 22 26 ar 45 22 43 1 46 23 26 ar 47 23 44 1 48 24 45 1 49 25 27 1 50 25 46 1 51 25 47 1 52 26 48 1 53 27 49 1 54 27 50 1 55 28 53 1 56 28 54 1 57 28 55 1