$coord
    3.01147125217364     -0.48344107827223      0.00000000000000      c
    0.22269420555110      0.00316067312668      0.00000000000000      c
   -0.52623817737599      1.50144624284277     -2.38140371564558      c
   -1.20393887638461     -2.55839946196276      0.00000000000000      c
   -0.52623817737599      1.50144624284277      2.38140371564558      c
    4.01314229409875     -0.82469926647544      1.75320867441819      h
    4.01314229409875     -0.82469926647544     -1.75320867441819      h
   -0.01040390226221      0.47130439226971     -4.09626665562058      h
   -2.56505334800820      1.83312732846587     -2.43093708270035      h
    0.42264313769857      3.33441308619959     -2.43099440450337      h
   -3.24887083894222     -2.24636100139922      0.00000000000000      h
   -0.72476787534990     -3.67307134904874     -1.67011066248382      h
   -0.72476787534990     -3.67307134904874      1.67011066248382      h
   -2.56505334800820      1.83312732846587      2.43093708270035      h
   -0.01040390226221      0.47130439226971      4.09626665562058      h
    0.42264313769857      3.33441308619959      2.43099440450337      h
$redundant
     number_of_atoms            16
     degrees_of_freedom         23
     internal_coordinates       23
     frozen_coordinates          0
# definitions of redundant internals
   1 k  1.0000000000000 outp    6    2    7    1 val=   9.17657
   2 k  1.0000000000000 stre    3    9           val=   2.06621
   3 k  1.0000000000000 stre    3    8           val=   2.06592
   4 k  1.0000000000000 stre    3   10           val=   2.06461
   5 k  1.0000000000000 stre    4   11           val=   2.06860
   6 k  1.0000000000000 stre    2    1           val=   2.83091
   7 k  1.0000000000000 stre    2    4           val=   2.93204
   8 k  0.4190942177345 bend    8   10    3      val=   1.32467
        0.4216013871339 bend    9   10    3
        0.4151569651477 bend    9    8    3
       -0.3969031699079 bend    2   10    3
       -0.3987055655188 bend    2    8    3
       -0.3971885535347 bend    2    9    3
   9 k  0.4203603044487 bend   13   12    4      val=   1.23413
        0.4166181064282 bend   11   12    4
        0.4166181064282 bend   11   13    4
       -0.3992396516359 bend    2   12    4
       -0.3992396516359 bend    2   13    4
       -0.3967005449446 bend    2   11    4
  10 k  0.8168709174082 bend    7    6    1      val=  -1.38118
       -0.4078736963158 bend    2    6    1
       -0.4078736963158 bend    2    7    1
  11 k  1.0000000000000 stre    4   12           val=   2.06431
  12 k  1.0000000000000 stre    2    5           val=   2.91150
  13 k  1.0000000000000 stre    1    6           val=   2.04781
  14 k -0.6753606003903 bend    8   10    3      val=   0.03531
        0.4651116724947 bend    9   10    3
        0.2096980814507 bend    9    8    3
       -0.1322184779905 bend    2   10    3
       -0.2918451933501 bend    2    8    3
        0.4253593344242 bend    2    9    3
  15 k -0.1443793986299 bend    8   10    3      val=   0.06222
       -0.5081960256416 bend    9   10    3
        0.6593883435909 bend    9    8    3
       -0.4175405180425 bend    2   10    3
        0.3213689889710 bend    2    8    3
        0.0920884891305 bend    2    9    3
  16 k -0.6940416059854 bend   13   12    4      val=   0.21141
        0.3494103471090 bend   11   12    4
        0.3494103471090 bend   11   13    4
       -0.2133475166695 bend    2   12    4
       -0.2133475166695 bend    2   13    4
        0.4278980510465 bend    2   11    4
  17 k  1.0000000000000 tors   10    3    2    1 val=  59.25467
        1.0000000000000 tors   10    3    2    4
        1.0000000000000 tors   10    3    2    5
        1.0000000000000 tors    8    3    2    1
        1.0000000000000 tors    8    3    2    4
        1.0000000000000 tors    8    3    2    5
        1.0000000000000 tors    9    3    2    1
        1.0000000000000 tors    9    3    2    4
        1.0000000000000 tors    9    3    2    5
  18 k -0.1058594843146 bend    3    1    2      val=   0.36392
       -0.1058594843146 bend    5    1    2
       -0.6821625892711 bend    5    3    2
        0.7009804275185 bend    4    1    2
        0.1021473964336 bend    4    3    2
        0.1021473964336 bend    4    5    2
  19 k -0.4924658873810 bend    3    1    2      val=   0.44598
       -0.4924658873810 bend    5    1    2
        0.1633888567294 bend    5    3    2
       -0.1311775185331 bend    4    1    2
        0.4853098183945 bend    4    3    2
        0.4853098183945 bend    4    5    2
  20 k  0.3180386019286 bend    8   10    3      val=   0.01918
        0.0986763844033 bend    9   10    3
       -0.4182661381477 bend    9    8    3
       -0.6591674454077 bend    2   10    3
        0.1558969296335 bend    2    8    3
        0.5053338329945 bend    2    9    3
  21 k -0.2963697493706 bend    8   10    3      val=   0.11279
        0.4239317957673 bend    9   10    3
       -0.1276468725400 bend    9    8    3
       -0.2007564531193 bend    2   10    3
        0.6734273056403 bend    2    8    3
       -0.4715353546398 bend    2    9    3
  22 k -0.4259006261256 bend   13   12    4      val=   0.26264
        0.2153373398222 bend   11   12    4
        0.2153373398222 bend   11   13    4
        0.3466708221446 bend    2   12    4
        0.3466708221446 bend    2   13    4
       -0.6967833228269 bend    2   11    4
  23 k  0.2761680801801 bend    3    1    2      val=  -0.00854
        0.2761680801801 bend    5    1    2
       -0.5827413171058 bend    5    3    2
       -0.5714407955360 bend    4    1    2
        0.3011065903583 bend    4    3    2
        0.3011065903582 bend    4    5    2
        23 non zero eigenvalues  of BmBt
           1           5.554939436    1    0
         1
           2           4.164846874    2    0
         2
           3           3.802001722    3    0
         3
           4           3.406926156    4    0
         4
           5           3.224303124    5    0
         5
           6           3.185077912    6    0
         6
           7           3.101461026    7    0
         7
           8           1.701202433    8    0
         8
           9           1.465912050    9    0
         9
          10           0.901115553   10    0
        10
          11           0.879963719   11    0
        11
          12           0.867803224   12    0
        12
          13           0.833563331   13    0
        13
          14           0.694252993   14    0
        14
          15           0.693371738   15    0
        15
          16           0.665849476   16    0
        16
          17           0.372037832   17    0
        17
          18           0.324883166   18    0
        18
          19           0.309749601   19    0
        19
          20           0.194530334   20    0
        20
          21           0.071157120   21    0
        21
          22           0.064864959   22    0
        22
          23           0.049851317   23    0
        23
$user-defined bonds
$end
