@MOLECULE 1-(1,2-dihydro-5-acenaphthylenyl)-2-(dipropylamino)ethanol 49 51 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.2495 -1.1482 1.7279 O.3 1 UNL111111111 -0.5646 2 N 2.8511 0.0821 -0.2185 N.3 1 UNL111111111 -0.4569 3 C -2.9802 0.0177 -0.0272 C.ar 1 UNL111111111 -0.0693 4 C -3.4398 -1.2979 0.2563 C.ar 1 UNL111111111 0.0211 5 C -4.9037 -1.3714 -0.0722 C.3 1 UNL111111111 -0.2730 6 C -4.0146 0.8567 -0.5261 C.ar 1 UNL111111111 0.0342 7 C -1.6645 0.4399 0.1647 C.ar 1 UNL111111111 0.0117 8 C -5.2845 0.0580 -0.5946 C.3 1 UNL111111111 -0.2790 9 C -0.7603 -0.5457 0.6625 C.ar 1 UNL111111111 -0.0868 10 C 0.6816 -0.1787 0.8660 C.3 1 UNL111111111 0.1576 11 C 1.4258 -0.2025 -0.4987 C.3 1 UNL111111111 -0.1789 12 C -2.5572 -2.2182 0.7442 C.ar 1 UNL111111111 -0.2012 13 C -1.2047 -1.8189 0.9410 C.ar 1 UNL111111111 -0.0940 14 C 3.1334 1.5379 -0.2448 C.3 1 UNL111111111 -0.1073 15 C 3.7536 -0.6764 -1.1172 C.3 1 UNL111111111 -0.1104 16 C -1.3907 1.7985 -0.1631 C.ar 1 UNL111111111 -0.1884 17 C -3.7235 2.1542 -0.8395 C.ar 1 UNL111111111 -0.2111 18 C -2.3890 2.6124 -0.6461 C.ar 1 UNL111111111 -0.1092 19 C 4.2966 1.8291 0.7242 C.3 1 UNL111111111 -0.2598 20 C 3.9240 -2.1008 -0.5521 C.3 1 UNL111111111 -0.2612 21 C 4.5714 3.3289 0.7871 C.3 1 UNL111111111 -0.4436 22 C 4.8500 -2.9190 -1.4476 C.3 1 UNL111111111 -0.4433 23 H -5.1085 -2.1386 -0.8374 H 1 UNL111111111 0.1537 24 H -5.5031 -1.6393 0.8147 H 1 UNL111111111 0.1553 25 H -6.0781 0.5068 0.0266 H 1 UNL111111111 0.1554 26 H -5.6772 0.0100 -1.6240 H 1 UNL111111111 0.1542 27 H 0.7927 0.8047 1.3789 H 1 UNL111111111 0.1323 28 H 0.9574 0.5043 -1.2112 H 1 UNL111111111 0.1330 29 H 1.3122 -1.2157 -0.9431 H 1 UNL111111111 0.1572 30 H -2.8522 -3.2342 0.9840 H 1 UNL111111111 0.1567 31 H -0.5016 -2.5603 1.3343 H 1 UNL111111111 0.1769 32 H 2.2335 2.0976 0.0925 H 1 UNL111111111 0.1377 33 H 3.3732 1.9101 -1.2618 H 1 UNL111111111 0.1151 34 H 4.7462 -0.1776 -1.1530 H 1 UNL111111111 0.1352 35 H 3.3845 -0.7147 -2.1630 H 1 UNL111111111 0.1181 36 H -0.3856 2.1856 -0.0200 H 1 UNL111111111 0.1517 37 H -4.4720 2.8375 -1.2242 H 1 UNL111111111 0.1536 38 H -2.1698 3.6510 -0.8933 H 1 UNL111111111 0.1469 39 H 5.2047 1.2815 0.4131 H 1 UNL111111111 0.1366 40 H 4.0462 1.4353 1.7289 H 1 UNL111111111 0.1516 41 H 2.9398 -2.5970 -0.4550 H 1 UNL111111111 0.1471 42 H 4.3283 -2.0443 0.4768 H 1 UNL111111111 0.1450 43 H 2.2319 -1.1116 1.6323 H 1 UNL111111111 0.3414 44 H 4.8518 3.7306 -0.1927 H 1 UNL111111111 0.1402 45 H 3.6944 3.8858 1.1364 H 1 UNL111111111 0.1443 46 H 5.3935 3.5506 1.4776 H 1 UNL111111111 0.1438 47 H 4.4475 -3.0184 -2.4619 H 1 UNL111111111 0.1424 48 H 5.8426 -2.4617 -1.5277 H 1 UNL111111111 0.1424 49 H 4.9888 -3.9316 -1.0508 H 1 UNL111111111 0.1455 @BOND 1 1 10 1 2 1 43 1 3 2 11 1 4 2 14 1 5 2 15 1 6 3 4 ar 7 3 6 ar 8 3 7 ar 9 4 5 1 10 4 12 ar 11 5 8 1 12 5 23 1 13 5 24 1 14 6 8 1 15 6 17 ar 16 7 9 ar 17 7 16 ar 18 8 25 1 19 8 26 1 20 9 10 1 21 9 13 ar 22 10 11 1 23 10 27 1 24 11 28 1 25 11 29 1 26 12 13 ar 27 12 30 1 28 13 31 1 29 14 19 1 30 14 32 1 31 14 33 1 32 15 20 1 33 15 34 1 34 15 35 1 35 16 18 ar 36 16 36 1 37 17 18 ar 38 17 37 1 39 18 38 1 40 19 21 1 41 19 39 1 42 19 40 1 43 20 22 1 44 20 41 1 45 20 42 1 46 21 44 1 47 21 45 1 48 21 46 1 49 22 47 1 50 22 48 1 51 22 49 1