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|
global_
_lib_name ?
_lib_version ?
_lib_update ?
# ------------------------------------------------
#
# --- LIST OF MONOMERS ---
#
data_comp_list
loop_
_chem_comp.id
_chem_comp.three_letter_code
_chem_comp.name
_chem_comp.group
_chem_comp.number_atoms_all
_chem_comp.number_atoms_nh
_chem_comp.desc_level
PC8 PC8 '1,2-DIOCTANOYL-SN-GLYCERO-3-PHOSPHOC' non-polymer 82 34 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_PC8
#
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.partial_charge
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
PC8 O8 O O -0.500 0.000 0.000 0.000
PC8 C17 C C 0.000 -0.989 -0.621 -0.447
PC8 C18 C CH2 0.000 -0.980 -1.132 -1.865
PC8 H34 H H 0.000 -1.808 -0.683 -2.419
PC8 H35 H H 0.000 -1.094 -2.218 -1.861
PC8 C19 C CH2 0.000 0.345 -0.759 -2.533
PC8 H36 H H 0.000 1.171 -1.209 -1.978
PC8 H37 H H 0.000 0.458 0.327 -2.534
PC8 C20 C CH2 0.000 0.354 -1.276 -3.973
PC8 H38 H H 0.000 -0.473 -0.826 -4.525
PC8 H39 H H 0.000 0.240 -2.362 -3.969
PC8 C21 C CH2 0.000 1.679 -0.903 -4.641
PC8 H40 H H 0.000 2.505 -1.352 -4.087
PC8 H41 H H 0.000 1.792 0.183 -4.643
PC8 C22 C CH2 0.000 1.687 -1.421 -6.081
PC8 H42 H H 0.000 0.860 -0.971 -6.634
PC8 H43 H H 0.000 1.573 -2.507 -6.077
PC8 C23 C CH2 0.000 3.013 -1.047 -6.748
PC8 H44 H H 0.000 3.839 -1.497 -6.193
PC8 H45 H H 0.000 3.125 0.039 -6.750
PC8 C24 C CH3 0.000 3.022 -1.565 -8.188
PC8 H48 H H 0.000 2.221 -1.130 -8.729
PC8 H47 H H 0.000 3.939 -1.308 -8.654
PC8 H46 H H 0.000 2.913 -2.620 -8.189
PC8 O7 O O2 -0.500 -1.986 -0.820 0.283
PC8 C7 C CH1 0.000 -2.067 -0.343 1.702
PC8 H16 H H 0.000 -1.052 -0.314 2.121
PC8 C6 C CH2 0.000 -2.647 1.072 1.731
PC8 H14 H H 0.000 -2.087 1.708 1.043
PC8 H15 H H 0.000 -2.571 1.475 2.743
PC8 O4 O O2 0.000 -4.020 1.033 1.335
PC8 P1 P P 0.000 -4.563 2.547 1.388
PC8 O2 O OP -0.500 -3.697 3.414 0.552
PC8 O3 O O2 0.000 -6.072 2.596 0.827
PC8 C1 C CH2 0.000 -6.453 3.972 0.788
PC8 H1 H H 0.000 -5.775 4.518 0.129
PC8 H2 H H 0.000 -6.399 4.393 1.794
PC8 C2 C CH2 0.000 -7.885 4.090 0.261
PC8 H3 H H 0.000 -7.965 3.569 -0.695
PC8 H4 H H 0.000 -8.135 5.144 0.122
PC8 N1 N NT 1.000 -8.814 3.489 1.227
PC8 C5 C CH3 0.000 -8.561 2.044 1.315
PC8 H13 H H 0.000 -9.343 1.582 1.859
PC8 H12 H H 0.000 -8.519 1.634 0.339
PC8 H11 H H 0.000 -7.640 1.876 1.808
PC8 C4 C CH3 0.000 -10.196 3.719 0.786
PC8 H10 H H 0.000 -10.378 4.760 0.723
PC8 H9 H H 0.000 -10.342 3.276 -0.165
PC8 H8 H H 0.000 -10.866 3.285 1.483
PC8 C3 C CH3 0.000 -8.613 4.102 2.547
PC8 H7 H H 0.000 -9.282 3.668 3.243
PC8 H6 H H 0.000 -7.616 3.936 2.865
PC8 H5 H H 0.000 -8.794 5.143 2.484
PC8 O1 O OP -0.500 -4.542 3.031 2.789
PC8 C8 C CH2 0.000 -2.927 -1.265 2.570
PC8 H17 H H 0.000 -2.831 -0.935 3.607
PC8 H18 H H 0.000 -2.534 -2.279 2.474
PC8 O5 O O2 -0.500 -4.372 -1.246 2.170
PC8 C9 C C 0.000 -5.247 -1.926 2.749
PC8 O6 O O -0.500 -4.934 -2.666 3.708
PC8 C10 C CH2 0.000 -6.682 -1.856 2.290
PC8 H19 H H 0.000 -6.745 -2.172 1.247
PC8 H20 H H 0.000 -7.042 -0.829 2.381
PC8 C11 C CH2 0.000 -7.541 -2.777 3.158
PC8 H21 H H 0.000 -7.474 -2.461 4.201
PC8 H22 H H 0.000 -7.179 -3.804 3.066
PC8 C12 C CH2 0.000 -8.996 -2.705 2.692
PC8 H23 H H 0.000 -9.061 -3.021 1.649
PC8 H24 H H 0.000 -9.356 -1.677 2.783
PC8 C13 C CH2 0.000 -9.855 -3.626 3.561
PC8 H25 H H 0.000 -9.790 -3.308 4.604
PC8 H26 H H 0.000 -9.493 -4.652 3.471
PC8 C14 C CH2 0.000 -11.311 -3.554 3.095
PC8 H27 H H 0.000 -11.375 -3.871 2.052
PC8 H28 H H 0.000 -11.672 -2.527 3.185
PC8 C15 C CH2 0.000 -12.171 -4.476 3.964
PC8 H29 H H 0.000 -12.105 -4.158 5.006
PC8 H30 H H 0.000 -11.809 -5.502 3.873
PC8 C16 C CH3 0.000 -13.627 -4.404 3.498
PC8 H33 H H 0.000 -13.693 -4.711 2.485
PC8 H32 H H 0.000 -14.225 -5.042 4.097
PC8 H31 H H 0.000 -13.981 -3.408 3.585
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
PC8 O8 n/a C17 START
PC8 C17 O8 O7 .
PC8 C18 C17 C19 .
PC8 H34 C18 . .
PC8 H35 C18 . .
PC8 C19 C18 C20 .
PC8 H36 C19 . .
PC8 H37 C19 . .
PC8 C20 C19 C21 .
PC8 H38 C20 . .
PC8 H39 C20 . .
PC8 C21 C20 C22 .
PC8 H40 C21 . .
PC8 H41 C21 . .
PC8 C22 C21 C23 .
PC8 H42 C22 . .
PC8 H43 C22 . .
PC8 C23 C22 C24 .
PC8 H44 C23 . .
PC8 H45 C23 . .
PC8 C24 C23 H46 .
PC8 H48 C24 . .
PC8 H47 C24 . .
PC8 H46 C24 . .
PC8 O7 C17 C7 .
PC8 C7 O7 C8 .
PC8 H16 C7 . .
PC8 C6 C7 O4 .
PC8 H14 C6 . .
PC8 H15 C6 . .
PC8 O4 C6 P1 .
PC8 P1 O4 O1 .
PC8 O2 P1 . .
PC8 O3 P1 C1 .
PC8 C1 O3 C2 .
PC8 H1 C1 . .
PC8 H2 C1 . .
PC8 C2 C1 N1 .
PC8 H3 C2 . .
PC8 H4 C2 . .
PC8 N1 C2 C3 .
PC8 C5 N1 H11 .
PC8 H13 C5 . .
PC8 H12 C5 . .
PC8 H11 C5 . .
PC8 C4 N1 H8 .
PC8 H10 C4 . .
PC8 H9 C4 . .
PC8 H8 C4 . .
PC8 C3 N1 H5 .
PC8 H7 C3 . .
PC8 H6 C3 . .
PC8 H5 C3 . .
PC8 O1 P1 . .
PC8 C8 C7 O5 .
PC8 H17 C8 . .
PC8 H18 C8 . .
PC8 O5 C8 C9 .
PC8 C9 O5 C10 .
PC8 O6 C9 . .
PC8 C10 C9 C11 .
PC8 H19 C10 . .
PC8 H20 C10 . .
PC8 C11 C10 C12 .
PC8 H21 C11 . .
PC8 H22 C11 . .
PC8 C12 C11 C13 .
PC8 H23 C12 . .
PC8 H24 C12 . .
PC8 C13 C12 C14 .
PC8 H25 C13 . .
PC8 H26 C13 . .
PC8 C14 C13 C15 .
PC8 H27 C14 . .
PC8 H28 C14 . .
PC8 C15 C14 C16 .
PC8 H29 C15 . .
PC8 H30 C15 . .
PC8 C16 C15 H31 .
PC8 H33 C16 . .
PC8 H32 C16 . .
PC8 H31 C16 . END
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
PC8 O1 P1 deloc 1.510 0.020
PC8 O2 P1 deloc 1.510 0.020
PC8 O3 P1 single 1.610 0.020
PC8 P1 O4 single 1.610 0.020
PC8 C1 O3 single 1.426 0.020
PC8 C2 C1 single 1.524 0.020
PC8 H1 C1 single 1.092 0.020
PC8 H2 C1 single 1.092 0.020
PC8 N1 C2 single 1.469 0.020
PC8 H3 C2 single 1.092 0.020
PC8 H4 C2 single 1.092 0.020
PC8 C3 N1 single 1.469 0.020
PC8 C4 N1 single 1.469 0.020
PC8 C5 N1 single 1.469 0.020
PC8 H5 C3 single 1.059 0.020
PC8 H6 C3 single 1.059 0.020
PC8 H7 C3 single 1.059 0.020
PC8 H8 C4 single 1.059 0.020
PC8 H9 C4 single 1.059 0.020
PC8 H10 C4 single 1.059 0.020
PC8 H11 C5 single 1.059 0.020
PC8 H12 C5 single 1.059 0.020
PC8 H13 C5 single 1.059 0.020
PC8 O4 C6 single 1.426 0.020
PC8 C6 C7 single 1.524 0.020
PC8 H14 C6 single 1.092 0.020
PC8 H15 C6 single 1.092 0.020
PC8 C8 C7 single 1.524 0.020
PC8 C7 O7 single 1.426 0.020
PC8 H16 C7 single 1.099 0.020
PC8 O5 C8 single 1.426 0.020
PC8 H17 C8 single 1.092 0.020
PC8 H18 C8 single 1.092 0.020
PC8 C9 O5 deloc 1.454 0.020
PC8 O6 C9 deloc 1.220 0.020
PC8 C10 C9 single 1.510 0.020
PC8 C11 C10 single 1.524 0.020
PC8 H19 C10 single 1.092 0.020
PC8 H20 C10 single 1.092 0.020
PC8 C12 C11 single 1.524 0.020
PC8 H21 C11 single 1.092 0.020
PC8 H22 C11 single 1.092 0.020
PC8 C13 C12 single 1.524 0.020
PC8 H23 C12 single 1.092 0.020
PC8 H24 C12 single 1.092 0.020
PC8 C14 C13 single 1.524 0.020
PC8 H25 C13 single 1.092 0.020
PC8 H26 C13 single 1.092 0.020
PC8 C15 C14 single 1.524 0.020
PC8 H27 C14 single 1.092 0.020
PC8 H28 C14 single 1.092 0.020
PC8 C16 C15 single 1.513 0.020
PC8 H29 C15 single 1.092 0.020
PC8 H30 C15 single 1.092 0.020
PC8 H31 C16 single 1.059 0.020
PC8 H32 C16 single 1.059 0.020
PC8 H33 C16 single 1.059 0.020
PC8 O7 C17 deloc 1.454 0.020
PC8 C17 O8 deloc 1.220 0.020
PC8 C18 C17 single 1.510 0.020
PC8 C19 C18 single 1.524 0.020
PC8 H34 C18 single 1.092 0.020
PC8 H35 C18 single 1.092 0.020
PC8 C20 C19 single 1.524 0.020
PC8 H36 C19 single 1.092 0.020
PC8 H37 C19 single 1.092 0.020
PC8 C21 C20 single 1.524 0.020
PC8 H38 C20 single 1.092 0.020
PC8 H39 C20 single 1.092 0.020
PC8 C22 C21 single 1.524 0.020
PC8 H40 C21 single 1.092 0.020
PC8 H41 C21 single 1.092 0.020
PC8 C23 C22 single 1.524 0.020
PC8 H42 C22 single 1.092 0.020
PC8 H43 C22 single 1.092 0.020
PC8 C24 C23 single 1.513 0.020
PC8 H44 C23 single 1.092 0.020
PC8 H45 C23 single 1.092 0.020
PC8 H46 C24 single 1.059 0.020
PC8 H47 C24 single 1.059 0.020
PC8 H48 C24 single 1.059 0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
PC8 O8 C17 C18 120.500 3.000
PC8 O8 C17 O7 119.000 3.000
PC8 C18 C17 O7 120.000 3.000
PC8 C17 C18 H34 109.470 3.000
PC8 C17 C18 H35 109.470 3.000
PC8 C17 C18 C19 109.470 3.000
PC8 H34 C18 H35 107.900 3.000
PC8 H34 C18 C19 109.470 3.000
PC8 H35 C18 C19 109.470 3.000
PC8 C18 C19 H36 109.470 3.000
PC8 C18 C19 H37 109.470 3.000
PC8 C18 C19 C20 111.000 3.000
PC8 H36 C19 H37 107.900 3.000
PC8 H36 C19 C20 109.470 3.000
PC8 H37 C19 C20 109.470 3.000
PC8 C19 C20 H38 109.470 3.000
PC8 C19 C20 H39 109.470 3.000
PC8 C19 C20 C21 111.000 3.000
PC8 H38 C20 H39 107.900 3.000
PC8 H38 C20 C21 109.470 3.000
PC8 H39 C20 C21 109.470 3.000
PC8 C20 C21 H40 109.470 3.000
PC8 C20 C21 H41 109.470 3.000
PC8 C20 C21 C22 111.000 3.000
PC8 H40 C21 H41 107.900 3.000
PC8 H40 C21 C22 109.470 3.000
PC8 H41 C21 C22 109.470 3.000
PC8 C21 C22 H42 109.470 3.000
PC8 C21 C22 H43 109.470 3.000
PC8 C21 C22 C23 111.000 3.000
PC8 H42 C22 H43 107.900 3.000
PC8 H42 C22 C23 109.470 3.000
PC8 H43 C22 C23 109.470 3.000
PC8 C22 C23 H44 109.470 3.000
PC8 C22 C23 H45 109.470 3.000
PC8 C22 C23 C24 111.000 3.000
PC8 H44 C23 H45 107.900 3.000
PC8 H44 C23 C24 109.470 3.000
PC8 H45 C23 C24 109.470 3.000
PC8 C23 C24 H48 109.470 3.000
PC8 C23 C24 H47 109.470 3.000
PC8 C23 C24 H46 109.470 3.000
PC8 H48 C24 H47 109.470 3.000
PC8 H48 C24 H46 109.470 3.000
PC8 H47 C24 H46 109.470 3.000
PC8 C17 O7 C7 111.800 3.000
PC8 O7 C7 H16 109.470 3.000
PC8 O7 C7 C6 109.470 3.000
PC8 O7 C7 C8 109.470 3.000
PC8 H16 C7 C6 108.340 3.000
PC8 H16 C7 C8 108.340 3.000
PC8 C6 C7 C8 109.470 3.000
PC8 C7 C6 H14 109.470 3.000
PC8 C7 C6 H15 109.470 3.000
PC8 C7 C6 O4 109.470 3.000
PC8 H14 C6 H15 107.900 3.000
PC8 H14 C6 O4 109.470 3.000
PC8 H15 C6 O4 109.470 3.000
PC8 C6 O4 P1 120.500 3.000
PC8 O4 P1 O3 102.600 3.000
PC8 O4 P1 O2 108.200 3.000
PC8 O4 P1 O1 108.200 3.000
PC8 O3 P1 O2 108.200 3.000
PC8 O3 P1 O1 108.200 3.000
PC8 O2 P1 O1 119.900 3.000
PC8 P1 O3 C1 120.500 3.000
PC8 O3 C1 H1 109.470 3.000
PC8 O3 C1 H2 109.470 3.000
PC8 O3 C1 C2 109.470 3.000
PC8 H1 C1 H2 107.900 3.000
PC8 H1 C1 C2 109.470 3.000
PC8 H2 C1 C2 109.470 3.000
PC8 C1 C2 H3 109.470 3.000
PC8 C1 C2 H4 109.470 3.000
PC8 C1 C2 N1 109.470 3.000
PC8 H3 C2 H4 107.900 3.000
PC8 H3 C2 N1 109.470 3.000
PC8 H4 C2 N1 109.470 3.000
PC8 C2 N1 C5 109.470 3.000
PC8 C2 N1 C4 109.470 3.000
PC8 C2 N1 C3 109.470 3.000
PC8 C5 N1 C4 109.470 3.000
PC8 C5 N1 C3 109.470 3.000
PC8 C4 N1 C3 109.470 3.000
PC8 N1 C5 H13 109.470 3.000
PC8 N1 C5 H12 109.470 3.000
PC8 N1 C5 H11 109.470 3.000
PC8 H13 C5 H12 109.470 3.000
PC8 H13 C5 H11 109.470 3.000
PC8 H12 C5 H11 109.470 3.000
PC8 N1 C4 H10 109.470 3.000
PC8 N1 C4 H9 109.470 3.000
PC8 N1 C4 H8 109.470 3.000
PC8 H10 C4 H9 109.470 3.000
PC8 H10 C4 H8 109.470 3.000
PC8 H9 C4 H8 109.470 3.000
PC8 N1 C3 H7 109.470 3.000
PC8 N1 C3 H6 109.470 3.000
PC8 N1 C3 H5 109.470 3.000
PC8 H7 C3 H6 109.470 3.000
PC8 H7 C3 H5 109.470 3.000
PC8 H6 C3 H5 109.470 3.000
PC8 C7 C8 H17 109.470 3.000
PC8 C7 C8 H18 109.470 3.000
PC8 C7 C8 O5 109.470 3.000
PC8 H17 C8 H18 107.900 3.000
PC8 H17 C8 O5 109.470 3.000
PC8 H18 C8 O5 109.470 3.000
PC8 C8 O5 C9 120.000 3.000
PC8 O5 C9 O6 119.000 3.000
PC8 O5 C9 C10 120.000 3.000
PC8 O6 C9 C10 120.500 3.000
PC8 C9 C10 H19 109.470 3.000
PC8 C9 C10 H20 109.470 3.000
PC8 C9 C10 C11 109.470 3.000
PC8 H19 C10 H20 107.900 3.000
PC8 H19 C10 C11 109.470 3.000
PC8 H20 C10 C11 109.470 3.000
PC8 C10 C11 H21 109.470 3.000
PC8 C10 C11 H22 109.470 3.000
PC8 C10 C11 C12 111.000 3.000
PC8 H21 C11 H22 107.900 3.000
PC8 H21 C11 C12 109.470 3.000
PC8 H22 C11 C12 109.470 3.000
PC8 C11 C12 H23 109.470 3.000
PC8 C11 C12 H24 109.470 3.000
PC8 C11 C12 C13 111.000 3.000
PC8 H23 C12 H24 107.900 3.000
PC8 H23 C12 C13 109.470 3.000
PC8 H24 C12 C13 109.470 3.000
PC8 C12 C13 H25 109.470 3.000
PC8 C12 C13 H26 109.470 3.000
PC8 C12 C13 C14 111.000 3.000
PC8 H25 C13 H26 107.900 3.000
PC8 H25 C13 C14 109.470 3.000
PC8 H26 C13 C14 109.470 3.000
PC8 C13 C14 H27 109.470 3.000
PC8 C13 C14 H28 109.470 3.000
PC8 C13 C14 C15 111.000 3.000
PC8 H27 C14 H28 107.900 3.000
PC8 H27 C14 C15 109.470 3.000
PC8 H28 C14 C15 109.470 3.000
PC8 C14 C15 H29 109.470 3.000
PC8 C14 C15 H30 109.470 3.000
PC8 C14 C15 C16 111.000 3.000
PC8 H29 C15 H30 107.900 3.000
PC8 H29 C15 C16 109.470 3.000
PC8 H30 C15 C16 109.470 3.000
PC8 C15 C16 H33 109.470 3.000
PC8 C15 C16 H32 109.470 3.000
PC8 C15 C16 H31 109.470 3.000
PC8 H33 C16 H32 109.470 3.000
PC8 H33 C16 H31 109.470 3.000
PC8 H32 C16 H31 109.470 3.000
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
PC8 var_1 O8 C17 C18 C19 -0.032 20.000 3
PC8 var_2 C17 C18 C19 C20 -179.943 20.000 3
PC8 var_3 C18 C19 C20 C21 179.981 20.000 3
PC8 var_4 C19 C20 C21 C22 179.972 20.000 3
PC8 var_5 C20 C21 C22 C23 -179.981 20.000 3
PC8 var_6 C21 C22 C23 C24 179.994 20.000 3
PC8 var_7 C22 C23 C24 H46 -60.016 20.000 3
PC8 var_8 O8 C17 O7 C7 0.086 20.000 1
PC8 var_9 C17 O7 C7 C8 -149.468 20.000 1
PC8 var_10 O7 C7 C6 O4 68.199 20.000 3
PC8 var_11 C7 C6 O4 P1 179.999 20.000 1
PC8 var_12 C6 O4 P1 O1 -65.011 20.000 1
PC8 var_13 O4 P1 O3 C1 -174.980 20.000 1
PC8 var_14 P1 O3 C1 C2 179.983 20.000 1
PC8 var_15 O3 C1 C2 N1 66.472 20.000 3
PC8 var_16 C1 C2 N1 C3 54.481 20.000 1
PC8 var_17 C2 N1 C5 H11 70.993 20.000 1
PC8 var_18 C2 N1 C4 H8 -179.972 20.000 1
PC8 var_19 C2 N1 C3 H5 59.979 20.000 1
PC8 var_20 O7 C7 C8 O5 -66.606 20.000 3
PC8 var_21 C7 C8 O5 C9 -179.965 20.000 1
PC8 var_22 C8 O5 C9 C10 179.982 20.000 1
PC8 var_23 O5 C9 C10 C11 179.932 20.000 3
PC8 var_24 C9 C10 C11 C12 179.950 20.000 3
PC8 var_25 C10 C11 C12 C13 -179.963 20.000 3
PC8 var_26 C11 C12 C13 C14 -179.952 20.000 3
PC8 var_27 C12 C13 C14 C15 180.000 20.000 3
PC8 var_28 C13 C14 C15 C16 180.000 20.000 3
PC8 var_29 C14 C15 C16 H31 -60.069 20.000 3
loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
PC8 chir_01 N1 C2 C3 C4 negativ
PC8 chir_02 C7 C6 C8 O7 negativ
loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
PC8 plan-1 C9 0.020
PC8 plan-1 O5 0.020
PC8 plan-1 O6 0.020
PC8 plan-1 C10 0.020
PC8 plan-2 C17 0.020
PC8 plan-2 O7 0.020
PC8 plan-2 O8 0.020
PC8 plan-2 C18 0.020
# ------------------------------------------------------
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