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THU-ATOM
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PDBbind_test

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linbc20 commited on
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4572dd5
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verified ·
1 Parent(s): adfdd3e

Add batch 4

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  1. 6dz0/6dz0_input_conf_0.sdf +51 -51
  2. 6dz0/6dz0_input_conf_1.sdf +49 -49
  3. 6dz0/6dz0_input_conf_2.sdf +50 -50
  4. 6dz0/6dz0_input_conf_3.sdf +49 -49
  5. 6dz0/6dz0_input_conf_4.sdf +51 -51
  6. 6dz0/6dz0_input_conf_5.sdf +49 -49
  7. 6dz0/6dz0_input_conf_6.sdf +48 -48
  8. 6dz0/6dz0_input_conf_7.sdf +51 -51
  9. 6dz0/6dz0_input_conf_8.sdf +51 -51
  10. 6dz0/6dz0_input_conf_9.sdf +49 -49
  11. 6dz2/6dz2_input_conf_0.sdf +68 -68
  12. 6dz2/6dz2_input_conf_1.sdf +66 -66
  13. 6dz2/6dz2_input_conf_2.sdf +66 -66
  14. 6dz2/6dz2_input_conf_3.sdf +66 -66
  15. 6dz2/6dz2_input_conf_4.sdf +66 -66
  16. 6dz2/6dz2_input_conf_5.sdf +66 -66
  17. 6dz2/6dz2_input_conf_6.sdf +66 -66
  18. 6dz2/6dz2_input_conf_7.sdf +68 -68
  19. 6dz2/6dz2_input_conf_8.sdf +65 -65
  20. 6dz2/6dz2_input_conf_9.sdf +66 -66
  21. 6dz3/6dz3_input_conf_0.sdf +64 -64
  22. 6dz3/6dz3_input_conf_1.sdf +64 -64
  23. 6dz3/6dz3_input_conf_2.sdf +65 -65
  24. 6dz3/6dz3_input_conf_3.sdf +64 -64
  25. 6dz3/6dz3_input_conf_4.sdf +64 -64
  26. 6dz3/6dz3_input_conf_5.sdf +64 -64
  27. 6dz3/6dz3_input_conf_6.sdf +64 -64
  28. 6dz3/6dz3_input_conf_7.sdf +66 -66
  29. 6dz3/6dz3_input_conf_8.sdf +65 -65
  30. 6dz3/6dz3_input_conf_9.sdf +64 -64
  31. 6e13/6e13_input_conf_0.sdf +38 -38
  32. 6e13/6e13_input_conf_1.sdf +37 -37
  33. 6e13/6e13_input_conf_2.sdf +38 -38
  34. 6e13/6e13_input_conf_3.sdf +38 -38
  35. 6e13/6e13_input_conf_4.sdf +37 -37
  36. 6e13/6e13_input_conf_5.sdf +38 -38
  37. 6e13/6e13_input_conf_6.sdf +37 -37
  38. 6e13/6e13_input_conf_7.sdf +38 -38
  39. 6e13/6e13_input_conf_8.sdf +38 -38
  40. 6e13/6e13_input_conf_9.sdf +39 -39
  41. 6e3m/6e3m_input_conf_0.sdf +27 -27
  42. 6e3m/6e3m_input_conf_1.sdf +27 -27
  43. 6e3m/6e3m_input_conf_2.sdf +27 -27
  44. 6e3m/6e3m_input_conf_3.sdf +27 -27
  45. 6e3m/6e3m_input_conf_4.sdf +27 -27
  46. 6e3m/6e3m_input_conf_5.sdf +27 -27
  47. 6e3m/6e3m_input_conf_6.sdf +27 -27
  48. 6e3m/6e3m_input_conf_7.sdf +27 -27
  49. 6e3m/6e3m_input_conf_8.sdf +27 -27
  50. 6e3m/6e3m_input_conf_9.sdf +27 -27
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+ 3.0914 0.5147 0.7263 C 0 0 0 0 0 0 0 0 0 0 0 0
22
+ 4.3833 0.7329 1.1179 O 0 0 0 0 0 0 0 0 0 0 0 0
23
+ 2.1158 0.4344 1.7131 C 0 0 0 0 0 0 0 0 0 0 0 0
24
+ 2.5096 0.5936 3.0208 O 0 0 0 0 0 0 0 0 0 0 0 0
25
+ -1.9591 0.2927 1.4584 H 0 0 0 0 0 0 0 0 0 0 0 0
26
+ -4.5916 -1.0672 -1.6171 H 0 0 0 0 0 0 0 0 0 0 0 0
27
+ -2.6626 -1.3416 -3.1569 H 0 0 0 0 0 0 0 0 0 0 0 0
28
+ -0.3756 -0.8354 -2.3978 H 0 0 0 0 0 0 0 0 0 0 0 0
29
+ 0.0430 0.1080 2.1695 H 0 0 0 0 0 0 0 0 0 0 0 0
30
+ 4.3313 0.8229 2.0861 H 0 0 0 0 0 0 0 0 0 0 0 0
31
+ 1.7080 0.5333 3.5687 H 0 0 0 0 0 0 0 0 0 0 0 0
32
  1 2 1 0
33
  2 3 2 0
34
  2 4 1 0