COMPND HMDB0038358 HETATM 1 O1 UNL 1 -5.915 3.451 -4.430 1.00 0.00 O HETATM 2 C1 UNL 1 -5.403 3.029 -3.228 1.00 0.00 C HETATM 3 C2 UNL 1 -5.851 1.847 -2.696 1.00 0.00 C HETATM 4 C3 UNL 1 -5.379 1.357 -1.486 1.00 0.00 C HETATM 5 O2 UNL 1 -5.884 0.158 -1.018 1.00 0.00 O HETATM 6 C4 UNL 1 -4.442 2.042 -0.773 1.00 0.00 C HETATM 7 C5 UNL 1 -3.882 1.585 0.505 1.00 0.00 C HETATM 8 C6 UNL 1 -2.844 0.497 0.213 1.00 0.00 C HETATM 9 O3 UNL 1 -1.868 1.163 -0.614 1.00 0.00 O HETATM 10 C7 UNL 1 -0.607 0.721 -0.263 1.00 0.00 C HETATM 11 C8 UNL 1 0.596 0.831 -0.939 1.00 0.00 C HETATM 12 C9 UNL 1 1.773 0.327 -0.437 1.00 0.00 C HETATM 13 C10 UNL 1 1.704 -0.309 0.799 1.00 0.00 C HETATM 14 C11 UNL 1 0.503 -0.418 1.473 1.00 0.00 C HETATM 15 O4 UNL 1 0.432 -1.040 2.685 1.00 0.00 O HETATM 16 C12 UNL 1 -0.687 0.095 0.960 1.00 0.00 C HETATM 17 C13 UNL 1 -2.097 0.127 1.447 1.00 0.00 C HETATM 18 C14 UNL 1 -2.507 -1.092 2.129 1.00 0.00 C HETATM 19 C15 UNL 1 -2.359 -1.164 3.500 1.00 0.00 C HETATM 20 C16 UNL 1 -2.743 -2.313 4.144 1.00 0.00 C HETATM 21 C17 UNL 1 -3.278 -3.404 3.451 1.00 0.00 C HETATM 22 O5 UNL 1 -3.641 -4.524 4.164 1.00 0.00 O HETATM 23 C18 UNL 1 -3.434 -3.352 2.083 1.00 0.00 C HETATM 24 O6 UNL 1 -3.957 -4.400 1.340 1.00 0.00 O HETATM 25 C19 UNL 1 -3.034 -2.167 1.449 1.00 0.00 C HETATM 26 C20 UNL 1 2.990 -0.841 1.314 1.00 0.00 C HETATM 27 C21 UNL 1 4.141 0.099 1.054 1.00 0.00 C HETATM 28 O7 UNL 1 5.320 -0.634 1.313 1.00 0.00 O HETATM 29 C22 UNL 1 4.203 0.642 -0.327 1.00 0.00 C HETATM 30 C23 UNL 1 5.395 0.230 -1.086 1.00 0.00 C HETATM 31 C24 UNL 1 6.516 1.052 -1.150 1.00 0.00 C HETATM 32 C25 UNL 1 7.650 0.738 -1.829 1.00 0.00 C HETATM 33 C26 UNL 1 7.733 -0.451 -2.504 1.00 0.00 C HETATM 34 O8 UNL 1 8.885 -0.766 -3.191 1.00 0.00 O HETATM 35 C27 UNL 1 6.640 -1.307 -2.470 1.00 0.00 C HETATM 36 O9 UNL 1 6.756 -2.502 -3.163 1.00 0.00 O HETATM 37 C28 UNL 1 5.499 -0.967 -1.774 1.00 0.00 C HETATM 38 O10 UNL 1 2.993 0.407 -1.064 1.00 0.00 O HETATM 39 C29 UNL 1 -3.990 3.238 -1.312 1.00 0.00 C HETATM 40 O11 UNL 1 -3.038 3.974 -0.627 1.00 0.00 O HETATM 41 C30 UNL 1 -4.452 3.731 -2.510 1.00 0.00 C HETATM 42 H1 UNL 1 -6.735 4.033 -4.427 1.00 0.00 H HETATM 43 H2 UNL 1 -6.590 1.268 -3.219 1.00 0.00 H HETATM 44 H3 UNL 1 -5.568 -0.209 -0.148 1.00 0.00 H HETATM 45 H4 UNL 1 -3.328 2.421 0.972 1.00 0.00 H HETATM 46 H5 UNL 1 -4.650 1.209 1.210 1.00 0.00 H HETATM 47 H6 UNL 1 -3.216 -0.311 -0.406 1.00 0.00 H HETATM 48 H7 UNL 1 0.656 1.330 -1.914 1.00 0.00 H HETATM 49 H8 UNL 1 1.187 -1.465 3.195 1.00 0.00 H HETATM 50 H9 UNL 1 -2.239 0.985 2.172 1.00 0.00 H HETATM 51 H10 UNL 1 -1.940 -0.318 4.075 1.00 0.00 H HETATM 52 H11 UNL 1 -2.624 -2.366 5.231 1.00 0.00 H HETATM 53 H12 UNL 1 -4.031 -5.343 3.735 1.00 0.00 H HETATM 54 H13 UNL 1 -4.255 -5.262 1.756 1.00 0.00 H HETATM 55 H14 UNL 1 -3.175 -2.175 0.376 1.00 0.00 H HETATM 56 H15 UNL 1 3.175 -1.795 0.738 1.00 0.00 H HETATM 57 H16 UNL 1 2.972 -1.053 2.384 1.00 0.00 H HETATM 58 H17 UNL 1 4.107 0.877 1.852 1.00 0.00 H HETATM 59 H18 UNL 1 5.124 -1.347 1.941 1.00 0.00 H HETATM 60 H19 UNL 1 4.246 1.768 -0.236 1.00 0.00 H HETATM 61 H20 UNL 1 6.453 2.001 -0.614 1.00 0.00 H HETATM 62 H21 UNL 1 8.475 1.460 -1.814 1.00 0.00 H HETATM 63 H22 UNL 1 9.649 -0.117 -3.187 1.00 0.00 H HETATM 64 H23 UNL 1 5.981 -3.140 -3.155 1.00 0.00 H HETATM 65 H24 UNL 1 4.661 -1.640 -1.757 1.00 0.00 H HETATM 66 H25 UNL 1 -2.677 4.850 -0.976 1.00 0.00 H HETATM 67 H26 UNL 1 -4.097 4.655 -2.918 1.00 0.00 H CONECT 1 2 42 CONECT 2 3 3 41 CONECT 3 4 43 CONECT 4 5 6 6 CONECT 5 44 CONECT 6 7 39 CONECT 7 8 45 46 CONECT 8 9 17 47 CONECT 9 10 CONECT 10 11 11 16 CONECT 11 12 48 CONECT 12 13 13 38 CONECT 13 14 26 CONECT 14 15 16 16 CONECT 15 49 CONECT 16 17 CONECT 17 18 50 CONECT 18 19 19 25 CONECT 19 20 51 CONECT 20 21 21 52 CONECT 21 22 23 CONECT 22 53 CONECT 23 24 25 25 CONECT 24 54 CONECT 25 55 CONECT 26 27 56 57 CONECT 27 28 29 58 CONECT 28 59 CONECT 29 30 38 60 CONECT 30 31 31 37 CONECT 31 32 61 CONECT 32 33 33 62 CONECT 33 34 35 CONECT 34 63 CONECT 35 36 37 37 CONECT 36 64 CONECT 37 65 CONECT 39 40 41 41 CONECT 40 66 CONECT 41 67 END