4BL
  CCTOOLS-0919241030

 22 23  0  0  0  0  0  0  0  0999 V2000
   -1.5730    0.0420    0.0030 C   0  0  0  0  0
   -0.6810   -1.0140    0.0040 N   0  0  0  0  0
   -0.8790    1.2110    0.0020 C   0  0  0  0  0
    0.5990   -0.5120    0.0020 C   0  0  0  0  0
   -3.0370   -0.0790   -0.0010 C   0  0  0  0  0
    0.5010    0.8930    0.0010 C   0  0  0  0  0
    1.8560   -1.1100    0.0010 C   0  0  0  0  0
   -3.6120   -1.2990   -0.0040 O   0  0  0  0  0
    1.6660    1.6700   -0.0010 C   0  0  0  0  0
   -3.7300    0.9190   -0.0000 O   0  0  0  0  0
    2.9870   -0.3240   -0.0010 C   0  0  0  0  0
    2.8880    1.0610   -0.0020 C   0  0  0  0  0
    4.3470   -0.9750   -0.0010 C   0  0  0  0  0
   -1.3040    2.2040    0.0010 H   0  0  0  0  0
    1.9440   -2.1860    0.0020 H   0  0  0  0  0
   -4.5790   -1.3290   -0.0070 H   0  0  0  0  0
    1.5990    2.7480   -0.0030 H   0  0  0  0  0
    3.7850    1.6620   -0.0040 H   0  0  0  0  0
    4.6740   -1.1330   -1.0290 H   0  0  0  0  0
    5.0590   -0.3280    0.5110 H   0  0  0  0  0
    4.2910   -1.9340    0.5140 H   0  0  0  0  0
   -0.9190   -1.9540    0.0050 H   0  0  0  0  0
  1  2  1  0  0  0
  2 22  1  0  0  0
  3  1  2  0  0  0
  3  6  1  0  0  0
  3 14  1  0  0  0
  4  2  1  0  0  0
  4  7  2  0  0  0
  5  1  1  0  0  0
  5  8  1  0  0  0
  6  4  1  0  0  0
  7 15  1  0  0  0
  8 16  1  0  0  0
  9  6  2  0  0  0
  9 12  1  0  0  0
  9 17  1  0  0  0
 10  5  2  0  0  0
 11  7  1  0  0  0
 11 13  1  0  0  0
 12 11  2  0  0  0
 12 18  1  0  0  0
 13 19  1  0  0  0
 13 20  1  0  0  0
 13 21  1  0  0  0
M  END
$$$$
