@MOLECULE (3alpha,8alpha,9s)-6'-methoxy-10,11-dihydrocinchonan-9-ol 50 53 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.4735 -2.1999 2.0453 O.3 1 UNL1111111111 -0.5568 2 O 2.9845 2.8504 0.5850 O.3 1 UNL1111111111 -0.3074 3 N -2.6025 -0.6145 1.0999 N.3 1 UNL1111111111 -0.4168 4 N 3.2121 -2.3682 -1.1651 N.ar 1 UNL1111111111 -0.3603 5 C -2.3930 1.2329 -0.6963 C.3 1 UNL1111111111 -0.0892 6 C -3.6592 0.3786 -0.9559 C.3 1 UNL1111111111 -0.1553 7 C -1.3964 -0.8558 0.2548 C.3 1 UNL1111111111 -0.0138 8 C -1.1654 0.3002 -0.7456 C.3 1 UNL1111111111 -0.3314 9 C -3.7957 -0.6400 0.2123 C.3 1 UNL1111111111 -0.1266 10 C -2.4514 1.8628 0.7078 C.3 1 UNL1111111111 -0.3186 11 C -2.5334 0.7208 1.7490 C.3 1 UNL1111111111 -0.1146 12 C -4.9110 1.2530 -1.0991 C.3 1 UNL1111111111 -0.2700 13 C -0.1818 -1.1069 1.1911 C.3 1 UNL1111111111 0.1247 14 C 1.0225 -1.5259 0.3905 C.ar 1 UNL1111111111 -0.0061 15 C -6.0954 0.4466 -1.6316 C.3 1 UNL1111111111 -0.4390 16 C 2.0532 -0.5912 0.0642 C.ar 1 UNL1111111111 -0.0176 17 C 1.1313 -2.8254 -0.0337 C.ar 1 UNL1111111111 -0.1958 18 C 3.1276 -1.0639 -0.7363 C.ar 1 UNL1111111111 0.0867 19 C 2.0674 0.7546 0.4930 C.ar 1 UNL1111111111 -0.2837 20 C 2.2595 -3.2110 -0.8169 C.ar 1 UNL1111111111 0.0422 21 C 4.1784 -0.1791 -1.1206 C.ar 1 UNL1111111111 -0.0743 22 C 3.1031 1.5832 0.1055 C.ar 1 UNL1111111111 0.2520 23 C 4.1684 1.1273 -0.7117 C.ar 1 UNL1111111111 -0.2665 24 C 4.0181 3.7710 0.2672 C.3 1 UNL1111111111 -0.2036 25 H -2.3022 2.0241 -1.4684 H 1 UNL1111111111 0.1343 26 H -3.5105 -0.1824 -1.9076 H 1 UNL1111111111 0.1396 27 H -1.5810 -1.8076 -0.3106 H 1 UNL1111111111 0.1506 28 H -1.0118 -0.0938 -1.7639 H 1 UNL1111111111 0.1461 29 H -0.2487 0.8687 -0.5109 H 1 UNL1111111111 0.1571 30 H -4.6929 -0.4291 0.8281 H 1 UNL1111111111 0.1424 31 H -3.9214 -1.6703 -0.1760 H 1 UNL1111111111 0.1372 32 H -3.3178 2.5373 0.7956 H 1 UNL1111111111 0.1366 33 H -1.5605 2.4893 0.8833 H 1 UNL1111111111 0.1445 34 H -1.6600 0.7411 2.4317 H 1 UNL1111111111 0.1414 35 H -3.4302 0.8344 2.3917 H 1 UNL1111111111 0.1353 36 H -4.7004 2.0989 -1.7821 H 1 UNL1111111111 0.1380 37 H -5.1727 1.7134 -0.1276 H 1 UNL1111111111 0.1381 38 H 0.0295 -0.2358 1.8518 H 1 UNL1111111111 0.1386 39 H -5.8854 0.0332 -2.6248 H 1 UNL1111111111 0.1448 40 H -6.3420 -0.3923 -0.9715 H 1 UNL1111111111 0.1431 41 H -6.9920 1.0709 -1.7184 H 1 UNL1111111111 0.1438 42 H -1.4212 -2.1549 2.3185 H 1 UNL1111111111 0.3431 43 H 0.3774 -3.5677 0.2291 H 1 UNL1111111111 0.1830 44 H 1.2802 1.1417 1.1369 H 1 UNL1111111111 0.1774 45 H 2.3646 -4.2459 -1.1630 H 1 UNL1111111111 0.1682 46 H 4.9820 -0.5794 -1.7433 H 1 UNL1111111111 0.1730 47 H 4.9660 1.8040 -1.0042 H 1 UNL1111111111 0.1646 48 H 4.9793 3.4397 0.6720 H 1 UNL1111111111 0.1354 49 H 3.6810 4.6808 0.7831 H 1 UNL1111111111 0.1515 50 H 4.0716 3.9436 -0.8119 H 1 UNL1111111111 0.1337 @BOND 1 1 13 1 2 1 42 1 3 2 22 1 4 2 24 1 5 3 7 1 6 3 9 1 7 3 11 1 8 4 18 ar 9 4 20 ar 10 5 6 1 11 5 8 1 12 5 10 1 13 5 25 1 14 6 9 1 15 6 12 1 16 6 26 1 17 7 8 1 18 7 13 1 19 7 27 1 20 8 28 1 21 8 29 1 22 9 30 1 23 9 31 1 24 10 11 1 25 10 32 1 26 10 33 1 27 11 34 1 28 11 35 1 29 12 15 1 30 12 36 1 31 12 37 1 32 13 14 1 33 13 38 1 34 14 16 ar 35 14 17 ar 36 15 39 1 37 15 40 1 38 15 41 1 39 16 18 ar 40 16 19 ar 41 17 20 ar 42 17 43 1 43 18 21 ar 44 19 22 ar 45 19 44 1 46 20 45 1 47 21 23 ar 48 21 46 1 49 22 23 ar 50 23 47 1 51 24 48 1 52 24 49 1 53 24 50 1