0X3
  CCTOOLS-0919241031

 27 29  0  0  0  0  0  0  0  0999 V2000
   -3.7680    2.3990   -1.0260 CL  0  0  0  0  0
   -3.2640    0.8600   -0.4000 C   0  0  0  0  0
   -1.9450    0.4630   -0.5210 C   0  0  0  0  0
   -4.1820    0.0340    0.2250 C   0  0  0  0  0
   -3.7830   -1.1950    0.7250 C   0  0  0  0  0
   -4.6820   -1.9990    1.3350 F   0  0  0  0  0
   -2.4660   -1.5990    0.6020 C   0  0  0  0  0
   -1.5420   -0.7680   -0.0200 C   0  0  0  0  0
   -0.2100   -1.1710   -0.1410 N   0  0  0  0  0
    0.8180   -0.2680    0.1250 C   0  0  0  0  0
    2.1000   -0.6320   -0.1570 C   0  0  0  0  0
    2.3820   -1.9640   -0.7370 N   0  3  0  0  0
    2.5980   -2.9140   -0.0050 O   0  5  0  0  0
    2.3970   -2.1120   -1.9460 O   0  0  0  0  0
    0.4930    0.9870    0.6720 C   0  0  0  0  0
    1.4440    1.9130    0.9490 C   0  0  0  0  0
    2.8340    1.5940    0.6730 C   0  0  0  0  0
    3.1540    0.2600    0.1010 C   0  0  0  0  0
    4.0110    2.1550    0.7790 N   0  0  0  0  0
    4.8570    1.3820    0.3750 O   0  0  0  0  0
    4.4590    0.3040   -0.0190 N   0  0  0  0  0
   -1.2290    1.1100   -1.0050 H   0  0  0  0  0
   -5.2110    0.3470    0.3220 H   0  0  0  0  0
   -2.1560   -2.5560    0.9920 H   0  0  0  0  0
   -0.0010   -2.0790   -0.4110 H   0  0  0  0  0
   -0.5420    1.2200    0.8750 H   0  0  0  0  0
    1.1720    2.8720    1.3640 H   0  0  0  0  0
  1  2  1  0  0  0
  2  4  2  0  0  0
  2  3  1  0  0  0
  3  8  2  0  0  0
  3 22  1  0  0  0
  4  5  1  0  0  0
  4 23  1  0  0  0
  5  7  2  0  0  0
  5  6  1  0  0  0
  7 24  1  0  0  0
  8  7  1  0  0  0
  8  9  1  0  0  0
  9 25  1  0  0  0
 10 11  2  0  0  0
 10  9  1  0  0  0
 11 12  1  0  0  0
 12 14  2  0  0  0
 12 13  1  0  0  0
 15 10  1  0  0  0
 15 26  1  0  0  0
 16 17  1  0  0  0
 16 15  2  0  0  0
 16 27  1  0  0  0
 17 18  1  0  0  0
 18 21  2  0  0  0
 18 11  1  0  0  0
 19 17  2  0  0  0
 19 20  1  0  0  0
 20 21  1  0  0  0
M  CHG  1  12   1
M  CHG  1  13  -1
M  END
$$$$