PEG4-Mal
                    3D
 Structure written by MMmdl.
 67 68  0  0  1  0            999 V2000
    2.4114    1.3483    4.4855 O   0  0  0  0  0  0
   -0.9056    0.0100    7.2674 O   0  0  0  0  0  0
    0.7024    0.4339    5.6982 N   0  0  0  0  0  0
    0.4625   -0.7312    4.8517 C   0  0  0  0  0  0
    1.5362    2.2992    6.4985 C   0  0  0  0  0  0
    1.6361    1.3467    5.4410 C   0  0  0  0  0  0
    0.0096    0.6904    6.8051 C   0  0  0  0  0  0
    0.5554    1.9035    7.3211 C   0  0  0  0  0  0
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   -0.8012   -1.5842    2.9345 C   0  0  0  0  0  0
   -1.7010   -1.3296    1.9841 N   0  0  0  0  0  0
   -0.2551   -2.6763    3.0603 O   0  0  0  0  0  0
   -2.1623   -2.2804    0.9767 C   0  0  0  0  0  0
   -1.8505   -1.7500   -0.3913 C   0  0  0  0  0  0
   -0.4877   -1.5724   -0.5162 O   0  0  0  0  0  0
   -0.0727   -1.0851   -1.7389 C   0  0  0  0  0  0
    1.4203   -0.9406   -1.7389 C   0  0  0  0  0  0
    2.0035   -2.1913   -1.7389 O   0  0  0  0  0  0
    3.3835   -2.1913   -1.7389 C   0  0  0  0  0  0
    3.8835   -1.7076   -3.0678 C   0  0  0  0  0  0
    5.2635   -1.7076   -3.0678 O   0  0  0  0  0  0
    5.8468   -0.7495   -2.2639 C   0  0  0  0  0  0
    7.3398   -0.8602   -2.3567 C   0  0  0  0  0  0
    7.7548   -0.4476   -3.6065 O   0  0  0  0  0  0
    9.1176   -0.5034   -3.8164 C   0  0  0  0  0  0
    9.4293   -0.0303   -5.2053 C   0  0  0  0  0  0
    8.9555    1.3832   -5.3702 C   0  0  0  0  0  0
    7.6752    1.3781   -5.8211 O   0  0  0  0  0  0
    9.5853    2.4110   -5.1470 O   0  0  0  0  0  0
    7.2693    2.6473   -5.9623 N   0  0  0  0  0  0
    6.6755    3.3251   -4.9684 C   0  0  0  0  0  0
    6.3572    4.7145   -5.4807 C   0  0  0  0  0  0
    6.8584    4.7165   -6.9040 C   0  0  0  0  0  0
    7.4287    3.3280   -7.1073 C   0  0  0  0  0  0
    6.4273    2.9059   -3.8378 O   0  0  0  0  0  0
    7.9440    2.9118   -8.1449 O   0  0  0  0  0  0
    0.0910   -1.5539    5.4626 H   0  0  0  0  0  0
    1.3940   -1.0282    4.3698 H   0  0  0  0  0  0
    2.1589    3.1773    6.5911 H   0  0  0  0  0  0
    0.2143    2.3927    8.2221 H   0  0  0  0  0  0
   -0.1832    0.4355    3.1934 H   0  0  0  0  0  0
   -1.4862   -0.0902    4.2861 H   0  0  0  0  0  0
   -2.1735   -0.4479    1.8448 H   0  0  0  0  0  0
   -3.2387   -2.4207    1.0754 H   0  0  0  0  0  0
   -1.6567   -3.2354    1.1200 H   0  0  0  0  0  0
   -2.3560   -0.7950   -0.5346 H   0  0  0  0  0  0
   -2.1948   -2.4598   -1.1434 H   0  0  0  0  0  0
   -0.5318   -0.1128   -1.9173 H   0  0  0  0  0  0
   -0.3707   -1.7776   -2.5261 H   0  0  0  0  0  0
    1.7325   -0.3942   -0.8489 H   0  0  0  0  0  0
    1.7325   -0.3942   -2.6288 H   0  0  0  0  0  0
    3.7469   -3.2034   -1.5604 H   0  0  0  0  0  0
    3.7469   -1.5308   -0.9516 H   0  0  0  0  0  0
    3.5202   -0.6956   -3.2462 H   0  0  0  0  0  0
    3.5202   -2.3682   -3.8550 H   0  0  0  0  0  0
    5.5346   -0.9030   -1.2308 H   0  0  0  0  0  0
    5.5346    0.2411   -2.5944 H   0  0  0  0  0  0
    7.6378   -1.8968   -2.1988 H   0  0  0  0  0  0
    7.7989   -0.2301   -1.5950 H   0  0  0  0  0  0
    9.4619   -1.5306   -3.6965 H   0  0  0  0  0  0
    9.6231    0.1361   -3.0927 H   0  0  0  0  0  0
    8.9238   -0.6698   -5.9289 H   0  0  0  0  0  0
   10.5058   -0.0744   -5.3711 H   0  0  0  0  0  0
    6.8651    5.4549   -4.8619 H   0  0  0  0  0  0
    5.2821    4.8865   -5.4201 H   0  0  0  0  0  0
    7.6414    5.4579   -7.0663 H   0  0  0  0  0  0
    6.0584    4.8895   -7.6245 H   0  0  0  0  0  0
  1  6  2  0  0  0
  2  7  2  0  0  0
  3  4  1  0  0  0
  3  6  1  0  0  0
  3  7  1  0  0  0
  4  9  1  0  0  0
  4 37  1  0  0  0
  4 38  1  0  0  0
  5  6  1  0  0  0
  5  8  2  0  0  0
  5 39  1  0  0  0
  7  8  1  0  0  0
  8 40  1  0  0  0
  9 10  1  0  0  0
  9 41  1  0  0  0
  9 42  1  0  0  0
 10 11  1  0  0  0
 10 12  2  0  0  0
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 13 14  1  0  0  0
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 14 47  1  0  0  0
 15 16  1  0  0  0
 16 17  1  0  0  0
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 16 49  1  0  0  0
 17 18  1  0  0  0
 17 50  1  0  0  0
 17 51  1  0  0  0
 18 19  1  0  0  0
 19 20  1  0  0  0
 19 52  1  0  0  0
 19 53  1  0  0  0
 20 21  1  0  0  0
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 21 22  1  0  0  0
 22 23  1  0  0  0
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 23 24  1  0  0  0
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 26 27  1  0  0  0
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 27 28  1  0  0  0
 27 29  2  0  0  0
 28 30  1  0  0  0
 30 34  1  0  0  0
 30 31  1  0  0  0
 31 32  1  0  0  0
 31 35  2  0  0  0
 32 33  1  0  0  0
 32 64  1  0  0  0
 32 65  1  0  0  0
 33 34  1  0  0  0
 33 66  1  0  0  0
 33 67  1  0  0  0
 34 36  2  0  0  0
M  END
> <s_m_entry_id>
15

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
