Isoprene-PEG3-beta-Glu-PABC
     RDKit          2D

 56 57  0  0  1  0  0  0  0  0999 V2000
  -10.2752   -7.0104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3425   -5.8356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8936   -4.4405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3773   -4.2201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9283   -2.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9956   -1.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5119   -1.8706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9609   -3.2657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5792   -0.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0955   -0.9162    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1303    0.6993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1628    0.2586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6791    0.0383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7464    1.2130    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2627    0.9927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3300    2.1674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1538    1.9471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0865    3.1219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5467   -0.2551    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0304   -0.0348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5814    1.3604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0652    1.5807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.9979    0.4059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4468   -0.9892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9631   -1.2095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6162    2.9758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.6835    4.1506    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0999    3.1962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.4816    0.6263    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4121   -2.6046    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.3795   -2.1639    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5702    2.9015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5029    4.0763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9866    3.8559    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9193    5.0307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4030    4.8103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3683    6.4258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9541    3.4152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4378    3.1949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9888    1.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4726    1.5794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0236    0.1843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5073   -0.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0583   -1.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3705    4.3696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4400    1.1387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5421   -1.6515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0931   -3.0467    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5768   -3.2670    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   17.7972   -1.7833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3565   -4.7507    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0606   -3.4874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9933   -2.3126    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   21.1680   -3.2453    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8185   -1.3799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.9259   -1.1378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  8  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  6 19  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
  9 11  2  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 32  1  0
 19 20  1  0
 20 21  1  0
 20 25  1  0
 21 22  1  0
 22 23  1  0
 22 26  1  0
 23 24  1  0
 23 29  1  0
 24 25  1  0
 24 31  1  0
 25 30  1  0
 26 27  1  0
 26 28  2  0
 32 33  1  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 35 37  1  0
 36 38  1  0
 38 39  1  0
 39 40  2  0
 39 45  1  0
 40 41  1  0
 41 42  1  0
 42 43  1  0
 43 44  2  0
 43 46  1  0
 44 47  1  0
 47 48  1  0
 48 49  1  0
 49 50  2  0
 49 51  2  0
 49 52  1  0
 52 53  1  0
 53 54  2  0
 53 55  2  0
 53 56  1  0
M  END
>  <i_m_stars>  (1) 
0

>  <s_m_entry_id>  (1) 
35

>  <s_m_entry_name>  (1) 
Structure35

>  <r_f3d_energy>  (1) 
0

>  <i_f3d_flags>  (1) 
0

$$$$
