{
  s_m_m2io_version
  :::
  1.1.0
}

f_m_ct {
  s_m_title
  i_m_nmolecules
  :::
  "C9H8O4"
  1
  m_atom[21] {
    # First column is atom index #
    i_m_mmod_type
    r_m_x_coord
    r_m_y_coord
    r_m_z_coord
    i_m_residue_number
    s_m_mmod_res
    s_m_chain_name
    i_m_color
    r_m_charge1
    r_m_charge2
    s_m_pdb_residue_name
    s_m_pdb_atom_name
    s_m_grow_name
    i_m_atomic_number
    i_m_formal_charge
    i_m_visibility
    :::
    1 2 2.239272 -0.379063 0.262961 0 X " " 2 -0.04701 -0.04701 "UNK " "    " " " 6 0 1
    2 2 0.842418 1.923070 -0.424949 0 X " " 2 -0.03100 -0.03100 "UNK " "    " " " 6 0 1
    3 2 2.870926 0.845574 0.272238 0 X " " 2 -0.06158 -0.06158 "UNK " "    " " " 6 0 1
    4 2 2.175116 1.993529 -0.070350 0 X " " 2 -0.05999 -0.05999 "UNK " "    " " " 6 0 1
    5 3 -3.483760 0.495315 -0.089583 0 X " " 2 0.02253 0.02253 "UNK " "    " " " 6 0 1
    6 2 0.890970 -0.464746 -0.093876 0 X " " 2 0.07637 0.07637 "UNK " "    " " " 6 0 1
    7 2 0.190846 0.699129 -0.440244 0 X " " 2 0.09859 0.09859 "UNK " "    " " " 6 0 1
    8 15 -0.963310 -1.842516 -0.418542 0 X " " 16 -0.25868 -0.25868 "UNK " "    " " " 8 0 1
    9 15 -1.653075 0.888854 1.340633 0 X " " 16 -0.26436 -0.26436 "UNK " "    " " " 8 0 1
    10 16 0.885744 -2.888329 0.226742 0 X " " 16 -0.32737 -0.32737 "UNK " "    " " " 8 0 1
    11 2 0.208961 -1.771972 -0.106920 0 X " " 2 0.29293 0.29293 "UNK " "    " " " 6 0 1
    12 2 -2.018522 0.685348 0.207084 0 X " " 2 0.26263 0.26263 "UNK " "    " " " 6 0 1
    13 16 -1.118880 0.628498 -0.788551 0 X " " 16 -0.27652 -0.27652 "UNK " "    " " " 8 0 1
    14 42 0.396217 -3.721942 0.203470 0 X " " 21 0.22092 0.22092 "UNK " "    " " " 1 0 1
    15 41 2.786660 -1.271906 0.526773 0 X " " 21 0.06334 0.06334 "UNK " "    " " " 1 0 1
    16 41 0.306931 2.822417 -0.691086 0 X " " 21 0.06509 0.06509 "UNK " "    " " " 1 0 1
    17 41 3.913041 0.910836 0.548169 0 X " " 21 0.06250 0.06250 "UNK " "    " " " 1 0 1
    18 41 2.678112 2.949194 -0.060362 0 X " " 21 0.06256 0.06256 "UNK " "    " " " 1 0 1
    19 41 -3.735987 -0.562262 -0.012041 0 X " " 21 0.03302 0.03302 "UNK " "    " " " 1 0 1
    20 41 -4.076313 1.063672 0.627322 0 X " " 21 0.03302 0.03302 "UNK " "    " " " 1 0 1
    21 41 -3.698775 0.847085 -1.098605 0 X " " 21 0.03302 0.03302 "UNK " "    " " " 1 0 1
    :::
  }
  m_bond[42] {
    # First column is bond index #
    i_m_from
    i_m_to
    i_m_order
    :::
    1 1 6 1
    2 1 3 2
    3 1 15 1
    4 2 7 1
    5 2 4 2
    6 2 16 1
    7 3 1 2
    8 3 4 1
    9 3 17 1
    10 4 2 2
    11 4 3 1
    12 4 18 1
    13 5 12 1
    14 5 19 1
    15 5 20 1
    16 5 21 1
    17 6 7 2
    18 6 1 1
    19 6 11 1
    20 7 6 2
    21 7 2 1
    22 7 13 1
    23 8 11 2
    24 9 12 2
    25 10 11 1
    26 10 14 1
    27 11 6 1
    28 11 10 1
    29 11 8 2
    30 12 13 1
    31 12 5 1
    32 12 9 2
    33 13 7 1
    34 13 12 1
    35 14 10 1
    36 15 1 1
    37 16 2 1
    38 17 3 1
    39 18 4 1
    40 19 5 1
    41 20 5 1
    42 21 5 1
    :::
  }
}