TLR7 agonist-2
                    3D
 Schrodinger Suite 2023-1.
 52 55  0  0  1  0            999 V2000
   -2.6171    0.6909    1.4930 C   0  0  0  0  0  0
   -2.0387    1.3396    0.2258 C   0  0  0  0  0  0
   -0.4991    1.3335    0.1578 C   0  0  0  0  0  0
    0.1261   -0.0738    0.0195 C   0  0  0  0  0  0
    1.6501   -0.0905   -0.0799 C   0  0  0  0  0  0
    2.3913    0.9937   -0.1011 N   0  0  0  0  0  0
    3.6829    0.5476   -0.1547 C   0  0  0  0  0  0
    3.7185   -0.8618   -0.1754 C   0  0  0  0  0  0
    4.9721   -1.5466   -0.2149 C   0  0  0  0  0  0
    5.1176   -2.9605   -0.2271 C   0  0  0  0  0  0
    6.3850   -3.5363   -0.2680 C   0  0  0  0  0  0
    7.5258   -2.7420   -0.2979 C   0  0  0  0  0  0
    7.4212   -1.3543   -0.2849 C   0  0  0  0  0  0
    6.1485   -0.7357   -0.2419 C   0  0  0  0  0  0
    6.0946    0.6254   -0.2267 N   0  0  0  0  0  0
    4.8951    1.2552   -0.1824 C   0  0  0  0  0  0
    4.9162    2.6484   -0.1601 N   0  0  0  0  0  0
    2.3878   -1.2665   -0.1475 N   0  0  0  0  0  0
    1.8378   -2.6261   -0.1136 C   0  0  0  0  0  0
    1.9692   -3.3518    1.2258 C   0  0  0  0  0  0
    2.0749   -4.7441    1.2352 C   0  0  0  0  0  0
    2.1873   -5.4301    2.4412 C   0  0  0  0  0  0
    2.1854   -4.7358    3.6532 C   0  0  0  0  0  0
    2.3143   -5.5513    4.9422 C   0  0  0  0  0  0
    2.2984   -4.7717    6.1693 N   0  0  0  0  0  0
    2.0656   -3.3392    3.6436 C   0  0  0  0  0  0
    1.9556   -2.6530    2.4377 C   0  0  0  0  0  0
   -3.7028    0.7872    1.5160 H   0  0  0  0  0  0
   -2.3848   -0.3728    1.5439 H   0  0  0  0  0  0
   -2.2256    1.1642    2.3941 H   0  0  0  0  0  0
   -2.3857    2.3726    0.1765 H   0  0  0  0  0  0
   -2.4488    0.8464   -0.6564 H   0  0  0  0  0  0
   -0.0984    1.8305    1.0428 H   0  0  0  0  0  0
   -0.1932    1.9423   -0.6945 H   0  0  0  0  0  0
   -0.3041   -0.5567   -0.8586 H   0  0  0  0  0  0
   -0.1792   -0.6792    0.8732 H   0  0  0  0  0  0
    4.2636   -3.6120   -0.2005 H   0  0  0  0  0  0
    6.4835   -4.6118   -0.2759 H   0  0  0  0  0  0
    8.5007   -3.2055   -0.3299 H   0  0  0  0  0  0
    8.3126   -0.7436   -0.3066 H   0  0  0  0  0  0
    4.0443    3.1561   -0.1229 H   0  0  0  0  0  0
    5.8042    3.1283   -0.1710 H   0  0  0  0  0  0
    2.3137   -3.1910   -0.9149 H   0  0  0  0  0  0
    0.7821   -2.5969   -0.3815 H   0  0  0  0  0  0
    2.0761   -5.2982    0.3078 H   0  0  0  0  0  0
    2.2752   -6.5071    2.4313 H   0  0  0  0  0  0
    3.2398   -6.1273    4.9142 H   0  0  0  0  0  0
    1.4877   -6.2612    4.9876 H   0  0  0  0  0  0
    2.2521   -5.3968    6.9613 H   0  0  0  0  0  0
    3.1751   -4.2780    6.2600 H   0  0  0  0  0  0
    2.0548   -2.7721    4.5623 H   0  0  0  0  0  0
    1.8595   -1.5773    2.4546 H   0  0  0  0  0  0
  1  2  1  0  0  0
  1 28  1  0  0  0
  1 29  1  0  0  0
  1 30  1  0  0  0
  2  3  1  0  0  0
  2 31  1  0  0  0
  2 32  1  0  0  0
  3  4  1  0  0  0
  3 33  1  0  0  0
  3 34  1  0  0  0
  4  5  1  0  0  0
  4 35  1  0  0  0
  4 36  1  0  0  0
  5  6  2  0  0  0
  5 18  1  0  0  0
  6  7  1  0  0  0
  7  8  2  0  0  0
  7 16  1  0  0  0
  8  9  1  0  0  0
  8 18  1  0  0  0
  9 10  2  0  0  0
  9 14  1  0  0  0
 10 11  1  0  0  0
 10 37  1  0  0  0
 11 12  2  0  0  0
 11 38  1  0  0  0
 12 13  1  0  0  0
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 13 14  2  0  0  0
 13 40  1  0  0  0
 14 15  1  0  0  0
 15 16  2  0  0  0
 16 17  1  0  0  0
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 18 19  1  0  0  0
 19 20  1  0  0  0
 19 43  1  0  0  0
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 20 21  2  0  0  0
 20 27  1  0  0  0
 21 22  1  0  0  0
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 22 23  2  0  0  0
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 23 24  1  0  0  0
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 25 49  1  0  0  0
 25 50  1  0  0  0
 26 27  2  0  0  0
 26 51  1  0  0  0
 27 52  1  0  0  0
M  END
> <s_m_entry_id>
41

> <s_m_entry_name>
TLR7 agonist-2.1

> <s_m_Source_Path>
D:\Schrodinger_2023-1\projects\ligprep_1

> <s_m_Source_File>
ligprep_1-out.maegz

> <i_m_Source_File_Index>
1

> <idx>
1

> <s_m_source_file>
ligprep_1.maegz

> <i_m_source_file_index>
4

> <i_lp_mmshare_version>
61128

> <i_f3d_flags>
0

> <r_lp_tautomer_probability>
1

> <s_lp_Force_Field>
S-OPLS

> <r_lp_Energy>
35.514006

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
TLR7 agonist-2-1

> <s_m_job_name>
ligprep_1

$$$$
