1 50 Retinoic Acid 2 1 C -0.640867 1.281437 -0.307535 2 2 6 43 3 2 C -1.484311 2.535220 -0.498488 1 1 3 4 5 4 3 H -2.210494 2.400381 -1.330202 5 2 5 4 H -2.067392 2.764216 0.420894 5 2 6 5 H -0.886195 3.436285 -0.750255 5 2 7 6 C 0.709549 1.308556 -0.176212 2 1 7 32 8 7 C 1.379871 2.631512 -0.001477 2 6 8 9 9 8 H 0.894681 3.353401 0.674964 5 7 10 9 C 2.514062 2.990305 -0.638090 2 7 10 11 11 10 H 2.975943 2.256765 -1.317593 5 9 12 11 C 3.192882 4.291985 -0.475728 2 9 12 16 13 12 C 2.489646 5.452306 0.219885 1 11 13 14 15 14 13 H 2.804896 5.529244 1.284137 5 12 15 14 H 2.703648 6.425387 -0.272332 5 12 16 15 H 1.384106 5.349594 0.202318 5 12 17 16 C 4.443786 4.440097 -0.990828 2 11 17 18 18 17 H 4.891498 3.576430 -1.513282 5 16 19 18 C 5.259000 5.653075 -0.877072 2 16 19 20 20 19 H 4.865227 6.506059 -0.305410 5 18 21 20 C 6.493860 5.737885 -1.428151 2 18 21 22 22 21 H 6.876307 4.846318 -1.955915 5 20 23 22 C 7.379254 6.916243 -1.340611 2 20 23 27 24 23 C 6.831410 8.262356 -0.882422 1 22 24 25 26 25 24 H 7.159510 8.498232 0.154202 5 23 26 25 H 7.162430 9.086775 -1.550371 5 23 27 26 H 5.722395 8.301914 -0.895620 5 23 28 27 C 8.676825 6.768451 -1.709060 2 22 28 29 29 28 H 9.019733 5.781063 -2.063481 5 27 30 29 C 9.734525 7.810044 -1.671731 3 27 30 31 31 30 O 9.533930 9.035181 -1.136487 6 29 50 32 31 O 10.858137 7.544226 -2.137447 7 29 33 32 C 1.508048 0.008778 0.068376 1 6 33 37 41 34 33 C 2.640700 0.216474 1.101152 1 32 34 35 36 35 34 H 3.157138 -0.740344 1.337822 5 33 36 35 H 3.426054 0.915437 0.741794 5 33 37 36 H 2.252796 0.623282 2.061718 5 33 38 37 C 2.135433 -0.491908 -1.253079 1 32 38 39 40 39 38 H 2.593487 -1.498876 -1.134638 5 37 40 39 H 1.389419 -0.563722 -2.073955 5 37 41 40 H 2.942201 0.178436 -1.617309 5 37 42 41 C 0.581261 -1.089225 0.643816 1 32 42 48 49 43 42 C -0.666718 -1.272291 -0.219921 1 41 43 46 47 44 43 C -1.487000 0.020063 -0.212503 1 1 42 44 45 45 44 H -2.217351 -0.008033 -1.053071 5 43 46 45 H -2.083262 0.072507 0.727566 5 43 47 46 H -1.284753 -2.116027 0.164989 5 42 48 47 H -0.382111 -1.541609 -1.261134 5 42 49 48 H 0.270761 -0.819517 1.679688 5 41 50 49 H 1.130762 -2.055300 0.720076 5 41 51 50 H 10.366510 9.530054 -1.216554 24 30 52