$coord  natoms=    38
  -10.44077073765865     -1.54339597878388     -2.19220241800962      c
  -11.39651686077736     -2.46027740409016      0.00000000000000      c
   -4.93005426761187      2.50823934561160      0.00000000000000      c
  -10.44077073765865     -1.54339597878388      2.19220241800962      c
  -10.97813979671898     -2.48543192734691      4.08078861003084      h
   -8.35188518828260      0.04555380459367     -2.18654241068246      c
   -8.35188518828260      0.04555380459367      2.18654241068246      c
   -7.28360202490595      0.29919873991014      4.07663317738460      h
  -10.97813979671898     -2.48543192734691     -4.08078861003084      h
   -7.18968063512488      0.73731852997515      0.00000000000000      c
  -13.01364125812327     -3.69074359984453      0.00000000000000      h
   -7.28360202490595      0.29919873991014     -4.07663317738460      h
   -5.04617010565786      3.73642719683159     -1.57173016568531      h
   -5.04617010565786      3.73642719683159      1.57173016568531      h
   -2.38191356353849      1.18951429853805      0.00000000000000      c
    2.38191356353849     -1.18951429853805      0.00000000000000      c
    4.93005426761187     -2.50823934561160      0.00000000000000      c
    2.07617227274790     -1.01477923013371      4.08873525039477      h
   -1.16610399157566      0.60117079940517      2.31632482902327      c
    1.16610399157566     -0.60117079940517      2.31632482902327      c
    1.16610399157566     -0.60117079940517     -2.31632482902327      c
   -1.16610399157566      0.60117079940517     -2.31632482902327      c
    2.07617227274790     -1.01477923013371     -4.08873525039477      h
   -2.07617227274790      1.01477923013371     -4.08873525039477      h
   -2.07617227274790      1.01477923013371      4.08873525039477      h
   11.39651686077736      2.46027740409016      0.00000000000000      c
    7.28360202490595     -0.29919873991014      4.07663317738460      h
   10.44077073765865      1.54339597878388      2.19220241800962      c
    7.18968063512488     -0.73731852997515      0.00000000000000      c
    5.04617010565786     -3.73642719683159      1.57173016568531      h
    5.04617010565786     -3.73642719683159     -1.57173016568531      h
    8.35188518828260     -0.04555380459367     -2.18654241068246      c
   10.44077073765865      1.54339597878388     -2.19220241800962      c
    7.28360202490595     -0.29919873991014     -4.07663317738460      h
    8.35188518828260     -0.04555380459367      2.18654241068246      c
   10.97813979671898      2.48543192734691     -4.08078861003084      h
   13.01364125812327      3.69074359984453      0.00000000000000      h
   10.97813979671898      2.48543192734691      4.08078861003084      h
$redundant
     number_of_atoms            38
     degrees_of_freedom         30
     internal_coordinates       30
     frozen_coordinates          0
# definitions of redundant internals
   1 k -1.0000000000000 tors    6    1    2    4 val=   0.02507
        1.0000000000000 tors    1    2    4    7
       -1.0000000000000 tors    2    4    7   10
        1.0000000000000 tors    4    7   10    6
       -1.0000000000000 tors    7   10    6    1
        1.0000000000000 tors   10    6    1    2
   2 k -1.0000000000000 tors   19   20   16   21 val=   1.68247
        1.0000000000000 tors   20   16   21   22
       -1.0000000000000 tors   16   21   22   15
        1.0000000000000 tors   21   22   15   19
       -1.0000000000000 tors   22   15   19   20
        1.0000000000000 tors   15   19   20   16
   3 k  1.0000000000000 outp    6    3    7   10 val=  -7.68467
   4 k  1.0000000000000 outp   25   15   20   19 val=   2.12727
   5 k  0.8660254037844 tors    6    1    2    4 val=   7.63514
       -0.8660254037844 tors    1    2    4    7
        0.8660254037844 tors    4    7   10    6
       -0.8660254037844 tors    7   10    6    1
   6 k  1.0000000000000 outp   12    1   10    6 val= -15.28097
   7 k  1.0000000000000 outp    9    6    2    1 val=  14.70985
   8 k  1.0000000000000 outp   11    4    1    2 val=   6.54363
   9 k  1.0000000000000 stre    6   12           val=   2.18587
  10 k  1.0000000000000 stre   19   25           val=   2.03488
  11 k  1.0000000000000 stre    1    9           val=   2.17783
  12 k  1.0000000000000 stre    6    1           val=   2.62454
  13 k  1.0000000000000 stre    3   10           val=   2.87090
  14 k  1.0000000000000 stre   15    3           val=   2.86916
  15 k  1.0000000000000 stre   19   20           val=   2.62389
  16 k  1.0000000000000 stre    2   11           val=   2.03203
  17 k -1.0000000000000 bend   10    1    6      val=  -0.48207
        1.0000000000000 bend    6    2    1
       -1.0000000000000 bend    1    4    2
        1.0000000000000 bend    2    7    4
       -1.0000000000000 bend    4   10    7
        1.0000000000000 bend    7    6   10
  18 k  1.0000000000000 stre    3   14           val=   1.99807
  19 k  0.0010658782327 bend   14   13    3      val=   0.01445
       -0.5000883928214 bend   15   13    3
       -0.5000883928214 bend   15   14    3
        0.4999110234003 bend   10   13    3
        0.4999110234003 bend   10   14    3
  20 k  1.0000000000000 outp    3   22   19   15 val=  -1.53982
  21 k  1.0000000000000 stre   10    6           val=   2.57104
  22 k  1.0000000000000 stre    1    2           val=   2.56123
  23 k  1.0000000000000 stre   16   21           val=   2.68136
  24 k  0.7082368849901 bend    2    9    1      val=   1.33708
       -0.7059748683484 bend    6    9    1
  25 k  0.7080539636366 bend   10   12    6      val=   0.99805
       -0.7061583282653 bend    1   12    6
  26 k  0.7071099471146 bend   20   25   19      val=  -0.47484
       -0.7071036152444 bend   15   25   19
  27 k  0.9115370658103 bend   14   13    3      val=   2.60099
       -0.2050860339716 bend   15   13    3
       -0.2050860339716 bend   15   14    3
       -0.2061305593472 bend   10   13    3
       -0.2061305593472 bend   10   14    3
  28 k -0.5000000000000 bend   10    1    6      val=  -2.04497
       -0.5000000000000 bend    6    2    1
        1.0000000000000 bend    1    4    2
       -0.5000000000000 bend    2    7    4
       -0.5000000000000 bend    4   10    7
        1.0000000000000 bend    7    6   10
  29 k -0.5000000000000 bend   15   20   19      val=  -0.36525
       -0.5000000000000 bend   19   16   20
        1.0000000000000 bend   20   21   16
       -0.5000000000000 bend   16   22   21
       -0.5000000000000 bend   21   15   22
        1.0000000000000 bend   22   19   15
  30 k  1.0000000000000 bend   15   10    3      val= 114.55072
        30 non zero eigenvalues  of BmBt
           1          11.980031296    1    0
         1
           2          10.717520411    2    0
         2
           3           5.927665579    3    0
         3
           4           4.464675327    4    0
         4
           5           4.346520247    5    0
         5
           6           3.665179249    6    0
         6
           7           3.260567949    7    0
         7
           8           3.157845491    8    0
         8
           9           2.858383000    9    0
         9
          10           2.414220034   10    0
        10
          11           2.312070094   11    0
        11
          12           1.711158280   12    0
        12
          13           1.266018463   13    0
        13
          14           1.085164230   14    0
        14
          15           1.001020242   15    0
        15
          16           0.752185170   16    0
        16
          17           0.711495228   17    0
        17
          18           0.513088324   18    0
        18
          19           0.419549463   19    0
        19
          20           0.361660043   20    0
        20
          21           0.338294802   21    0
        21
          22           0.335498227   22    0
        22
          23           0.316318731   23    0
        23
          24           0.257486449   24    0
        24
          25           0.168489957   25    0
        25
          26           0.134442303   26    0
        26
          27           0.124236969   27    0
        27
          28           0.069110627   28    0
        28
          29           0.037519271   29    0
        29
          30           0.003930802   30    0
        30
$end
