#
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
VAX      VAX '4-EPI-VANCOSAMINYL DERIVATIVE OF VAN' non-polymer       202 111 .
#
data_comp_VAX
#
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
 VAX           O80    O    OC       -0.500      0.000    0.000    0.000
 VAX           C70    C    C         0.000      0.759    0.841   -0.532
 VAX           O71    O    OC       -0.500      1.787    0.523   -1.176
 VAX           C69    C    CH1       0.000      0.322    2.274   -0.519
 VAX           H69    H    H         0.000      0.978    2.928   -1.112
 VAX           C72    C    CR6       0.000      0.147    2.746    0.892
 VAX           C73    C    CR6       0.000     -0.923    3.703    1.318
 VAX           C75    C    CR6       0.000     -0.916    4.011    2.814
 VAX           C76    C    CR16      0.000      0.034    3.440    3.699
 VAX           H76    H    H         0.000      0.012    3.687    4.753
 VAX           C77    C    CR6       0.000      0.980    2.574    3.213
 VAX           C74    C    CR16      0.000      1.022    2.247    1.878
 VAX           H74    H    H         0.000      1.788    1.550    1.559
 VAX           O78    O    OH1       0.000      1.874    2.068    4.115
 VAX           HO8    H    H         0.000      2.488    1.474    3.662
 VAX           O79    O    OH1       0.000     -1.711    4.828    3.610
 VAX           HO7    H    H         0.000     -1.417    4.776    4.532
 VAX           C50    C    CR6       0.000     -1.874    4.274    0.473
 VAX           C52    C    CR6       0.000     -2.871    5.126    1.132
 VAX           C51    C    CR16      0.000     -3.844    5.626    0.355
 VAX           H51    H    H         0.000     -4.605    6.274    0.773
 VAX           C49    C    CR16      0.000     -3.858    5.306   -0.966
 VAX           H49    H    H         0.000     -4.739    5.684   -1.470
 VAX           O53    O    OH1       0.000     -3.173    5.594    2.374
 VAX           HO3    H    H         0.000     -2.528    5.256    3.011
 VAX           C48    C    CR16      0.000     -2.016    4.045   -0.937
 VAX           H48    H    H         0.000     -1.300    3.378   -1.402
 VAX           C47    C    CR6       0.000     -3.040    4.630   -1.805
 VAX           N68    N    NH1       0.000     -1.053    2.226   -1.033
 VAX           HN8    H    H         0.000     -1.752    2.713   -0.491
 VAX           C56    C    C         0.000     -1.485    1.608   -2.144
 VAX           O57    O    O         0.000     -0.702    0.872   -2.732
 VAX           C55    C    CH1       0.000     -2.841    1.877   -2.774
 VAX           H55    H    H         0.000     -3.327    2.609   -2.114
 VAX           C58    C    CH1       0.000     -3.744    0.666   -2.760
 VAX           H58    H    H         0.000     -3.635    0.142   -1.800
 VAX           O59    O    O2        0.000     -3.429   -0.205   -3.798
 VAX           C81    C    CH1       0.000     -3.886   -1.516   -3.689
 VAX           H81    H    H         0.000     -4.969   -1.532   -3.875
 VAX           O82    O    O2        0.000     -3.638   -2.009   -2.397
 VAX           C83    C    CH1       0.000     -2.276   -2.139   -2.037
 VAX           H83    H    H         0.000     -1.846   -1.130   -1.966
 VAX           C85    C    CH1       0.000     -1.453   -2.927   -3.033
 VAX           H85    H    H         0.000     -1.732   -3.987   -2.955
 VAX           C87    C    CT        0.000     -1.706   -2.463   -4.462
 VAX           C90    C    CH2       0.000     -3.198   -2.356   -4.740
 VAX           H902   H    H         0.000     -3.626   -3.360   -4.743
 VAX           H901   H    H         0.000     -3.338   -1.899   -5.722
 VAX           C89    C    CH3       0.000     -1.026   -1.151   -4.821
 VAX           H893   H    H         0.000      0.006   -1.215   -4.593
 VAX           H892   H    H         0.000     -1.148   -0.963   -5.856
 VAX           H891   H    H         0.000     -1.463   -0.364   -4.264
 VAX           N88    N    NT3       1.000     -1.119   -3.434   -5.422
 VAX           HN83   H    H         0.000     -0.102   -3.506   -5.258
 VAX           HN82   H    H         0.000     -1.557   -4.360   -5.286
 VAX           HN81   H    H         0.000     -1.291   -3.110   -6.387
 VAX           O86    O    OH1       0.000     -0.070   -2.789   -2.658
 VAX           HO6    H    H         0.000      0.398   -3.616   -2.838
 VAX           C84    C    CH3       0.000     -2.296   -2.743   -0.630
 VAX           H843   H    H         0.000     -2.789   -3.681   -0.653
 VAX           H842   H    H         0.000     -1.303   -2.876   -0.286
 VAX           H841   H    H         0.000     -2.811   -2.092    0.028
 VAX           C60    C    CR6       0.000     -5.159    1.098   -2.927
 VAX           C61    C    CR16      0.000     -5.722    1.031   -4.205
 VAX           H61    H    H         0.000     -5.105    0.698   -5.031
 VAX           C63    C    CR16      0.000     -7.033    1.372   -4.453
 VAX           H63    H    H         0.000     -7.423    1.305   -5.461
 VAX           C65    C    CR6       0.000     -7.848    1.798   -3.435
 VAX           C64    C    CR6       0.000     -7.293    1.852   -2.069
 VAX           C62    C    CR16      0.000     -5.963    1.504   -1.844
 VAX           H62    H    H         0.000     -5.550    1.545   -0.844
 VAX           CL6    CL   CL        0.000     -8.306    2.402   -0.699
 VAX           O66    O    O2        0.000     -9.150    2.105   -3.728
 VAX           C39    C    CR6       0.000     -9.567    3.413   -3.895
 VAX           C37    C    CR16      0.000     -8.634    4.428   -4.076
 VAX           H37    H    H         0.000     -7.609    4.077   -4.067
 VAX           C41    C    CR6       0.000    -10.955    3.842   -3.856
 VAX           O42    O    O2        0.000    -11.747    2.694   -3.661
 VAX           'C1''  C    CH1       0.000    -12.260    2.277   -2.363
 VAX           'H1''  H    H         0.000    -12.639    3.263   -2.058
 VAX           'C2''  C    CH1       0.000    -13.554    1.536   -2.185
 VAX           'H2''  H    H         0.000    -13.470    0.486   -2.499
 VAX           'C3''  C    CH1       0.000    -14.090    1.667   -0.703
 VAX           'H3''  H    H         0.000    -14.610    2.622   -0.543
 VAX           'C4''  C    CH1       0.000    -13.025    1.418    0.372
 VAX           'H4''  H    H         0.000    -12.678    0.379    0.282
 VAX           'C5''  C    CH1       0.000    -11.853    2.328    0.147
 VAX           'H5''  H    H         0.000    -12.186    3.372    0.227
 VAX           'C6''  C    CH2       0.000    -10.686    2.090    1.126
 VAX           'H6'1' H    H         0.000    -11.053    2.330    2.127
 VAX           'H6'2' H    H         0.000     -9.891    2.787    0.854
 VAX           'O6''  O    OH1       0.000    -10.178    0.756    1.112
 VAX           'HO6'' H    H         0.000     -9.447    0.684    1.740
 VAX           'O5''  O    O2        0.000    -11.332    2.090   -1.206
 VAX           'O4''  O    OH1       0.000    -13.556    1.604    1.692
 VAX           'HO4'' H    H         0.000    -13.877    0.758    2.033
 VAX           'O3''  O    OH1       0.000    -14.984    0.550   -0.573
 VAX           'HO3'' H    H         0.000    -15.731    0.798   -0.011
 VAX           'O2''  O    O2        0.000    -14.574    2.225   -2.907
 VAX           C1"    C    CH1       0.000    -15.110    1.561   -4.019
 VAX           H1"    H    H         0.000    -14.909    0.488   -3.891
 VAX           C2"    C    CH2       0.000    -16.615    1.744   -4.046
 VAX           H2"1   H    H         0.000    -16.971    1.566   -3.029
 VAX           H2"2   H    H         0.000    -17.013    0.973   -4.709
 VAX           C3"    C    CT        0.000    -17.079    3.104   -4.515
 VAX           C3M    C    CH3       0.000    -16.985    4.143   -3.405
 VAX           H3M3   H    H         0.000    -15.969    4.290   -3.145
 VAX           H3M2   H    H         0.000    -17.400    5.057   -3.741
 VAX           H3M1   H    H         0.000    -17.521    3.802   -2.557
 VAX           C4"    C    CH1       0.000    -16.390    3.476   -5.817
 VAX           H4"    H    H         0.000    -16.796    2.861   -6.632
 VAX           C5"    C    CH1       0.000    -14.904    3.239   -5.705
 VAX           H5"    H    H         0.000    -14.539    3.970   -4.970
 VAX           C5M    C    CH3       0.000    -14.114    3.507   -6.987
 VAX           H5M3   H    H         0.000    -13.097    3.250   -6.837
 VAX           H5M2   H    H         0.000    -14.511    2.924   -7.777
 VAX           H5M1   H    H         0.000    -14.184    4.534   -7.238
 VAX           O5"    O    O2        0.000    -14.487    1.970   -5.227
 VAX           O4"    O    OH1       0.000    -16.570    4.872   -6.139
 VAX           HO4"   H    H         0.000    -17.336    4.975   -6.722
 VAX           N3"    N    NT3       1.000    -18.534    3.028   -4.782
 VAX           HN33   H    H         0.000    -18.869    3.945   -5.118
 VAX           HN32   H    H         0.000    -18.712    2.309   -5.502
 VAX           HN31   H    H         0.000    -19.029    2.776   -3.912
 VAX           C40    C    CR6       0.000    -11.087    5.339   -4.018
 VAX           C38    C    CR16      0.000    -10.082    6.286   -4.232
 VAX           H38    H    H         0.000    -10.314    7.336   -4.365
 VAX           C36    C    CR6       0.000     -8.748    5.815   -4.267
 VAX           O22    O    O2        0.000    -12.270    5.958   -3.995
 VAX           C21    C    CR6       0.000    -12.603    7.232   -3.631
 VAX           C20    C    CR16      0.000    -12.529    7.769   -2.383
 VAX           H20    H    H         0.000    -12.145    7.175   -1.562
 VAX           C18    C    CR16      0.000    -12.947    9.091   -2.155
 VAX           H18    H    H         0.000    -12.862    9.479   -1.147
 VAX           C19    C    CR6       0.000    -13.160    8.142   -4.663
 VAX           CL2    CL   CL        0.000    -13.322    7.501   -6.332
 VAX           C17    C    CR16      0.000    -13.548    9.477   -4.430
 VAX           H17    H    H         0.000    -13.894   10.103   -5.243
 VAX           C16    C    CR6       0.000    -13.478    9.961   -3.159
 VAX           C14    C    CH1       0.000    -13.659   11.318   -2.580
 VAX           H14    H    H         0.000    -13.542   12.089   -3.354
 VAX           O15    O    OH1       0.000    -14.869   11.620   -1.696
 VAX           HO5    H    H         0.000    -14.934   10.975   -0.969
 VAX           N54    N    NH1       0.000     -2.715    2.552   -4.081
 VAX           HN5    H    H         0.000     -2.280    2.023   -4.824
 VAX           C45    C    C         0.000     -3.129    3.829   -4.395
 VAX           O46    O    O         0.000     -3.121    4.195   -5.567
 VAX           C44    C    CH1       0.000     -3.855    4.482   -3.237
 VAX           H44    H    H         0.000     -4.457    3.608   -2.953
 VAX           N43    N    NH1       0.000     -4.974    5.339   -3.639
 VAX           HN3    H    H         0.000     -4.762    5.698   -4.559
 VAX           C34    C    C         0.000     -6.110    5.817   -3.297
 VAX           O35    O    O         0.000     -6.526    5.733   -2.147
 VAX           C33    C    CH1       0.000     -7.176    6.599   -4.117
 VAX           H33    H    H         0.000     -6.782    6.883   -5.103
 VAX           N32    N    NH1       0.000     -7.534    7.806   -3.317
 VAX           HN2    H    H         0.000     -7.164    7.824   -2.377
 VAX           C26    C    C         0.000     -8.278    8.879   -3.662
 VAX           O27    O    O         0.000     -8.627    8.933   -4.840
 VAX           C25    C    CH1       0.000     -8.688   10.063   -2.776
 VAX           H25    H    H         0.000     -8.471   10.982   -3.338
 VAX           C28    C    CH2       0.000     -7.687    9.985   -1.633
 VAX           H281   H    H         0.000     -6.663   10.085   -1.999
 VAX           H282   H    H         0.000     -7.786    9.045   -1.086
 VAX           C29    C    C         0.000     -8.004   11.116   -0.734
 VAX           N31    N    NH2       0.000     -8.583   10.861    0.428
 VAX           HN12   H    H         0.000     -8.807   11.620    1.054
 VAX           HN11   H    H         0.000     -8.799    9.910    0.682
 VAX           O30    O    O         0.000     -7.719   12.255   -1.081
 VAX           N24    N    NH1       0.000    -10.103   10.109   -2.398
 VAX           HN4    H    H         0.000    -10.514    9.231   -2.113
 VAX           C12    C    C         0.000    -10.930   11.184   -2.384
 VAX           O13    O    O         0.000    -10.591   12.211   -2.998
 VAX           C11    C    CH1       0.000    -12.312   11.235   -1.630
 VAX           H11    H    H         0.000    -12.315   12.050   -0.893
 VAX           N10    N    NH1       0.000    -12.268    9.947   -0.959
 VAX           HN0    H    H         0.000    -11.920    9.232   -1.581
 VAX           C4     C    C         0.000    -12.550    9.439    0.226
 VAX           O5     O    O         0.000    -12.665   10.241    1.148
 VAX           C3     C    CH1       0.000    -12.755    7.980    0.596
 VAX           H3     H    H         0.000    -12.991    7.428   -0.324
 VAX           N2     N    NT2       1.000    -13.938    7.909    1.486
 VAX           HN21   H    H         0.000    -13.849    8.579    2.267
 VAX           HN22   H    H         0.000    -14.056    6.955    1.863
 VAX           C1     C    CH3       0.000    -15.134    8.269    0.649
 VAX           H1_3   H    H         0.000    -15.231    7.584   -0.156
 VAX           H1_2   H    H         0.000    -16.014    8.234    1.242
 VAX           H1_1   H    H         0.000    -15.019    9.249    0.257
 VAX           C6     C    CH2       0.000    -11.570    7.290    1.268
 VAX           H6_1   H    H         0.000    -11.464    7.728    2.263
 VAX           H6_2   H    H         0.000    -10.684    7.522    0.674
 VAX           C7     C    CH1       0.000    -11.720    5.793    1.388
 VAX           H7     H    H         0.000    -12.441    5.591    2.193
 VAX           C9     C    CH3       0.000    -10.339    5.450    1.906
 VAX           H9_3   H    H         0.000    -10.278    4.408    2.075
 VAX           H9_2   H    H         0.000     -9.615    5.737    1.189
 VAX           H9_1   H    H         0.000    -10.166    5.968    2.812
 VAX           C8     C    CH3       0.000    -12.240    5.170    0.143
 VAX           H8_3   H    H         0.000    -13.172    5.604   -0.097
 VAX           H8_2   H    H         0.000    -11.552    5.340   -0.640
 VAX           H8_1   H    H         0.000    -12.357    4.132    0.300
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
 VAX      O80    n/a    C70    START
 VAX      C70    O80    C69    .
 VAX      O71    C70    .      .
 VAX      C69    C70    N68    .
 VAX      H69    C69    .      .
 VAX      C72    C69    C73    .
 VAX      C73    C72    C50    .
 VAX      C75    C73    O79    .
 VAX      C76    C75    C77    .
 VAX      H76    C76    .      .
 VAX      C77    C76    O78    .
 VAX      C74    C77    H74    .
 VAX      H74    C74    .      .
 VAX      O78    C77    HO8    .
 VAX      HO8    O78    .      .
 VAX      O79    C75    HO7    .
 VAX      HO7    O79    .      .
 VAX      C50    C73    C48    .
 VAX      C52    C50    O53    .
 VAX      C51    C52    C49    .
 VAX      H51    C51    .      .
 VAX      C49    C51    H49    .
 VAX      H49    C49    .      .
 VAX      O53    C52    HO3    .
 VAX      HO3    O53    .      .
 VAX      C48    C50    C47    .
 VAX      H48    C48    .      .
 VAX      C47    C48    .      .
 VAX      N68    C69    C56    .
 VAX      HN8    N68    .      .
 VAX      C56    N68    C55    .
 VAX      O57    C56    .      .
 VAX      C55    C56    N54    .
 VAX      H55    C55    .      .
 VAX      C58    C55    C60    .
 VAX      H58    C58    .      .
 VAX      O59    C58    C81    .
 VAX      C81    O59    O82    .
 VAX      H81    C81    .      .
 VAX      O82    C81    C83    .
 VAX      C83    O82    C84    .
 VAX      H83    C83    .      .
 VAX      C85    C83    O86    .
 VAX      H85    C85    .      .
 VAX      C87    C85    N88    .
 VAX      C90    C87    H901   .
 VAX      H902   C90    .      .
 VAX      H901   C90    .      .
 VAX      C89    C87    H891   .
 VAX      H893   C89    .      .
 VAX      H892   C89    .      .
 VAX      H891   C89    .      .
 VAX      N88    C87    HN81   .
 VAX      HN83   N88    .      .
 VAX      HN82   N88    .      .
 VAX      HN81   N88    .      .
 VAX      O86    C85    HO6    .
 VAX      HO6    O86    .      .
 VAX      C84    C83    H841   .
 VAX      H843   C84    .      .
 VAX      H842   C84    .      .
 VAX      H841   C84    .      .
 VAX      C60    C58    C61    .
 VAX      C61    C60    C63    .
 VAX      H61    C61    .      .
 VAX      C63    C61    C65    .
 VAX      H63    C63    .      .
 VAX      C65    C63    O66    .
 VAX      C64    C65    CL6    .
 VAX      C62    C64    H62    .
 VAX      H62    C62    .      .
 VAX      CL6    C64    .      .
 VAX      O66    C65    C39    .
 VAX      C39    O66    C41    .
 VAX      C37    C39    H37    .
 VAX      H37    C37    .      .
 VAX      C41    C39    C40    .
 VAX      O42    C41    'C1''  .
 VAX      'C1''  O42    'C2''  .
 VAX      'H1''  'C1''  .      .
 VAX      'C2''  'C1''  'O2''  .
 VAX      'H2''  'C2''  .      .
 VAX      'C3''  'C2''  'O3''  .
 VAX      'H3''  'C3''  .      .
 VAX      'C4''  'C3''  'O4''  .
 VAX      'H4''  'C4''  .      .
 VAX      'C5''  'C4''  'O5''  .
 VAX      'H5''  'C5''  .      .
 VAX      'C6''  'C5''  'O6''  .
 VAX      'H6'1' 'C6''  .      .
 VAX      'H6'2' 'C6''  .      .
 VAX      'O6''  'C6''  'HO6'' .
 VAX      'HO6'' 'O6''  .      .
 VAX      'O5''  'C5''  .      .
 VAX      'O4''  'C4''  'HO4'' .
 VAX      'HO4'' 'O4''  .      .
 VAX      'O3''  'C3''  'HO3'' .
 VAX      'HO3'' 'O3''  .      .
 VAX      'O2''  'C2''  C1"    .
 VAX      C1"    'O2''  C2"    .
 VAX      H1"    C1"    .      .
 VAX      C2"    C1"    C3"    .
 VAX      H2"1   C2"    .      .
 VAX      H2"2   C2"    .      .
 VAX      C3"    C2"    N3"    .
 VAX      C3M    C3"    H3M1   .
 VAX      H3M3   C3M    .      .
 VAX      H3M2   C3M    .      .
 VAX      H3M1   C3M    .      .
 VAX      C4"    C3"    O4"    .
 VAX      H4"    C4"    .      .
 VAX      C5"    C4"    O5"    .
 VAX      H5"    C5"    .      .
 VAX      C5M    C5"    H5M1   .
 VAX      H5M3   C5M    .      .
 VAX      H5M2   C5M    .      .
 VAX      H5M1   C5M    .      .
 VAX      O5"    C5"    .      .
 VAX      O4"    C4"    HO4"   .
 VAX      HO4"   O4"    .      .
 VAX      N3"    C3"    HN31   .
 VAX      HN33   N3"    .      .
 VAX      HN32   N3"    .      .
 VAX      HN31   N3"    .      .
 VAX      C40    C41    O22    .
 VAX      C38    C40    C36    .
 VAX      H38    C38    .      .
 VAX      C36    C38    .      .
 VAX      O22    C40    C21    .
 VAX      C21    O22    C19    .
 VAX      C20    C21    C18    .
 VAX      H20    C20    .      .
 VAX      C18    C20    H18    .
 VAX      H18    C18    .      .
 VAX      C19    C21    C17    .
 VAX      CL2    C19    .      .
 VAX      C17    C19    C16    .
 VAX      H17    C17    .      .
 VAX      C16    C17    C14    .
 VAX      C14    C16    O15    .
 VAX      H14    C14    .      .
 VAX      O15    C14    HO5    .
 VAX      HO5    O15    .      .
 VAX      N54    C55    C45    .
 VAX      HN5    N54    .      .
 VAX      C45    N54    C44    .
 VAX      O46    C45    .      .
 VAX      C44    C45    N43    .
 VAX      H44    C44    .      .
 VAX      N43    C44    C34    .
 VAX      HN3    N43    .      .
 VAX      C34    N43    C33    .
 VAX      O35    C34    .      .
 VAX      C33    C34    N32    .
 VAX      H33    C33    .      .
 VAX      N32    C33    C26    .
 VAX      HN2    N32    .      .
 VAX      C26    N32    C25    .
 VAX      O27    C26    .      .
 VAX      C25    C26    N24    .
 VAX      H25    C25    .      .
 VAX      C28    C25    C29    .
 VAX      H281   C28    .      .
 VAX      H282   C28    .      .
 VAX      C29    C28    O30    .
 VAX      N31    C29    HN11   .
 VAX      HN12   N31    .      .
 VAX      HN11   N31    .      .
 VAX      O30    C29    .      .
 VAX      N24    C25    C12    .
 VAX      HN4    N24    .      .
 VAX      C12    N24    C11    .
 VAX      O13    C12    .      .
 VAX      C11    C12    N10    .
 VAX      H11    C11    .      .
 VAX      N10    C11    C4     .
 VAX      HN0    N10    .      .
 VAX      C4     N10    C3     .
 VAX      O5     C4     .      .
 VAX      C3     C4     C6     .
 VAX      H3     C3     .      .
 VAX      N2     C3     C1     .
 VAX      HN21   N2     .      .
 VAX      HN22   N2     .      .
 VAX      C1     N2     H1_1   .
 VAX      H1_3   C1     .      .
 VAX      H1_2   C1     .      .
 VAX      H1_1   C1     .      .
 VAX      C6     C3     C7     .
 VAX      H6_1   C6     .      .
 VAX      H6_2   C6     .      .
 VAX      C7     C6     C8     .
 VAX      H7     C7     .      .
 VAX      C9     C7     H9_1   .
 VAX      H9_3   C9     .      .
 VAX      H9_2   C9     .      .
 VAX      H9_1   C9     .      .
 VAX      C8     C7     H8_1   .
 VAX      H8_3   C8     .      .
 VAX      H8_2   C8     .      .
 VAX      H8_1   C8     .      END
 VAX      C11    C14    .    ADD
 VAX      C16    C18    .    ADD
 VAX      C33    C36    .    ADD
 VAX      C36    C37    .    ADD
 VAX      C44    C47    .    ADD
 VAX      C47    C49    .    ADD
 VAX      C60    C62    .    ADD
 VAX      C72    C74    .    ADD
 VAX      C81    C90    .    ADD
 VAX      'C1''  'O5''  .    ADD
 VAX      C1"    O5"    .    ADD
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
 VAX      C1     N2        single      1.472    0.020
 VAX      H1_1   C1        single      1.059    0.020
 VAX      H1_2   C1        single      1.059    0.020
 VAX      H1_3   C1        single      1.059    0.020
 VAX      N2     C3        single      1.475    0.020
 VAX      HN21   N2        single      1.033    0.020
 VAX      HN22   N2        single      1.033    0.020
 VAX      C6     C3        single      1.524    0.020
 VAX      C3     C4        single      1.500    0.020
 VAX      H3     C3        single      1.099    0.020
 VAX      C7     C6        single      1.524    0.020
 VAX      H6_1   C6        single      1.092    0.020
 VAX      H6_2   C6        single      1.092    0.020
 VAX      C8     C7        single      1.524    0.020
 VAX      C9     C7        single      1.524    0.020
 VAX      H7     C7        single      1.099    0.020
 VAX      H8_1   C8        single      1.059    0.020
 VAX      H8_2   C8        single      1.059    0.020
 VAX      H8_3   C8        single      1.059    0.020
 VAX      H9_1   C9        single      1.059    0.020
 VAX      H9_2   C9        single      1.059    0.020
 VAX      H9_3   C9        single      1.059    0.020
 VAX      O5     C4        double      1.220    0.020
 VAX      C4     N10       single      1.330    0.020
 VAX      N10    C11       single      1.450    0.020
 VAX      HN0    N10       single      1.010    0.020
 VAX      C11    C14       single      1.524    0.020
 VAX      C11    C12       single      1.500    0.020
 VAX      H11    C11       single      1.099    0.020
 VAX      O15    C14       single      1.432    0.020
 VAX      C14    C16       single      1.480    0.020
 VAX      H14    C14       single      1.099    0.020
 VAX      HO5    O15       single      0.967    0.020
 VAX      C16    C17       double      1.390    0.020
 VAX      C16    C18       single      1.390    0.020
 VAX      C17    C19       single      1.390    0.020
 VAX      H17    C17       single      1.083    0.020
 VAX      CL2    C19       single      1.795    0.020
 VAX      C19    C21       double      1.487    0.020
 VAX      C21    O22       single      1.370    0.020
 VAX      C20    C21       single      1.390    0.020
 VAX      O22    C40       single      1.370    0.020
 VAX      C18    C20       double      1.390    0.020
 VAX      H20    C20       single      1.083    0.020
 VAX      H18    C18       single      1.083    0.020
 VAX      O13    C12       double      1.220    0.020
 VAX      C12    N24       single      1.330    0.020
 VAX      N24    C25       single      1.450    0.020
 VAX      HN4    N24       single      1.010    0.020
 VAX      C28    C25       single      1.524    0.020
 VAX      C25    C26       single      1.500    0.020
 VAX      H25    C25       single      1.099    0.020
 VAX      C29    C28       single      1.510    0.020
 VAX      H281   C28       single      1.092    0.020
 VAX      H282   C28       single      1.092    0.020
 VAX      O30    C29       double      1.220    0.020
 VAX      N31    C29       single      1.332    0.020
 VAX      HN11   N31       single      1.010    0.020
 VAX      HN12   N31       single      1.010    0.020
 VAX      O27    C26       double      1.220    0.020
 VAX      C26    N32       single      1.330    0.020
 VAX      N32    C33       single      1.450    0.020
 VAX      HN2    N32       single      1.010    0.020
 VAX      C33    C36       single      1.480    0.020
 VAX      C33    C34       single      1.500    0.020
 VAX      H33    C33       single      1.099    0.020
 VAX      C36    C38       double      1.390    0.020
 VAX      C36    C37       single      1.390    0.020
 VAX      C38    C40       single      1.390    0.020
 VAX      H38    C38       single      1.083    0.020
 VAX      C40    C41       double      1.487    0.020
 VAX      O42    C41       single      1.370    0.020
 VAX      C41    C39       single      1.487    0.020
 VAX      'C1''  O42       single      1.426    0.020
 VAX      C37    C39       double      1.390    0.020
 VAX      C39    O66       single      1.370    0.020
 VAX      H37    C37       single      1.083    0.020
 VAX      O35    C34       double      1.220    0.020
 VAX      C34    N43       single      1.330    0.020
 VAX      N43    C44       single      1.450    0.020
 VAX      HN3    N43       single      1.010    0.020
 VAX      C44    C47       single      1.480    0.020
 VAX      C44    C45       single      1.500    0.020
 VAX      H44    C44       single      1.099    0.020
 VAX      C47    C48       double      1.390    0.020
 VAX      C47    C49       single      1.390    0.020
 VAX      C48    C50       single      1.390    0.020
 VAX      H48    C48       single      1.083    0.020
 VAX      C52    C50       double      1.487    0.020
 VAX      C50    C73       single      1.487    0.020
 VAX      O53    C52       single      1.362    0.020
 VAX      C51    C52       single      1.390    0.020
 VAX      HO3    O53       single      0.967    0.020
 VAX      C49    C51       double      1.390    0.020
 VAX      H51    C51       single      1.083    0.020
 VAX      H49    C49       single      1.083    0.020
 VAX      O46    C45       double      1.220    0.020
 VAX      C45    N54       single      1.330    0.020
 VAX      N54    C55       single      1.450    0.020
 VAX      HN5    N54       single      1.010    0.020
 VAX      C58    C55       single      1.524    0.020
 VAX      C55    C56       single      1.500    0.020
 VAX      H55    C55       single      1.099    0.020
 VAX      O59    C58       single      1.426    0.020
 VAX      C60    C58       single      1.480    0.020
 VAX      H58    C58       single      1.099    0.020
 VAX      C81    O59       single      1.426    0.020
 VAX      C61    C60       double      1.390    0.020
 VAX      C60    C62       single      1.390    0.020
 VAX      C63    C61       single      1.390    0.020
 VAX      H61    C61       single      1.083    0.020
 VAX      C65    C63       double      1.390    0.020
 VAX      H63    C63       single      1.083    0.020
 VAX      O66    C65       single      1.370    0.020
 VAX      C64    C65       single      1.487    0.020
 VAX      CL6    C64       single      1.795    0.020
 VAX      C62    C64       double      1.390    0.020
 VAX      H62    C62       single      1.083    0.020
 VAX      O57    C56       double      1.220    0.020
 VAX      C56    N68       single      1.330    0.020
 VAX      N68    C69       single      1.450    0.020
 VAX      HN8    N68       single      1.010    0.020
 VAX      C72    C69       single      1.480    0.020
 VAX      C69    C70       single      1.500    0.020
 VAX      H69    C69       single      1.099    0.020
 VAX      C73    C72       double      1.487    0.020
 VAX      C72    C74       single      1.390    0.020
 VAX      C75    C73       single      1.487    0.020
 VAX      O79    C75       single      1.362    0.020
 VAX      C76    C75       double      1.390    0.020
 VAX      HO7    O79       single      0.967    0.020
 VAX      C77    C76       single      1.390    0.020
 VAX      H76    C76       single      1.083    0.020
 VAX      O78    C77       single      1.362    0.020
 VAX      C74    C77       double      1.390    0.020
 VAX      HO8    O78       single      0.967    0.020
 VAX      H74    C74       single      1.083    0.020
 VAX      O71    C70       deloc       1.250    0.020
 VAX      C70    O80       deloc       1.250    0.020
 VAX      O82    C81       single      1.426    0.020
 VAX      C81    C90       single      1.524    0.020
 VAX      H81    C81       single      1.099    0.020
 VAX      C83    O82       single      1.426    0.020
 VAX      C84    C83       single      1.524    0.020
 VAX      C85    C83       single      1.524    0.020
 VAX      H83    C83       single      1.099    0.020
 VAX      H841   C84       single      1.059    0.020
 VAX      H842   C84       single      1.059    0.020
 VAX      H843   C84       single      1.059    0.020
 VAX      O86    C85       single      1.432    0.020
 VAX      C87    C85       single      1.524    0.020
 VAX      H85    C85       single      1.099    0.020
 VAX      HO6    O86       single      0.967    0.020
 VAX      N88    C87       single      1.488    0.020
 VAX      C89    C87       single      1.524    0.020
 VAX      C90    C87       single      1.524    0.020
 VAX      HN81   N88       single      1.033    0.020
 VAX      HN82   N88       single      1.033    0.020
 VAX      HN83   N88       single      1.033    0.020
 VAX      H891   C89       single      1.059    0.020
 VAX      H892   C89       single      1.059    0.020
 VAX      H893   C89       single      1.059    0.020
 VAX      H901   C90       single      1.092    0.020
 VAX      H902   C90       single      1.092    0.020
 VAX      'C2''  'C1''     single      1.524    0.020
 VAX      'C1''  'O5''     single      1.426    0.020
 VAX      'H1''  'C1''     single      1.099    0.020
 VAX      'O2''  'C2''     single      1.426    0.020
 VAX      'C3''  'C2''     single      1.524    0.020
 VAX      'H2''  'C2''     single      1.099    0.020
 VAX      C1"    'O2''     single      1.426    0.020
 VAX      'O3''  'C3''     single      1.432    0.020
 VAX      'C4''  'C3''     single      1.524    0.020
 VAX      'H3''  'C3''     single      1.099    0.020
 VAX      'HO3'' 'O3''     single      0.967    0.020
 VAX      'O4''  'C4''     single      1.432    0.020
 VAX      'C5''  'C4''     single      1.524    0.020
 VAX      'H4''  'C4''     single      1.099    0.020
 VAX      'HO4'' 'O4''     single      0.967    0.020
 VAX      'O5''  'C5''     single      1.426    0.020
 VAX      'C6''  'C5''     single      1.524    0.020
 VAX      'H5''  'C5''     single      1.099    0.020
 VAX      'O6''  'C6''     single      1.432    0.020
 VAX      'H6'1' 'C6''     single      1.092    0.020
 VAX      'H6'2' 'C6''     single      1.092    0.020
 VAX      'HO6'' 'O6''     single      0.967    0.020
 VAX      C2"    C1"       single      1.524    0.020
 VAX      C1"    O5"       single      1.426    0.020
 VAX      H1"    C1"       single      1.099    0.020
 VAX      C3"    C2"       single      1.524    0.020
 VAX      H2"1   C2"       single      1.092    0.020
 VAX      H2"2   C2"       single      1.092    0.020
 VAX      N3"    C3"       single      1.488    0.020
 VAX      C3M    C3"       single      1.524    0.020
 VAX      C4"    C3"       single      1.524    0.020
 VAX      HN31   N3"       single      1.033    0.020
 VAX      HN32   N3"       single      1.033    0.020
 VAX      HN33   N3"       single      1.033    0.020
 VAX      H3M1   C3M       single      1.059    0.020
 VAX      H3M2   C3M       single      1.059    0.020
 VAX      H3M3   C3M       single      1.059    0.020
 VAX      O4"    C4"       single      1.432    0.020
 VAX      C5"    C4"       single      1.524    0.020
 VAX      H4"    C4"       single      1.099    0.020
 VAX      HO4"   O4"       single      0.967    0.020
 VAX      O5"    C5"       single      1.426    0.020
 VAX      C5M    C5"       single      1.524    0.020
 VAX      H5"    C5"       single      1.099    0.020
 VAX      H5M1   C5M       single      1.059    0.020
 VAX      H5M2   C5M       single      1.059    0.020
 VAX      H5M3   C5M       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
 VAX      O80    C70    O71     123.000    3.000
 VAX      O80    C70    C69     118.500    3.000
 VAX      O71    C70    C69     118.500    3.000
 VAX      C70    C69    H69     108.810    3.000
 VAX      C70    C69    C72     109.500    3.000
 VAX      C70    C69    N68     111.600    3.000
 VAX      H69    C69    C72     109.470    3.000
 VAX      H69    C69    N68     108.550    3.000
 VAX      C72    C69    N68     109.470    3.000
 VAX      C69    C72    C73     120.000    3.000
 VAX      C69    C72    C74     120.000    3.000
 VAX      C73    C72    C74     120.000    3.000
 VAX      C72    C73    C75     120.000    3.000
 VAX      C72    C73    C50     120.000    3.000
 VAX      C75    C73    C50     120.000    3.000
 VAX      C73    C75    C76     120.000    3.000
 VAX      C73    C75    O79     120.000    3.000
 VAX      C76    C75    O79     120.000    3.000
 VAX      C75    C76    H76     120.000    3.000
 VAX      C75    C76    C77     120.000    3.000
 VAX      H76    C76    C77     120.000    3.000
 VAX      C76    C77    C74     120.000    3.000
 VAX      C76    C77    O78     120.000    3.000
 VAX      C74    C77    O78     120.000    3.000
 VAX      C77    C74    H74     120.000    3.000
 VAX      C77    C74    C72     120.000    3.000
 VAX      H74    C74    C72     120.000    3.000
 VAX      C77    O78    HO8     109.470    3.000
 VAX      C75    O79    HO7     109.470    3.000
 VAX      C73    C50    C52     120.000    3.000
 VAX      C73    C50    C48     120.000    3.000
 VAX      C52    C50    C48     120.000    3.000
 VAX      C50    C52    C51     120.000    3.000
 VAX      C50    C52    O53     120.000    3.000
 VAX      C51    C52    O53     120.000    3.000
 VAX      C52    C51    H51     120.000    3.000
 VAX      C52    C51    C49     120.000    3.000
 VAX      H51    C51    C49     120.000    3.000
 VAX      C51    C49    H49     120.000    3.000
 VAX      C51    C49    C47     120.000    3.000
 VAX      H49    C49    C47     120.000    3.000
 VAX      C52    O53    HO3     109.470    3.000
 VAX      C50    C48    H48     120.000    3.000
 VAX      C50    C48    C47     120.000    3.000
 VAX      H48    C48    C47     120.000    3.000
 VAX      C48    C47    C44     120.000    3.000
 VAX      C48    C47    C49     120.000    3.000
 VAX      C44    C47    C49     120.000    3.000
 VAX      C69    N68    HN8     118.500    3.000
 VAX      C69    N68    C56     121.500    3.000
 VAX      HN8    N68    C56     120.000    3.000
 VAX      N68    C56    O57     123.000    3.000
 VAX      N68    C56    C55     116.500    3.000
 VAX      O57    C56    C55     120.500    3.000
 VAX      C56    C55    H55     108.810    3.000
 VAX      C56    C55    C58     109.470    3.000
 VAX      C56    C55    N54     111.600    3.000
 VAX      H55    C55    C58     108.340    3.000
 VAX      H55    C55    N54     108.550    3.000
 VAX      C58    C55    N54     110.000    3.000
 VAX      C55    C58    H58     108.340    3.000
 VAX      C55    C58    O59     109.470    3.000
 VAX      C55    C58    C60     109.470    3.000
 VAX      H58    C58    O59     109.470    3.000
 VAX      H58    C58    C60     109.470    3.000
 VAX      O59    C58    C60     109.470    3.000
 VAX      C58    O59    C81     111.800    3.000
 VAX      O59    C81    H81     109.470    3.000
 VAX      O59    C81    O82     109.470    3.000
 VAX      O59    C81    C90     109.470    3.000
 VAX      H81    C81    O82     109.470    3.000
 VAX      H81    C81    C90     108.340    3.000
 VAX      O82    C81    C90     109.470    3.000
 VAX      C81    O82    C83     111.800    3.000
 VAX      O82    C83    H83     109.470    3.000
 VAX      O82    C83    C85     109.470    3.000
 VAX      O82    C83    C84     109.470    3.000
 VAX      H83    C83    C85     108.340    3.000
 VAX      H83    C83    C84     108.340    3.000
 VAX      C85    C83    C84     111.000    3.000
 VAX      C83    C85    H85     108.340    3.000
 VAX      C83    C85    C87     111.000    3.000
 VAX      C83    C85    O86     109.470    3.000
 VAX      H85    C85    C87     108.340    3.000
 VAX      H85    C85    O86     109.470    3.000
 VAX      C87    C85    O86     109.470    3.000
 VAX      C85    C87    C90     111.000    3.000
 VAX      C85    C87    C89     111.000    3.000
 VAX      C85    C87    N88     110.000    3.000
 VAX      C90    C87    C89     111.000    3.000
 VAX      C90    C87    N88     110.000    3.000
 VAX      C89    C87    N88     110.000    3.000
 VAX      C87    C90    H902    109.470    3.000
 VAX      C87    C90    H901    109.470    3.000
 VAX      C87    C90    C81     111.000    3.000
 VAX      H902   C90    H901    107.900    3.000
 VAX      H902   C90    C81     109.470    3.000
 VAX      H901   C90    C81     109.470    3.000
 VAX      C87    C89    H893    109.470    3.000
 VAX      C87    C89    H892    109.470    3.000
 VAX      C87    C89    H891    109.470    3.000
 VAX      H893   C89    H892    109.470    3.000
 VAX      H893   C89    H891    109.470    3.000
 VAX      H892   C89    H891    109.470    3.000
 VAX      C87    N88    HN83    109.470    3.000
 VAX      C87    N88    HN82    109.470    3.000
 VAX      C87    N88    HN81    109.470    3.000
 VAX      HN83   N88    HN82    109.470    3.000
 VAX      HN83   N88    HN81    109.470    3.000
 VAX      HN82   N88    HN81    109.470    3.000
 VAX      C85    O86    HO6     109.470    3.000
 VAX      C83    C84    H843    109.470    3.000
 VAX      C83    C84    H842    109.470    3.000
 VAX      C83    C84    H841    109.470    3.000
 VAX      H843   C84    H842    109.470    3.000
 VAX      H843   C84    H841    109.470    3.000
 VAX      H842   C84    H841    109.470    3.000
 VAX      C58    C60    C61     120.000    3.000
 VAX      C58    C60    C62     120.000    3.000
 VAX      C61    C60    C62     120.000    3.000
 VAX      C60    C61    H61     120.000    3.000
 VAX      C60    C61    C63     120.000    3.000
 VAX      H61    C61    C63     120.000    3.000
 VAX      C61    C63    H63     120.000    3.000
 VAX      C61    C63    C65     120.000    3.000
 VAX      H63    C63    C65     120.000    3.000
 VAX      C63    C65    C64     120.000    3.000
 VAX      C63    C65    O66     120.000    3.000
 VAX      C64    C65    O66     120.000    3.000
 VAX      C65    C64    C62     120.000    3.000
 VAX      C65    C64    CL6     120.000    3.000
 VAX      C62    C64    CL6     120.000    3.000
 VAX      C64    C62    H62     120.000    3.000
 VAX      C64    C62    C60     120.000    3.000
 VAX      H62    C62    C60     120.000    3.000
 VAX      C65    O66    C39     120.000    3.000
 VAX      O66    C39    C37     120.000    3.000
 VAX      O66    C39    C41     120.000    3.000
 VAX      C37    C39    C41     120.000    3.000
 VAX      C39    C37    H37     120.000    3.000
 VAX      C39    C37    C36     120.000    3.000
 VAX      H37    C37    C36     120.000    3.000
 VAX      C39    C41    O42     120.000    3.000
 VAX      C39    C41    C40     120.000    3.000
 VAX      O42    C41    C40     120.000    3.000
 VAX      C41    O42    'C1''   120.000    3.000
 VAX      O42    'C1''  'H1''   109.470    3.000
 VAX      O42    'C1''  'C2''   109.470    3.000
 VAX      O42    'C1''  'O5''   109.470    3.000
 VAX      'H1''  'C1''  'C2''   108.340    3.000
 VAX      'H1''  'C1''  'O5''   109.470    3.000
 VAX      'C2''  'C1''  'O5''   109.470    3.000
 VAX      'C1''  'C2''  'H2''   108.340    3.000
 VAX      'C1''  'C2''  'C3''   111.000    3.000
 VAX      'C1''  'C2''  'O2''   109.470    3.000
 VAX      'H2''  'C2''  'C3''   108.340    3.000
 VAX      'H2''  'C2''  'O2''   109.470    3.000
 VAX      'C3''  'C2''  'O2''   109.470    3.000
 VAX      'C2''  'C3''  'H3''   108.340    3.000
 VAX      'C2''  'C3''  'C4''   111.000    3.000
 VAX      'C2''  'C3''  'O3''   109.470    3.000
 VAX      'H3''  'C3''  'C4''   108.340    3.000
 VAX      'H3''  'C3''  'O3''   109.470    3.000
 VAX      'C4''  'C3''  'O3''   109.470    3.000
 VAX      'C3''  'C4''  'H4''   108.340    3.000
 VAX      'C3''  'C4''  'C5''   111.000    3.000
 VAX      'C3''  'C4''  'O4''   109.470    3.000
 VAX      'H4''  'C4''  'C5''   108.340    3.000
 VAX      'H4''  'C4''  'O4''   109.470    3.000
 VAX      'C5''  'C4''  'O4''   109.470    3.000
 VAX      'C4''  'C5''  'H5''   108.340    3.000
 VAX      'C4''  'C5''  'C6''   111.000    3.000
 VAX      'C4''  'C5''  'O5''   109.470    3.000
 VAX      'H5''  'C5''  'C6''   108.340    3.000
 VAX      'H5''  'C5''  'O5''   109.470    3.000
 VAX      'C6''  'C5''  'O5''   109.470    3.000
 VAX      'C5''  'C6''  'H6'1'  109.470    3.000
 VAX      'C5''  'C6''  'H6'2'  109.470    3.000
 VAX      'C5''  'C6''  'O6''   109.470    3.000
 VAX      'H6'1' 'C6''  'H6'2'  107.900    3.000
 VAX      'H6'1' 'C6''  'O6''   109.470    3.000
 VAX      'H6'2' 'C6''  'O6''   109.470    3.000
 VAX      'C6''  'O6''  'HO6''  109.470    3.000
 VAX      'C5''  'O5''  'C1''   111.800    3.000
 VAX      'C4''  'O4''  'HO4''  109.470    3.000
 VAX      'C3''  'O3''  'HO3''  109.470    3.000
 VAX      'C2''  'O2''  C1"     111.800    3.000
 VAX      'O2''  C1"    H1"     109.470    3.000
 VAX      'O2''  C1"    C2"     109.470    3.000
 VAX      'O2''  C1"    O5"     109.470    3.000
 VAX      H1"    C1"    C2"     108.340    3.000
 VAX      H1"    C1"    O5"     109.470    3.000
 VAX      C2"    C1"    O5"     109.470    3.000
 VAX      C1"    C2"    H2"1    109.470    3.000
 VAX      C1"    C2"    H2"2    109.470    3.000
 VAX      C1"    C2"    C3"     111.000    3.000
 VAX      H2"1   C2"    H2"2    107.900    3.000
 VAX      H2"1   C2"    C3"     109.470    3.000
 VAX      H2"2   C2"    C3"     109.470    3.000
 VAX      C2"    C3"    C4"     111.000    3.000
 VAX      C2"    C3"    C3M     111.000    3.000
 VAX      C2"    C3"    N3"     110.000    3.000
 VAX      C4"    C3"    C3M     111.000    3.000
 VAX      C4"    C3"    N3"     110.000    3.000
 VAX      C3M    C3"    N3"     110.000    3.000
 VAX      C3"    C4"    H4"     108.340    3.000
 VAX      C3"    C4"    C5"     111.000    3.000
 VAX      C3"    C4"    O4"     109.470    3.000
 VAX      H4"    C4"    C5"     108.340    3.000
 VAX      H4"    C4"    O4"     109.470    3.000
 VAX      C5"    C4"    O4"     109.470    3.000
 VAX      C4"    C5"    H5"     108.340    3.000
 VAX      C4"    C5"    C5M     111.000    3.000
 VAX      C4"    C5"    O5"     109.470    3.000
 VAX      H5"    C5"    C5M     108.340    3.000
 VAX      H5"    C5"    O5"     109.470    3.000
 VAX      C5M    C5"    O5"     109.470    3.000
 VAX      C5"    C5M    H5M3    109.470    3.000
 VAX      C5"    C5M    H5M2    109.470    3.000
 VAX      C5"    C5M    H5M1    109.470    3.000
 VAX      H5M3   C5M    H5M2    109.470    3.000
 VAX      H5M3   C5M    H5M1    109.470    3.000
 VAX      H5M2   C5M    H5M1    109.470    3.000
 VAX      C5"    O5"    C1"     111.800    3.000
 VAX      C4"    O4"    HO4"    109.470    3.000
 VAX      C3"    C3M    H3M3    109.470    3.000
 VAX      C3"    C3M    H3M2    109.470    3.000
 VAX      C3"    C3M    H3M1    109.470    3.000
 VAX      H3M3   C3M    H3M2    109.470    3.000
 VAX      H3M3   C3M    H3M1    109.470    3.000
 VAX      H3M2   C3M    H3M1    109.470    3.000
 VAX      C3"    N3"    HN33    109.470    3.000
 VAX      C3"    N3"    HN32    109.470    3.000
 VAX      C3"    N3"    HN31    109.470    3.000
 VAX      HN33   N3"    HN32    109.470    3.000
 VAX      HN33   N3"    HN31    109.470    3.000
 VAX      HN32   N3"    HN31    109.470    3.000
 VAX      C41    C40    C38     120.000    3.000
 VAX      C41    C40    O22     120.000    3.000
 VAX      C38    C40    O22     120.000    3.000
 VAX      C40    C38    H38     120.000    3.000
 VAX      C40    C38    C36     120.000    3.000
 VAX      H38    C38    C36     120.000    3.000
 VAX      C38    C36    C33     120.000    3.000
 VAX      C38    C36    C37     120.000    3.000
 VAX      C33    C36    C37     120.000    3.000
 VAX      C40    O22    C21     120.000    3.000
 VAX      O22    C21    C20     120.000    3.000
 VAX      O22    C21    C19     120.000    3.000
 VAX      C20    C21    C19     120.000    3.000
 VAX      C21    C20    H20     120.000    3.000
 VAX      C21    C20    C18     120.000    3.000
 VAX      H20    C20    C18     120.000    3.000
 VAX      C20    C18    H18     120.000    3.000
 VAX      C20    C18    C16     120.000    3.000
 VAX      H18    C18    C16     120.000    3.000
 VAX      C21    C19    CL2     120.000    3.000
 VAX      C21    C19    C17     120.000    3.000
 VAX      CL2    C19    C17     120.000    3.000
 VAX      C19    C17    H17     120.000    3.000
 VAX      C19    C17    C16     120.000    3.000
 VAX      H17    C17    C16     120.000    3.000
 VAX      C17    C16    C14     120.000    3.000
 VAX      C17    C16    C18     120.000    3.000
 VAX      C14    C16    C18     120.000    3.000
 VAX      C16    C14    H14     109.470    3.000
 VAX      C16    C14    O15     109.470    3.000
 VAX      C16    C14    C11     109.470    3.000
 VAX      H14    C14    O15     109.470    3.000
 VAX      H14    C14    C11     108.340    3.000
 VAX      O15    C14    C11     109.470    3.000
 VAX      C14    O15    HO5     109.470    3.000
 VAX      C55    N54    HN5     118.500    3.000
 VAX      C55    N54    C45     121.500    3.000
 VAX      HN5    N54    C45     120.000    3.000
 VAX      N54    C45    O46     123.000    3.000
 VAX      N54    C45    C44     116.500    3.000
 VAX      O46    C45    C44     120.500    3.000
 VAX      C45    C44    H44     108.810    3.000
 VAX      C45    C44    N43     111.600    3.000
 VAX      C45    C44    C47     109.500    3.000
 VAX      H44    C44    N43     108.550    3.000
 VAX      H44    C44    C47     109.470    3.000
 VAX      N43    C44    C47     109.470    3.000
 VAX      C44    N43    HN3     118.500    3.000
 VAX      C44    N43    C34     121.500    3.000
 VAX      HN3    N43    C34     120.000    3.000
 VAX      N43    C34    O35     123.000    3.000
 VAX      N43    C34    C33     116.500    3.000
 VAX      O35    C34    C33     120.500    3.000
 VAX      C34    C33    H33     108.810    3.000
 VAX      C34    C33    N32     111.600    3.000
 VAX      C34    C33    C36     109.500    3.000
 VAX      H33    C33    N32     108.550    3.000
 VAX      H33    C33    C36     109.470    3.000
 VAX      N32    C33    C36     109.470    3.000
 VAX      C33    N32    HN2     118.500    3.000
 VAX      C33    N32    C26     121.500    3.000
 VAX      HN2    N32    C26     120.000    3.000
 VAX      N32    C26    O27     123.000    3.000
 VAX      N32    C26    C25     116.500    3.000
 VAX      O27    C26    C25     120.500    3.000
 VAX      C26    C25    H25     108.810    3.000
 VAX      C26    C25    C28     109.470    3.000
 VAX      C26    C25    N24     111.600    3.000
 VAX      H25    C25    C28     108.340    3.000
 VAX      H25    C25    N24     108.550    3.000
 VAX      C28    C25    N24     110.000    3.000
 VAX      C25    C28    H281    109.470    3.000
 VAX      C25    C28    H282    109.470    3.000
 VAX      C25    C28    C29     109.470    3.000
 VAX      H281   C28    H282    107.900    3.000
 VAX      H281   C28    C29     109.470    3.000
 VAX      H282   C28    C29     109.470    3.000
 VAX      C28    C29    N31     116.500    3.000
 VAX      C28    C29    O30     120.500    3.000
 VAX      N31    C29    O30     123.000    3.000
 VAX      C29    N31    HN12    120.000    3.000
 VAX      C29    N31    HN11    120.000    3.000
 VAX      HN12   N31    HN11    120.000    3.000
 VAX      C25    N24    HN4     118.500    3.000
 VAX      C25    N24    C12     121.500    3.000
 VAX      HN4    N24    C12     120.000    3.000
 VAX      N24    C12    O13     123.000    3.000
 VAX      N24    C12    C11     116.500    3.000
 VAX      O13    C12    C11     120.500    3.000
 VAX      C12    C11    H11     108.810    3.000
 VAX      C12    C11    N10     111.600    3.000
 VAX      C12    C11    C14     109.470    3.000
 VAX      H11    C11    N10     108.550    3.000
 VAX      H11    C11    C14     108.340    3.000
 VAX      N10    C11    C14     110.000    3.000
 VAX      C11    N10    HN0     118.500    3.000
 VAX      C11    N10    C4      121.500    3.000
 VAX      HN0    N10    C4      120.000    3.000
 VAX      N10    C4     O5      123.000    3.000
 VAX      N10    C4     C3      116.500    3.000
 VAX      O5     C4     C3      120.500    3.000
 VAX      C4     C3     H3      108.810    3.000
 VAX      C4     C3     N2      109.500    3.000
 VAX      C4     C3     C6      109.470    3.000
 VAX      H3     C3     N2      109.500    3.000
 VAX      H3     C3     C6      108.340    3.000
 VAX      N2     C3     C6      109.500    3.000
 VAX      C3     N2     HN21    109.500    3.000
 VAX      C3     N2     HN22    109.500    3.000
 VAX      C3     N2     C1      109.500    3.000
 VAX      HN21   N2     HN22    109.500    3.000
 VAX      HN21   N2     C1      109.500    3.000
 VAX      HN22   N2     C1      109.500    3.000
 VAX      N2     C1     H1_3    109.500    3.000
 VAX      N2     C1     H1_2    109.500    3.000
 VAX      N2     C1     H1_1    109.500    3.000
 VAX      H1_3   C1     H1_2    109.470    3.000
 VAX      H1_3   C1     H1_1    109.470    3.000
 VAX      H1_2   C1     H1_1    109.470    3.000
 VAX      C3     C6     H6_1    109.470    3.000
 VAX      C3     C6     H6_2    109.470    3.000
 VAX      C3     C6     C7      111.000    3.000
 VAX      H6_1   C6     H6_2    107.900    3.000
 VAX      H6_1   C6     C7      109.470    3.000
 VAX      H6_2   C6     C7      109.470    3.000
 VAX      C6     C7     H7      108.340    3.000
 VAX      C6     C7     C9      111.000    3.000
 VAX      C6     C7     C8      111.000    3.000
 VAX      H7     C7     C9      108.340    3.000
 VAX      H7     C7     C8      108.340    3.000
 VAX      C9     C7     C8      111.000    3.000
 VAX      C7     C9     H9_3    109.470    3.000
 VAX      C7     C9     H9_2    109.470    3.000
 VAX      C7     C9     H9_1    109.470    3.000
 VAX      H9_3   C9     H9_2    109.470    3.000
 VAX      H9_3   C9     H9_1    109.470    3.000
 VAX      H9_2   C9     H9_1    109.470    3.000
 VAX      C7     C8     H8_3    109.470    3.000
 VAX      C7     C8     H8_2    109.470    3.000
 VAX      C7     C8     H8_1    109.470    3.000
 VAX      H8_3   C8     H8_2    109.470    3.000
 VAX      H8_3   C8     H8_1    109.470    3.000
 VAX      H8_2   C8     H8_1    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
 VAX      var_1    O80    C70    C69    N68      -45.103   20.000   3
 VAX      var_2    C70    C69    C72    C73     -177.980   20.000   1
 VAX      CONST_1  C69    C72    C74    C77      180.000    0.000   0
 VAX      CONST_2  C69    C72    C73    C50        0.000    0.000   0
 VAX      CONST_3  C72    C73    C75    O79      180.000    0.000   0
 VAX      CONST_4  C73    C75    C76    C77        0.000    0.000   0
 VAX      CONST_5  C75    C76    C77    O78      180.000    0.000   0
 VAX      CONST_6  C76    C77    C74    C72        0.000    0.000   0
 VAX      var_3    C76    C77    O78    HO8      179.937   20.000   1
 VAX      var_4    C73    C75    O79    HO7      179.774   20.000   1
 VAX      CONST_7  C72    C73    C50    C48        0.000    0.000   0
 VAX      CONST_8  C73    C50    C52    O53        0.000    0.000   0
 VAX      CONST_9  C50    C52    C51    C49        0.000    0.000   0
 VAX      CONST_10 C52    C51    C49    C47        0.000    0.000   0
 VAX      var_5    C50    C52    O53    HO3       -0.048   20.000   1
 VAX      CONST_11 C73    C50    C48    C47      180.000    0.000   0
 VAX      CONST_12 C50    C48    C47    C44      180.000    0.000   0
 VAX      CONST_13 C48    C47    C49    C51        0.000    0.000   0
 VAX      var_6    C70    C69    N68    C56      -84.093   20.000   3
 VAX      CONST_14 C69    N68    C56    C55      180.000    0.000   0
 VAX      var_7    N68    C56    C55    N54      129.992   20.000   3
 VAX      var_8    C56    C55    C58    C60      163.056   20.000   3
 VAX      var_9    C55    C58    O59    C81      168.626   20.000   1
 VAX      var_10   C58    O59    C81    O82      -50.583   20.000   1
 VAX      var_11   O59    C81    C90    C87       60.000   20.000   3
 VAX      var_12   O59    C81    O82    C83      -60.000   20.000   1
 VAX      var_13   C81    O82    C83    C84      180.000   20.000   1
 VAX      var_14   O82    C83    C85    O86      180.000   20.000   3
 VAX      var_15   C83    C85    C87    N88      180.000   20.000   1
 VAX      var_16   C85    C87    C90    C81       60.000   20.000   1
 VAX      var_17   C85    C87    C89    H891     -67.095   20.000   1
 VAX      var_18   C85    C87    N88    HN81    -179.699   20.000   1
 VAX      var_19   C83    C85    O86    HO6      144.316   20.000   1
 VAX      var_20   O82    C83    C84    H841     -60.174   20.000   3
 VAX      var_21   C55    C58    C60    C61      109.130   20.000   1
 VAX      CONST_15 C58    C60    C62    C64      180.000    0.000   0
 VAX      CONST_16 C58    C60    C61    C63      180.000    0.000   0
 VAX      CONST_17 C60    C61    C63    C65        0.000    0.000   0
 VAX      CONST_18 C61    C63    C65    O66      180.000    0.000   0
 VAX      CONST_19 C63    C65    C64    CL6      180.000    0.000   0
 VAX      CONST_20 C65    C64    C62    C60        0.000    0.000   0
 VAX      var_22   C63    C65    O66    C39     -109.745   20.000   1
 VAX      var_23   C65    O66    C39    C41     -174.971   20.000   1
 VAX      CONST_21 O66    C39    C37    C36      180.000    0.000   0
 VAX      CONST_22 O66    C39    C41    C40      180.000    0.000   0
 VAX      var_24   C39    C41    O42    'C1''    113.211   20.000   1
 VAX      var_25   C41    O42    'C1''  'C2''    170.854   20.000   1
 VAX      var_26   O42    'C1''  'O5''  'C5''    180.000   20.000   1
 VAX      var_27   O42    'C1''  'C2''  'O2''    -60.000   20.000   3
 VAX      var_28   'C1''  'C2''  'C3''  'O3''    180.000   20.000   3
 VAX      var_29   'C2''  'C3''  'C4''  'O4''    180.000   20.000   3
 VAX      var_30   'C3''  'C4''  'C5''  'O5''    -60.000   20.000   3
 VAX      var_31   'C4''  'C5''  'C6''  'O6''     56.771   20.000   3
 VAX      var_32   'C5''  'C6''  'O6''  'HO6''   179.405   20.000   1
 VAX      var_33   'C4''  'C5''  'O5''  'C1''     60.000   20.000   1
 VAX      var_34   'C3''  'C4''  'O4''  'HO4''    92.389   20.000   1
 VAX      var_35   'C2''  'C3''  'O3''  'HO3''  -144.901   20.000   1
 VAX      var_36   'C1''  'C2''  'O2''  C1"      126.912   20.000   1
 VAX      var_37   'C2''  'O2''  C1"    C2"      136.210   20.000   1
 VAX      var_38   'O2''  C1"    O5"    C5"      -60.000   20.000   1
 VAX      var_39   'O2''  C1"    C2"    C3"       60.000   20.000   3
 VAX      var_40   C1"    C2"    C3"    N3"      180.000   20.000   1
 VAX      var_41   C2"    C3"    C4"    O4"      180.000   20.000   1
 VAX      var_42   C3"    C4"    C5"    O5"       60.000   20.000   3
 VAX      var_43   C4"    C5"    C5M    H5M1      63.972   20.000   3
 VAX      var_44   C4"    C5"    O5"    C1"      -60.000   20.000   1
 VAX      var_45   C3"    C4"    O4"    HO4"     -93.886   20.000   1
 VAX      var_46   C2"    C3"    C3M    H3M1     -54.844   20.000   1
 VAX      var_47   C2"    C3"    N3"    HN31      60.867   20.000   1
 VAX      CONST_23 C39    C41    C40    O22      180.000    0.000   0
 VAX      CONST_24 C41    C40    C38    C36        0.000    0.000   0
 VAX      CONST_25 C40    C38    C36    C33      180.000    0.000   0
 VAX      CONST_26 C38    C36    C37    C39        0.000    0.000   0
 VAX      var_48   C41    C40    O22    C21      155.294   20.000   1
 VAX      var_49   C40    O22    C21    C19      109.409   20.000   1
 VAX      CONST_27 O22    C21    C20    C18      180.000    0.000   0
 VAX      CONST_28 C21    C20    C18    C16        0.000    0.000   0
 VAX      CONST_29 O22    C21    C19    C17      180.000    0.000   0
 VAX      CONST_30 C21    C19    C17    C16        0.000    0.000   0
 VAX      CONST_31 C19    C17    C16    C14      180.000    0.000   0
 VAX      CONST_32 C17    C16    C18    C20        0.000    0.000   0
 VAX      var_50   C17    C16    C14    O15      121.057   20.000   1
 VAX      var_51   C16    C14    O15    HO5       53.333   20.000   1
 VAX      var_52   C56    C55    N54    C45      -99.465   20.000   3
 VAX      CONST_33 C55    N54    C45    C44        0.000    0.000   0
 VAX      var_53   N54    C45    C44    N43     -141.068   20.000   3
 VAX      var_54   C45    C44    C47    C48     -109.337   20.000   1
 VAX      var_55   C45    C44    N43    C34      174.621   20.000   3
 VAX      CONST_34 C44    N43    C34    C33      180.000    0.000   0
 VAX      var_56   N43    C34    C33    N32     -149.473   20.000   3
 VAX      var_57   C34    C33    C36    C38      156.049   20.000   1
 VAX      var_58   C34    C33    N32    C26      148.047   20.000   3
 VAX      CONST_35 C33    N32    C26    C25      180.000    0.000   0
 VAX      var_59   N32    C26    C25    N24      -74.529   20.000   3
 VAX      var_60   C26    C25    C28    C29     -178.392   20.000   3
 VAX      var_61   C25    C28    C29    O30      -68.650   20.000   3
 VAX      CONST_36 C28    C29    N31    HN11       0.000    0.000   0
 VAX      var_62   C26    C25    N24    C12     -138.881   20.000   3
 VAX      CONST_37 C25    N24    C12    C11      180.000    0.000   0
 VAX      var_63   N24    C12    C11    N10       27.816   20.000   3
 VAX      var_64   C12    C11    C14    C16       60.621   20.000   3
 VAX      var_65   C12    C11    N10    C4       118.204   20.000   3
 VAX      CONST_38 C11    N10    C4     C3       180.000    0.000   0
 VAX      var_66   N10    C4     C3     C6       109.065   20.000   3
 VAX      var_67   C4     C3     N2     C1        59.283   20.000   1
 VAX      var_68   C3     N2     C1     H1_1     -59.955   20.000   1
 VAX      var_69   C4     C3     C6     C7      -176.194   20.000   3
 VAX      var_70   C3     C6     C7     C8        60.324   20.000   3
 VAX      var_71   C6     C7     C9     H9_1      58.488   20.000   3
 VAX      var_72   C6     C7     C8     H8_1    -177.937   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
 VAX      chir_01  C3     N2     C6     C4        positiv
 VAX      chir_02  C7     C6     C8     C9        negativ
 VAX      chir_03  C11    N10    C14    C12       positiv
 VAX      chir_04  C14    C11    O15    C16       positiv
 VAX      chir_05  C25    N24    C28    C26       negativ
 VAX      chir_06  C33    N32    C36    C34       positiv
 VAX      chir_07  C44    N43    C47    C45       positiv
 VAX      chir_08  C55    N54    C58    C56       negativ
 VAX      chir_09  C58    C55    O59    C60       positiv
 VAX      chir_10  C69    N68    C72    C70       negativ
 VAX      chir_11  C81    O59    O82    C90       positiv
 VAX      chir_12  C83    O82    C84    C85       negativ
 VAX      chir_13  C85    C83    O86    C87       positiv
 VAX      chir_14  C87    C85    N88    C89       positiv
 VAX      chir_15  'C1''  O42    'C2''  'O5''     negativ
 VAX      chir_16  'C2''  'C1''  'O2''  'C3''     positiv
 VAX      chir_17  'C3''  'C2''  'O3''  'C4''     negativ
 VAX      chir_18  'C4''  'C3''  'O4''  'C5''     positiv
 VAX      chir_19  'C5''  'C4''  'O5''  'C6''     positiv
 VAX      chir_20  C1"    'O2''  C2"    O5"       negativ
 VAX      chir_21  C3"    C2"    N3"    C3M       negativ
 VAX      chir_22  C4"    C3"    O4"    C5"       negativ
 VAX      chir_23  C5"    C4"    O5"    C5M       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
 VAX      plan-1    C4        0.020
 VAX      plan-1    C3        0.020
 VAX      plan-1    O5        0.020
 VAX      plan-1    N10       0.020
 VAX      plan-1    HN0       0.020
 VAX      plan-2    N10       0.020
 VAX      plan-2    C4        0.020
 VAX      plan-2    C11       0.020
 VAX      plan-2    HN0       0.020
 VAX      plan-3    C16       0.020
 VAX      plan-3    C14       0.020
 VAX      plan-3    C17       0.020
 VAX      plan-3    C18       0.020
 VAX      plan-3    C19       0.020
 VAX      plan-3    C21       0.020
 VAX      plan-3    C20       0.020
 VAX      plan-3    H17       0.020
 VAX      plan-3    CL2       0.020
 VAX      plan-3    O22       0.020
 VAX      plan-3    H20       0.020
 VAX      plan-3    H18       0.020
 VAX      plan-4    C12       0.020
 VAX      plan-4    C11       0.020
 VAX      plan-4    O13       0.020
 VAX      plan-4    N24       0.020
 VAX      plan-4    HN4       0.020
 VAX      plan-5    N24       0.020
 VAX      plan-5    C12       0.020
 VAX      plan-5    C25       0.020
 VAX      plan-5    HN4       0.020
 VAX      plan-6    C29       0.020
 VAX      plan-6    C28       0.020
 VAX      plan-6    O30       0.020
 VAX      plan-6    N31       0.020
 VAX      plan-6    HN12      0.020
 VAX      plan-6    HN11      0.020
 VAX      plan-7    N31       0.020
 VAX      plan-7    C29       0.020
 VAX      plan-7    HN11      0.020
 VAX      plan-7    HN12      0.020
 VAX      plan-8    C26       0.020
 VAX      plan-8    C25       0.020
 VAX      plan-8    O27       0.020
 VAX      plan-8    N32       0.020
 VAX      plan-8    HN2       0.020
 VAX      plan-9    N32       0.020
 VAX      plan-9    C26       0.020
 VAX      plan-9    C33       0.020
 VAX      plan-9    HN2       0.020
 VAX      plan-10   C36       0.020
 VAX      plan-10   C33       0.020
 VAX      plan-10   C38       0.020
 VAX      plan-10   C37       0.020
 VAX      plan-10   C40       0.020
 VAX      plan-10   C41       0.020
 VAX      plan-10   C39       0.020
 VAX      plan-10   H38       0.020
 VAX      plan-10   O22       0.020
 VAX      plan-10   O42       0.020
 VAX      plan-10   O66       0.020
 VAX      plan-10   H37       0.020
 VAX      plan-11   C34       0.020
 VAX      plan-11   C33       0.020
 VAX      plan-11   O35       0.020
 VAX      plan-11   N43       0.020
 VAX      plan-11   HN3       0.020
 VAX      plan-12   N43       0.020
 VAX      plan-12   C34       0.020
 VAX      plan-12   C44       0.020
 VAX      plan-12   HN3       0.020
 VAX      plan-13   C47       0.020
 VAX      plan-13   C44       0.020
 VAX      plan-13   C48       0.020
 VAX      plan-13   C49       0.020
 VAX      plan-13   C50       0.020
 VAX      plan-13   C52       0.020
 VAX      plan-13   C51       0.020
 VAX      plan-13   H48       0.020
 VAX      plan-13   C73       0.020
 VAX      plan-13   O53       0.020
 VAX      plan-13   H51       0.020
 VAX      plan-13   H49       0.020
 VAX      plan-14   C45       0.020
 VAX      plan-14   C44       0.020
 VAX      plan-14   O46       0.020
 VAX      plan-14   N54       0.020
 VAX      plan-14   HN5       0.020
 VAX      plan-15   N54       0.020
 VAX      plan-15   C45       0.020
 VAX      plan-15   C55       0.020
 VAX      plan-15   HN5       0.020
 VAX      plan-16   C60       0.020
 VAX      plan-16   C58       0.020
 VAX      plan-16   C61       0.020
 VAX      plan-16   C62       0.020
 VAX      plan-16   C63       0.020
 VAX      plan-16   C65       0.020
 VAX      plan-16   C64       0.020
 VAX      plan-16   H61       0.020
 VAX      plan-16   H63       0.020
 VAX      plan-16   O66       0.020
 VAX      plan-16   CL6       0.020
 VAX      plan-16   H62       0.020
 VAX      plan-17   C56       0.020
 VAX      plan-17   C55       0.020
 VAX      plan-17   O57       0.020
 VAX      plan-17   N68       0.020
 VAX      plan-17   HN8       0.020
 VAX      plan-18   N68       0.020
 VAX      plan-18   C56       0.020
 VAX      plan-18   C69       0.020
 VAX      plan-18   HN8       0.020
 VAX      plan-19   C72       0.020
 VAX      plan-19   C69       0.020
 VAX      plan-19   C73       0.020
 VAX      plan-19   C74       0.020
 VAX      plan-19   C75       0.020
 VAX      plan-19   C76       0.020
 VAX      plan-19   C77       0.020
 VAX      plan-19   C50       0.020
 VAX      plan-19   O79       0.020
 VAX      plan-19   H76       0.020
 VAX      plan-19   O78       0.020
 VAX      plan-19   H74       0.020
 VAX      plan-20   C70       0.020
 VAX      plan-20   C69       0.020
 VAX      plan-20   O71       0.020
 VAX      plan-20   O80       0.020
