HEADER PROTEIN 30-MAR-20 NONE TITLE NULL COMPND MOLECULE: PE-NMe2(18:3(9Z,12Z,15Z)/22:1(13Z)) SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 30-MAR-20 0 HETATM 1 H UNK 0 54.876 22.296 0.000 0.00 0.00 H+0 HETATM 2 C UNK 0 54.883 20.352 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 52.947 21.185 0.000 0.00 0.00 C+0 HETATM 4 O UNK 0 51.550 20.518 0.000 0.00 0.00 O+0 HETATM 5 C UNK 0 56.368 21.019 0.000 0.00 0.00 C+0 HETATM 6 O UNK 0 57.971 20.241 0.000 0.00 0.00 O+0 HETATM 7 P UNK 0 59.844 20.241 0.000 0.00 0.00 P+0 HETATM 8 O UNK 0 59.844 21.781 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 59.900 18.701 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 61.384 20.186 0.000 0.00 0.00 O+0 HETATM 11 C UNK 0 62.877 20.908 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 64.306 20.186 0.000 0.00 0.00 C+0 HETATM 13 N UNK 0 65.710 21.112 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 67.193 20.144 0.000 0.00 0.00 C+0 HETATM 15 O UNK 0 54.876 17.971 0.000 0.00 0.00 O+0 HETATM 16 C UNK 0 65.706 22.652 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 50.281 21.390 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 50.281 22.830 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 48.948 20.619 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 47.614 21.390 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 46.281 20.619 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 44.948 21.390 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 43.615 20.619 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 42.282 21.390 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 40.949 20.619 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 39.616 21.390 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 38.076 21.390 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 36.743 20.619 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 35.410 21.390 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 33.870 21.390 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 32.537 20.619 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 31.204 21.390 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 29.664 21.390 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 28.331 20.619 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 26.998 21.390 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 53.354 17.730 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 53.354 16.290 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 52.021 18.501 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 50.688 17.730 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 49.355 18.501 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 48.022 17.730 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 46.689 18.501 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 45.356 17.730 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 44.023 18.501 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 42.690 17.730 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 41.357 18.501 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 40.024 17.730 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 38.691 18.501 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 37.358 17.730 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 35.818 17.730 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 34.485 18.501 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 33.152 17.730 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 31.819 18.501 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 30.486 17.730 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 29.153 18.501 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 27.820 17.730 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 26.487 18.501 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 25.154 17.730 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 3 5 15 CONECT 3 2 4 CONECT 4 3 17 CONECT 5 2 6 CONECT 6 5 7 CONECT 7 6 8 9 10 CONECT 8 7 CONECT 9 7 CONECT 10 7 11 CONECT 11 10 12 CONECT 12 11 13 CONECT 13 12 14 16 CONECT 14 13 CONECT 15 2 36 CONECT 16 13 CONECT 17 4 18 19 CONECT 18 17 CONECT 19 17 20 CONECT 20 19 21 CONECT 21 20 22 CONECT 22 21 23 CONECT 23 22 24 CONECT 24 23 25 CONECT 25 24 26 CONECT 26 25 27 CONECT 27 26 28 CONECT 28 27 29 CONECT 29 28 30 CONECT 30 29 31 CONECT 31 30 32 CONECT 32 31 33 CONECT 33 32 34 CONECT 34 33 35 CONECT 35 34 CONECT 36 15 37 38 CONECT 37 36 CONECT 38 36 39 CONECT 39 38 40 CONECT 40 39 41 CONECT 41 40 42 CONECT 42 41 43 CONECT 43 42 44 CONECT 44 43 45 CONECT 45 44 46 CONECT 46 45 47 CONECT 47 46 48 CONECT 48 47 49 CONECT 49 48 50 CONECT 50 49 51 CONECT 51 50 52 CONECT 52 51 53 CONECT 53 52 54 CONECT 54 53 55 CONECT 55 54 56 CONECT 56 55 57 CONECT 57 56 58 CONECT 58 57 MASTER 0 0 0 0 0 0 0 0 58 0 114 0 END