REMARK [C@1H2]-1([C@2H2][C]([CH]=[C@1]-2([C@2H2][C@2H2][C@2H]-3([C@2H]-4([C@2]([C@2H2][C@2H2][C@1H]-3[C@2]-1-2[CH3])([CH3])[C@2H]([O ATOM 1 C 1 2.521 -1.357 -0.154 ATOM 2 C 1 3.937 -1.470 0.442 ATOM 3 C 1 4.523 -0.111 0.744 ATOM 4 C 1 3.576 0.989 1.033 ATOM 5 C 1 2.242 0.860 1.044 ATOM 6 C 1 1.267 1.895 1.550 ATOM 7 C 1 0.005 1.993 0.673 ATOM 8 C 1 -0.641 0.611 0.464 ATOM 9 C 1 -1.917 0.707 -0.393 ATOM 10 C 1 -2.559 -0.677 -0.603 ATOM 11 C 1 -1.554 -1.679 -1.201 ATOM 12 C 1 -0.278 -1.775 -0.344 ATOM 13 C 1 0.364 -0.391 -0.133 ATOM 14 C 1 1.626 -0.486 0.746 ATOM 15 C 1 1.306 -1.214 2.048 ATOM 16 C 1 -2.876 -1.316 0.745 ATOM 17 C 1 -3.934 -0.384 -1.233 ATOM 18 O 1 -4.863 -1.430 -0.937 ATOM 19 C 1 -4.374 0.941 -0.585 ATOM 20 C 1 -3.103 1.630 -0.055 ATOM 21 O 1 5.739 0.073 0.750 ATOM 22 H 1 -5.045 0.733 0.247 ATOM 23 H 1 -4.841 1.575 -1.336 ATOM 24 H 1 -3.175 1.744 1.025 ATOM 25 H 1 -2.971 2.585 -0.559 ATOM 26 H 1 0.268 2.421 -0.293 ATOM 27 H 1 -0.713 2.661 1.145 ATOM 28 H 1 0.979 1.652 2.571 ATOM 29 H 1 1.757 2.866 1.587 ATOM 30 H 1 -0.523 -2.212 0.622 ATOM 31 H 1 0.436 -2.436 -0.832 ATOM 32 H 1 -1.291 -1.369 -2.210 ATOM 33 H 1 -2.019 -2.660 -1.269 ATOM 34 H 1 3.898 -2.059 1.356 ATOM 35 H 1 4.582 -1.996 -0.258 ATOM 36 H 1 2.580 -0.913 -1.146 ATOM 37 H 1 2.086 -2.350 -0.245 ATOM 38 H 1 3.989 1.963 1.250 ATOM 39 H 1 -3.852 -0.280 -2.313 ATOM 40 H 1 -1.579 1.021 -1.378 ATOM 41 H 1 0.669 -0.012 -1.107 ATOM 42 H 1 -0.936 0.236 1.442 ATOM 43 H 1 0.862 -2.182 1.823 ATOM 44 H 1 0.605 -0.621 2.633 ATOM 45 H 1 2.222 -1.359 2.617 ATOM 46 H 1 -3.329 -2.293 0.586 ATOM 47 H 1 -3.568 -0.681 1.294 ATOM 48 H 1 -1.958 -1.431 1.317 ATOM 49 H 1 -5.209 -1.809 -1.760 TER CONECT 1 2 14 36 37 CONECT 2 1 3 34 35 CONECT 3 2 4 21 0 CONECT 4 3 5 38 0 CONECT 5 4 6 14 0 CONECT 6 5 7 28 29 CONECT 7 6 8 26 27 CONECT 8 7 9 13 42 CONECT 9 8 10 20 40 CONECT 10 9 11 16 17 CONECT 11 10 12 32 33 CONECT 12 11 13 30 31 CONECT 13 8 12 14 41 CONECT 14 1 5 13 15 CONECT 15 14 43 44 45 CONECT 16 10 46 47 48 CONECT 17 10 18 19 39 CONECT 18 17 49 0 0 CONECT 19 17 20 22 23 CONECT 20 9 19 24 25 CONECT 21 3 0 0 0