1F6-Met-(D)Lys-MMAF
                    3D
 Schrodinger Suite 2023-1.
180182  0  0  1  0            999 V2000
   12.8589  -10.0748    6.2865 C   0  0  0  0  0  0
   12.1490  -10.4678    5.2246 C   0  0  0  0  0  0
   11.4942   -9.3254    4.6677 C   0  0  0  0  0  0
   11.8651   -8.2955    5.4502 N   0  0  0  0  0  0
   12.6850   -8.6658    6.4522 C   0  0  0  0  0  0
   13.1796   -7.9452    7.3194 O   0  0  0  0  0  0
   10.7536   -9.2904    3.6847 O   0  0  0  0  0  0
   11.4035   -6.9176    5.2336 C   0  0  0  0  0  0
   12.4002   -6.0387    4.4418 C   0  0  0  0  0  0
   12.1673   -4.5267    4.5553 C   0  0  0  0  0  0
   13.0131   -3.7528    3.8531 N   0  0  0  0  0  0
   12.9709   -2.2909    3.7835 C   0  0  0  0  0  0
   13.2404   -1.5553    5.1219 C   0  0  0  0  0  0
   12.0416   -0.9994    5.7461 N   0  0  0  0  0  0
   11.2570   -4.0765    5.2521 O   0  0  0  0  0  0
   11.4410    0.1307    5.3387 C   0  0  0  0  0  0
   10.1845    0.5495    6.1168 C   0  0  2  0  0  0
   11.8472    0.8320    4.4107 O   0  0  0  0  0  0
    9.1976    1.0911    5.1853 N   0  0  0  0  0  0
    7.8694    1.0610    5.3716 C   0  0  0  0  0  0
    7.0238    1.6853    4.2531 C   0  0  1  0  0  0
    5.9760    0.7380    3.8861 N   0  0  0  0  0  0
    7.3150    0.5897    6.3658 O   0  0  0  0  0  0
    5.5946    0.4539    2.6307 C   0  0  0  0  0  0
    6.0297    1.0155    1.6242 O   0  0  0  0  0  0
    6.3800    3.0254    4.6702 C   0  0  0  0  0  0
    7.3922    4.1322    5.0191 C   0  0  0  0  0  0
    6.7074    5.4625    5.3724 C   0  0  0  0  0  0
    7.6953    6.6040    5.6596 C   0  0  0  0  0  0
    8.4281    6.3609    6.8871 N   0  0  0  0  0  0
   10.4685    1.5897    7.2267 C   0  0  0  0  0  0
   11.5291    1.1709    8.2583 C   0  0  0  0  0  0
   11.7108    2.3391    9.6315 S   0  0  0  0  0  0
   13.0063    1.4950   10.5750 C   0  0  0  0  0  0
    4.6665   -3.2057   -4.4778 N   0  0  2  0  0  0
    3.4621   -2.8333   -5.2689 C   0  0  2  0  0  0
    3.4720   -1.3043   -5.5481 C   0  0  0  0  0  0
    3.5923   -0.9463   -6.8394 N   0  0  0  0  0  0
    3.6476    0.4278   -7.3632 C   0  0  2  0  0  0
    2.3626    1.2493   -7.0105 C   0  0  0  0  0  0
    2.4577    2.5425   -6.5767 N   0  0  0  0  0  0
    1.2961    3.3543   -6.1000 C   0  0  2  0  0  0
    0.9687    3.1448   -4.5798 C   0  0  1  0  0  0
    0.3016    1.7857   -4.2385 C   0  0  0  0  0  0
   -0.1185    1.6082   -2.7597 C   0  0  0  0  0  0
    4.7441   -2.7774   -3.0850 C   0  0  0  0  0  0
    2.0755   -3.2642   -4.6841 C   0  0  0  0  0  0
    2.0362   -4.7634   -4.3309 C   0  0  0  0  0  0
    0.8815   -2.9402   -5.6117 C   0  0  0  0  0  0
    3.3711   -0.5003   -4.6194 O   0  0  0  0  0  0
    3.8342    0.4127   -8.9219 C   0  0  0  0  0  0
    5.0071   -0.4855   -9.3704 C   0  0  0  0  0  0
    4.0152    1.8047   -9.5676 C   0  0  0  0  0  0
    1.2841    0.6658   -7.1442 O   0  0  0  0  0  0
    3.7501    3.2180   -6.3801 C   0  0  0  0  0  0
    0.0371    3.4016   -7.0438 C   0  0  1  0  0  0
   -1.0363    4.4048   -6.5622 C   0  0  0  0  0  0
    0.3744    3.6517   -8.5394 C   0  0  0  0  0  0
    1.1363    4.9546   -8.8376 C   0  0  0  0  0  0
    2.1437    3.2538   -3.7716 O   0  0  0  0  0  0
    2.5576    4.5807   -3.4704 C   0  0  0  0  0  0
   -0.1725    2.5986   -2.0288 O   0  0  0  0  0  0
   -0.4254    0.3630   -2.3138 N   0  0  0  0  0  0
   -0.7846    0.0432   -0.9166 C   0  0  1  0  0  0
   -1.3883   -1.3645   -1.0347 C   0  0  0  0  0  0
   -0.7559   -1.9848   -2.2679 C   0  0  0  0  0  0
   -0.4806   -0.8083   -3.1999 C   0  0  0  0  0  0
    0.3756    0.1505    0.1401 C   0  0  1  0  0  0
    1.6935   -0.6579   -0.1194 C   0  0  2  0  0  0
    0.7611    1.5013    0.4095 O   0  0  0  0  0  0
   -0.1483    2.2723    1.1860 C   0  0  0  0  0  0
    2.4540   -0.9250    1.2069 C   0  0  0  0  0  0
    2.5915   -0.0772   -1.2475 C   0  0  0  0  0  0
    1.8898   -1.5453    2.1098 O   0  0  0  0  0  0
    3.7195   -0.4850    1.3268 N   0  0  0  0  0  0
    4.5791   -0.6914    2.4911 C   0  0  1  0  0  0
    5.2331   -2.0952    2.4089 C   0  0  0  0  0  0
    6.2916   -2.4098    3.4552 C   0  0  0  0  0  0
    7.6599   -2.2014    3.1752 C   0  0  0  0  0  0
    8.6082   -2.3819    4.1726 C   0  0  0  0  0  0
    8.2151   -2.7450    5.4546 C   0  0  0  0  0  0
    6.8704   -2.9228    5.7535 C   0  0  0  0  0  0
    5.9059   -2.7465    4.7701 C   0  0  0  0  0  0
   13.4641  -10.7054    6.9207 H   0  0  0  0  0  0
   12.0745  -11.4750    4.8420 H   0  0  0  0  0  0
   11.2761   -6.4786    6.2253 H   0  0  0  0  0  0
   10.4039   -6.8598    4.7994 H   0  0  0  0  0  0
   12.4674   -6.3800    3.4080 H   0  0  0  0  0  0
   13.4034   -6.2341    4.8241 H   0  0  0  0  0  0
   13.7349   -4.2028    3.3087 H   0  0  0  0  0  0
   12.0287   -1.9716    3.3338 H   0  0  0  0  0  0
   13.7252   -1.9801    3.0600 H   0  0  0  0  0  0
   14.0146   -0.7955    4.9968 H   0  0  0  0  0  0
   13.6628   -2.2524    5.8472 H   0  0  0  0  0  0
   11.6494   -1.5165    6.5199 H   0  0  0  0  0  0
    9.7708   -0.3488    6.5802 H   0  0  0  0  0  0
    9.5728    1.4985    4.3404 H   0  0  0  0  0  0
    7.6742    1.8636    3.3940 H   0  0  0  0  0  0
    5.5761    0.2158    4.6526 H   0  0  0  0  0  0
    5.7144    2.8648    5.5200 H   0  0  0  0  0  0
    5.7458    3.3783    3.8557 H   0  0  0  0  0  0
    8.0652    4.2846    4.1747 H   0  0  0  0  0  0
    8.0147    3.8155    5.8562 H   0  0  0  0  0  0
    6.0418    5.3241    6.2257 H   0  0  0  0  0  0
    6.0703    5.7611    4.5394 H   0  0  0  0  0  0
    7.1550    7.5449    5.7641 H   0  0  0  0  0  0
    8.3966    6.7258    4.8340 H   0  0  0  0  0  0
    7.7813    6.2396    7.6535 H   0  0  0  0  0  0
    8.9479    5.4983    6.8089 H   0  0  0  0  0  0
    9.5410    1.8146    7.7547 H   0  0  0  0  0  0
   10.7816    2.5291    6.7681 H   0  0  0  0  0  0
   12.5040    1.0685    7.7814 H   0  0  0  0  0  0
   11.2747    0.1948    8.6723 H   0  0  0  0  0  0
   13.2526    2.0666   11.4697 H   0  0  0  0  0  0
   12.6714    0.5033   10.8794 H   0  0  0  0  0  0
   13.9089    1.3888    9.9729 H   0  0  0  0  0  0
    5.5197   -2.9886   -4.9729 H   0  0  0  0  0  0
    3.5633   -3.3453   -6.2286 H   0  0  0  0  0  0
    3.6568   -1.6733   -7.5368 H   0  0  0  0  0  0
    4.5379    0.8473   -6.8987 H   0  0  0  0  0  0
    1.6435    4.3862   -6.1456 H   0  0  0  0  0  0
    0.2755    3.9263   -4.2634 H   0  0  0  0  0  0
    0.9961    0.9919   -4.5069 H   0  0  0  0  0  0
   -0.5897    1.6495   -4.8503 H   0  0  0  0  0  0
    5.6060   -3.2455   -2.6098 H   0  0  0  0  0  0
    4.8736   -1.6990   -3.0044 H   0  0  0  0  0  0
    3.8565   -3.0676   -2.5233 H   0  0  0  0  0  0
    1.9123   -2.7245   -3.7504 H   0  0  0  0  0  0
    2.2220   -5.3804   -5.2104 H   0  0  0  0  0  0
    2.7841   -5.0204   -3.5813 H   0  0  0  0  0  0
    1.0648   -5.0469   -3.9247 H   0  0  0  0  0  0
    0.9863   -3.4394   -6.5752 H   0  0  0  0  0  0
   -0.0594   -3.2692   -5.1700 H   0  0  0  0  0  0
    0.7841   -1.8721   -5.8045 H   0  0  0  0  0  0
    2.9370   -0.0238   -9.3661 H   0  0  0  0  0  0
    5.9452   -0.1628   -8.9178 H   0  0  0  0  0  0
    4.8471   -1.5292   -9.0991 H   0  0  0  0  0  0
    5.1354   -0.4578  -10.4528 H   0  0  0  0  0  0
    4.9131    2.2981   -9.1960 H   0  0  0  0  0  0
    4.1149    1.7227  -10.6503 H   0  0  0  0  0  0
    3.1705    2.4649   -9.3814 H   0  0  0  0  0  0
    4.5359    2.8659   -7.0437 H   0  0  0  0  0  0
    3.6643    4.2857   -6.5822 H   0  0  0  0  0  0
    4.0946    3.0975   -5.3534 H   0  0  0  0  0  0
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M  END
> <s_m_entry_id>
35

> <s_m_entry_name>
1F6-Met-(D)Lys-MMAF.1

> <s_m_Source_Path>
D:\Schrodinger_2023-1\projects\ligprep_4

> <s_m_Source_File>
ligprep_4-out.maegz

> <i_m_Source_File_Index>
1

> <s_m_source_file>
ligprep_4.maegz

> <i_m_source_file_index>
2

> <i_lp_mmshare_version>
61128

> <i_f3d_flags>
0

> <r_lp_tautomer_probability>
1

> <s_lp_Force_Field>
S-OPLS

> <r_lp_Energy>
49.182054

> <b_lp_Chiralities_Consistent>
1

> <s_lp_Variant>
1F6-Met-(D)Lys-MMAF.sdf-1

> <s_m_job_name>
ligprep_4

$$$$
