LGR52V
  -OEChem-05022322203D

 22 23  0     0  0  0  0  0  0999 V2000
   -0.6007    1.7870   -0.0003 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0650   -1.3687   -0.0012 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1039   -0.7425   -0.0003 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9993    0.7413   -0.0014 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5685    0.4454   -0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7456    0.7098    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2769   -0.6075    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6618    0.4455   -0.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1175    1.0088    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2169   -1.6610    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0264   -0.0522    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5841   -1.3705    0.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1069   -0.1427   -0.0015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4280    0.5848    0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4296    0.2225   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4568    2.0413    0.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8821   -2.6945    0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2938   -2.1951    0.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2054    1.7374   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4642    1.2964   -0.8268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5466    1.1205    0.9486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2466   -0.1312   -0.1095 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  8  1  0  0  0  0
  2 13  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  8  1  0  0  0  0
  4 13  1  0  0  0  0
  4 19  1  0  0  0  0
  5 15  3  0  0  0  0
  6  7  2  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  2  0  0  0  0
  9 16  1  0  0  0  0
 10 12  2  0  0  0  0
 10 17  1  0  0  0  0
 11 12  1  0  0  0  0
 11 15  1  0  0  0  0
 12 18  1  0  0  0  0
 13 14  1  0  0  0  0
 14 20  1  0  0  0  0
 14 21  1  0  0  0  0
 14 22  1  0  0  0  0
M  END

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