@MOLECULE (3as,3br,9bs,11as)-2-chloro-7-methoxy-11a-methyl-2,3,3a,3b,4,5,9b,10,11,11a-decahydro-1h-naphtho[2,1-e]isoindol-1-one 44 47 0 0 0 SMALL GASTEIGER @ATOM 1 CL -4.7409 -0.6930 -0.2248 Cl 1 UNL1111111111 0.0484 2 O -3.5418 2.0089 -0.1975 O.2 1 UNL1111111111 -0.4104 3 O 5.3508 -0.0844 0.8481 O.3 1 UNL1111111111 -0.3162 4 N -3.5229 -0.0678 0.8431 N.am 1 UNL1111111111 -0.4351 5 C -1.1193 -0.4590 0.6471 C.3 1 UNL1111111111 -0.1528 6 C -0.7385 -1.1044 -0.6978 C.3 1 UNL1111111111 -0.1204 7 C -1.4061 1.0677 0.6038 C.3 1 UNL1111111111 -0.0178 8 C 0.2331 -0.2397 -1.5268 C.3 1 UNL1111111111 -0.1034 9 C -0.6162 1.8661 -0.4302 C.3 1 UNL1111111111 -0.2743 10 C -0.4428 1.1223 -1.7519 C.3 1 UNL1111111111 -0.2806 11 C -2.4709 -1.0612 1.1388 C.3 1 UNL1111111111 -0.1431 12 C -0.0939 -2.4854 -0.4961 C.3 1 UNL1111111111 -0.2787 13 C -2.9134 1.1269 0.3135 C.2 1 UNL1111111111 0.5260 14 C 1.5977 -0.1646 -0.8990 C.ar 1 UNL1111111111 -0.0851 15 C -1.1791 1.6834 1.9919 C.3 1 UNL1111111111 -0.4562 16 C 1.2290 -2.3985 0.2730 C.3 1 UNL1111111111 -0.2801 17 C 2.0573 -1.1952 -0.0643 C.ar 1 UNL1111111111 0.0674 18 C 2.4444 0.9079 -1.1826 C.ar 1 UNL1111111111 -0.0963 19 C 3.3286 -1.1237 0.4994 C.ar 1 UNL1111111111 -0.2975 20 C 3.7194 0.9981 -0.6288 C.ar 1 UNL1111111111 -0.3106 21 C 4.1463 -0.0228 0.2179 C.ar 1 UNL1111111111 0.2537 22 C 6.2625 0.9793 0.6059 C.3 1 UNL1111111111 -0.2024 23 H -0.3089 -0.6548 1.3831 H 1 UNL1111111111 0.1654 24 H -1.6702 -1.2354 -1.3050 H 1 UNL1111111111 0.1396 25 H 0.3656 -0.7324 -2.5290 H 1 UNL1111111111 0.1477 26 H 0.3855 2.1132 -0.0168 H 1 UNL1111111111 0.1588 27 H -1.1205 2.8400 -0.6071 H 1 UNL1111111111 0.1601 28 H -1.4274 0.9726 -2.2382 H 1 UNL1111111111 0.1472 29 H 0.1401 1.7368 -2.4626 H 1 UNL1111111111 0.1433 30 H -2.6666 -2.0592 0.7048 H 1 UNL1111111111 0.1580 31 H -2.4669 -1.1975 2.2444 H 1 UNL1111111111 0.1642 32 H 0.0842 -2.9466 -1.4888 H 1 UNL1111111111 0.1456 33 H -0.7879 -3.1686 0.0270 H 1 UNL1111111111 0.1361 34 H -1.4728 2.7412 2.0143 H 1 UNL1111111111 0.1629 35 H -1.7564 1.1694 2.7679 H 1 UNL1111111111 0.1579 36 H -0.1193 1.6296 2.2762 H 1 UNL1111111111 0.1602 37 H 1.8220 -3.3207 0.0860 H 1 UNL1111111111 0.1556 38 H 1.0295 -2.4010 1.3670 H 1 UNL1111111111 0.1531 39 H 2.1115 1.6996 -1.8545 H 1 UNL1111111111 0.1536 40 H 3.6993 -1.9075 1.1560 H 1 UNL1111111111 0.1734 41 H 4.3519 1.8461 -0.8620 H 1 UNL1111111111 0.1631 42 H 6.5379 1.0244 -0.4521 H 1 UNL1111111111 0.1343 43 H 7.1283 0.6843 1.2172 H 1 UNL1111111111 0.1521 44 H 5.8538 1.9307 0.9549 H 1 UNL1111111111 0.1334 @BOND 1 1 4 1 2 2 13 2 3 3 21 1 4 3 22 1 5 4 11 1 6 4 13 am 7 5 6 1 8 5 7 1 9 5 11 1 10 5 23 1 11 6 8 1 12 6 12 1 13 6 24 1 14 7 9 1 15 7 13 1 16 7 15 1 17 8 10 1 18 8 14 1 19 8 25 1 20 9 10 1 21 9 26 1 22 9 27 1 23 10 28 1 24 10 29 1 25 11 30 1 26 11 31 1 27 12 16 1 28 12 32 1 29 12 33 1 30 14 17 ar 31 14 18 ar 32 15 34 1 33 15 35 1 34 15 36 1 35 16 17 1 36 16 37 1 37 16 38 1 38 17 19 ar 39 18 20 ar 40 18 39 1 41 19 21 ar 42 19 40 1 43 20 21 ar 44 20 41 1 45 22 42 1 46 22 43 1 47 22 44 1