Mc-PEG2-Val-Cit-PABC
                    3D
 Structure written by MMmdl.
 86 87  0  0  1  0            999 V2000
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   -6.3536   -0.8132   -6.2154 C   0  0  0  0  0  0
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   -4.8951    0.7479   -4.9109 C   0  0  0  0  0  0
   -3.4461    0.5695   -1.4638 N   0  0  0  0  0  0
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    0.0000    0.0000    0.0000 C   0  0  0  0  0  0
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    2.0000   -1.2247   -0.7071 C   0  0  0  0  0  0
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    6.1801    0.7557    8.6957 C   0  0  0  0  0  0
    5.8064    2.0373    9.3797 C   0  0  0  0  0  0
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    7.1637    2.1983   11.4226 C   0  0  0  0  0  0
    8.3616    2.8811   11.7895 C   0  0  0  0  0  0
    8.7865    3.5736   10.7240 C   0  0  0  0  0  0
    7.8683    3.3466    9.6557 C   0  0  0  0  0  0
    6.4660    1.4590   12.1159 O   0  0  0  0  0  0
    7.9028    3.8007    8.5126 O   0  0  0  0  0  0
   -6.3086   -2.3127   -7.5646 H   0  0  0  0  0  0
   -7.4089   -0.9373   -5.9724 H   0  0  0  0  0  0
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   -6.1324   -2.2510   -3.9346 H   0  0  0  0  0  0
   -4.8802   -1.6555   -1.8883 H   0  0  0  0  0  0
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    0.0494    2.0879    0.0000 H   0  0  0  0  0  0
   -1.5471    3.6713   -0.1769 H   0  0  0  0  0  0
   -1.6910    3.0798    1.4957 H   0  0  0  0  0  0
   -4.0828    2.6676    1.1443 H   0  0  0  0  0  0
   -3.9389    3.2592   -0.5284 H   0  0  0  0  0  0
   -3.3203    4.8437    1.9794 H   0  0  0  0  0  0
   -4.7746    5.0138    0.9674 H   0  0  0  0  0  0
   -3.6098    5.9612   -0.6581 H   0  0  0  0  0  0
   -0.4010    7.2821   -0.7922 H   0  0  0  0  0  0
   -1.8871    7.2121   -1.4863 H   0  0  0  0  0  0
    1.8633    0.8900   -0.5138 H   0  0  0  0  0  0
    1.6461   -0.8270    1.8457 H   0  0  0  0  0  0
    2.6007   -0.3061    3.6434 H   0  0  0  0  0  0
    2.7016    1.4361    3.9942 H   0  0  0  0  0  0
    5.0355    1.4525    3.2414 H   0  0  0  0  0  0
    4.9347   -0.2896    2.8907 H   0  0  0  0  0  0
    6.7154    1.0245    4.8844 H   0  0  0  0  0  0
    6.6146   -0.7177    4.5337 H   0  0  0  0  0  0
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    5.7177   -1.0306    6.8672 H   0  0  0  0  0  0
    1.6367   -2.1147   -0.1933 H   0  0  0  0  0  0
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    3.8633   -2.1147   -1.2209 H   0  0  0  0  0  0
    1.8633   -0.3348   -2.6352 H   0  0  0  0  0  0
    1.8633   -2.1147   -2.6352 H   0  0  0  0  0  0
    0.4100   -1.2247   -2.1213 H   0  0  0  0  0  0
    7.2110    0.5002    8.9408 H   0  0  0  0  0  0
    5.5182   -0.0422    9.0324 H   0  0  0  0  0  0
    4.9635    1.8603   10.0477 H   0  0  0  0  0  0
    5.5279    2.7802    8.6322 H   0  0  0  0  0  0
    8.8208    2.8281   12.7660 H   0  0  0  0  0  0
    9.6632    4.2011   10.6535 H   0  0  0  0  0  0
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  5 49  1  0  0  0
  6  7  1  0  0  0
  6  9  1  0  0  0
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  9 52  1  0  0  0
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M  END
> <s_m_entry_id>
32

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
