J2O
  CCTOOLS-0807261403

 26 28  0  0  1  0  0  0  0  0999 V2000
    0.0080   -2.4030    0.1590 O   0  5  0  0  0
    1.9040   -0.2460   -0.2470 N   0  5  0  0  0
   -2.6570    0.6540    0.6030 C   0  0  0  0  0
   -2.1990   -1.6560    0.0680 C   0  0  0  0  0
   -3.6350    1.7970    0.7740 C   0  0  0  0  0
   -0.7890   -1.4700    0.2960 C   0  0  0  0  0
    1.0980    0.0570    0.9310 C   0  0  0  0  0
   -1.3010    0.8330    0.8250 C   0  0  0  0  0
    3.8740   -0.2870   -1.2740 C   0  0  0  0  0
    3.2330   -1.3260   -2.4240 S   0  5  0  0  0
    3.1740    0.1040   -0.2570 N   0  0  0  0  0
    5.1340    0.1420   -1.3420 N   0  0  0  0  0
   -3.0840   -0.6040    0.2260 C   0  0  0  0  0
   -0.3730   -0.1960    0.6790 C   0  0  0  0  0
    1.4690   -1.9920   -1.1300 AU  0  0  0  0  0
   -2.5150   -2.5040   -0.1910 H   0  0  0  0  0
   -4.3890    1.6790    0.1710 H   0  0  0  0  0
   -3.1950    2.6410    0.5730 H   0  0  0  0  0
   -3.9580    1.8140    1.6910 H   0  0  0  0  0
    1.2370    0.9840    1.1790 H   0  0  0  0  0
   -0.9950    1.6910    1.0840 H   0  0  0  0  0
    5.6450   -0.1050   -2.0250 H   0  0  0  0  0
    5.4700    0.6720   -0.7120 H   0  0  0  0  0
   -4.0030   -0.7500    0.0700 H   0  0  0  0  0
    1.3950   -0.4990    1.6690 H   0  0  0  0  0
    1.1040   -3.9570   -2.2480 CL  0  5  0  0  0
  1  6  1  0  0  0
  2  7  1  0  0  0
  2 15  1  0  0  0
  3  5  1  0  0  0
  3 13  2  0  0  0
  4 13  1  0  0  0
  4 16  1  0  0  0
  5 17  1  0  0  0
  5 18  1  0  0  0
  5 19  1  0  0  0
  6  4  2  0  0  0
  7 14  1  0  0  0
  7 20  1  0  0  0
  7 25  1  0  0  0
  8  3  1  0  0  0
  8 21  1  0  0  0
  9 11  2  0  0  0
  9 10  1  0  0  0
 10 15  1  0  0  0
 11  2  1  0  0  0
 12  9  1  0  0  0
 12 22  1  0  0  0
 12 23  1  0  0  0
 13 24  1  0  0  0
 14  8  2  0  0  0
 14  6  1  0  0  0
 15  1  1  0  0  0
 26 15  1  0  0  0
M  CHG  1   1  -1
M  CHG  1   2  -1
M  CHG  1  10  -1
M  CHG  1  26  -1
M  END
$$$$
