HEADER PROTEIN 30-MAR-20 NONE TITLE NULL COMPND MOLECULE: PE-NMe(18:1(9Z)/18:2(9Z,12Z)) 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 50.281 21.390 0.000 0.00 0.00 C+0 HETATM 17 O UNK 0 50.281 22.830 0.000 0.00 0.00 O+0 HETATM 18 C UNK 0 48.948 20.619 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 47.614 21.390 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 46.281 20.619 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 44.948 21.390 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 43.615 20.619 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 42.282 21.390 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 40.949 20.619 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 39.616 21.390 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 38.076 21.390 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 36.743 20.619 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 35.410 21.390 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 34.077 20.619 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 32.744 21.390 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 31.411 20.619 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 30.078 21.390 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 28.745 20.619 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 27.412 21.390 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 53.731 16.940 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 53.731 15.500 0.000 0.00 0.00 O+0 HETATM 37 C UNK 0 52.398 17.711 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 51.065 16.940 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 49.732 17.711 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 48.399 16.940 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 47.066 17.711 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 45.733 16.940 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 44.400 17.711 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 43.067 16.940 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 41.527 16.940 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 40.194 17.711 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 38.861 16.940 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 37.321 16.940 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 35.988 17.711 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 34.655 16.940 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 33.322 17.711 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 31.989 16.940 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 30.656 17.711 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 3 5 15 CONECT 3 2 4 CONECT 4 3 16 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 CONECT 14 13 CONECT 15 2 35 CONECT 16 4 17 18 CONECT 17 16 CONECT 18 16 19 CONECT 19 18 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 CONECT 35 15 36 37 CONECT 36 35 CONECT 37 35 38 CONECT 38 37 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 MASTER 0 0 0 0 0 0 0 0 53 0 104 0 END