coordgen 0.2.2

A thin rust wrapper around coordgen
Documentation
{ 
 s_m_m2io_version
 :::
 2.0.0 
} 

f_m_ct { 
 s_m_title
 i_m_ct_stereo_status
 s_st_Chirality_1
 s_st_Chirality_2
 i_m_ct_format
 :::
 Untitled_Molecule_000001 
  1
  5_R_4_7_6 
  10_R_9_11_13 
  2
 m_depend[2] { 
  # First column is dependency index #
  i_m_depend_dependency
  s_m_depend_property
  :::
  1 10 s_st_Chirality_1 
  2 10 s_st_Chirality_2 
  :::
 } 
 m_atom[27] { 
  # 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
  i_m_color
  i_m_atomic_number
  i_sd_original_parity
  :::
  1 5 -2.791812 1.972102 0.000000 900 2 6 <>
  2 2 -1.665230 2.611009 0.000000 900 2 6 <>
  3 15 -1.657448 3.908277 0.000000 900 70 8 <>
  4 29 -0.545392 1.956279 0.000000 900 43 7 <>
  5 4 0.581190 2.599076 0.000000 900 2 6 2
  6 6 0.587415 3.895826 0.000000 900 2 6 <>
  7 2 1.701806 1.945643 0.000000 900 2 6 <>
  8 15 2.827350 2.589997 0.000000 900 70 8 <>
  9 29 1.697396 0.648634 0.000000 900 43 7 <>
  10 4 2.818789 -0.002724 0.000000 900 2 6 1
  11 7 3.943815 0.642409 0.000000 900 2 6 <>
  12 15 3.947187 1.939418 0.000000 900 70 8 <>
  13 5 2.813342 -1.301289 0.000000 900 2 6 <>
  14 2 1.701027 -1.938120 0.000000 900 2 6 <>
  15 7 1.673531 -3.242393 0.000000 900 2 6 <>
  16 7 0.553174 -3.908277 0.000000 900 2 6 <>
  17 2 -0.565366 -3.229682 0.000000 900 2 6 <>
  18 17 -1.702843 -3.880002 0.000000 900 70 8 <>
  19 7 0.559919 -1.298436 0.000000 900 2 6 <>
  20 2 -0.582746 -1.925410 0.000000 900 2 6 <>
  21 2 -1.688835 -1.280018 0.000000 900 2 6 <>
  22 7 -1.659004 0.022179 0.000000 900 2 6 <>
  23 2 -2.814120 -1.949015 0.000000 900 2 6 <>
  24 17 -2.819827 -3.232795 0.000000 900 70 8 <>
  25 7 -3.930326 -1.271458 0.000000 900 2 6 <>
  26 7 -3.947187 0.030999 0.000000 900 2 6 <>
  27 2 -2.798815 0.659529 0.000000 900 2 6 <>
  :::
 } 
 m_bond[31] { 
  # First column is bond index #
  i_m_from
  i_m_to
  i_m_order
  i_sd_original_parity
  :::
  1 1 27 1 <>
  2 1 2 1 <>
  3 2 3 2 <>
  4 2 4 1 <>
  5 4 5 1 <>
  6 5 6 1 6
  7 5 7 1 <>
  8 6 5 1 6
  9 7 8 2 <>
  10 7 9 1 <>
  11 9 10 1 <>
  12 10 11 1 1
  13 10 13 1 <>
  14 11 10 1 1
  15 11 12 2 <>
  16 13 14 1 <>
  17 14 15 2 <>
  18 14 19 1 <>
  19 15 16 1 <>
  20 16 17 2 <>
  21 17 20 1 <>
  22 17 18 1 <>
  23 19 20 2 <>
  24 20 21 1 <>
  25 21 22 2 <>
  26 21 23 1 <>
  27 22 27 1 <>
  28 23 24 1 <>
  29 23 25 2 <>
  30 25 26 1 <>
  31 26 27 2 <>
  :::
 } 
}