A1CIB
  CCTOOLS-0605261016

 33 35  0  0  1  0  0  0  0  0999 V2000
    2.8380    2.1590    1.0830 O   0  0  0  0  0
    3.2890    1.0570    0.3080 S   0  0  0  0  0
    3.8850    1.2010   -0.9750 O   0  0  0  0  0
    4.3870    0.2440    1.2440 N   0  0  0  0  0
    1.8990   -0.0040    0.0940 C   0  0  0  0  0
    0.6720    0.3500    0.6230 C   0  0  0  0  0
    2.0330   -1.1880   -0.6070 C   0  0  0  0  0
    3.5740   -1.6340   -1.2710 CL  0  0  0  0  0
    0.9400   -2.0180   -0.7790 C   0  0  0  0  0
   -0.2870   -1.6630   -0.2500 C   0  0  0  0  0
   -0.4190   -0.4820    0.4560 C   0  0  0  0  0
   -1.7570   -0.0950    1.0330 C   0  0  0  0  0
   -1.5730    0.6840    2.2170 O   0  0  0  0  0
   -2.5540    0.6830    0.0170 C   0  0  0  0  0
   -2.3410    1.8730   -0.6370 C   0  0  0  0  0
   -3.2800    2.3450   -1.5400 C   0  0  0  0  0
   -4.4340    1.6220   -1.7840 C   0  0  0  0  0
   -4.6580    0.4260   -1.1330 C   0  0  0  0  0
   -3.7160   -0.0560   -0.2230 C   0  0  0  0  0
   -3.6710   -1.2720    0.6110 C   0  0  0  0  0
   -4.5330   -2.1280    0.6370 O   0  0  0  0  0
   -2.5410   -1.2980    1.3380 N   0  0  0  0  0
    4.3570    0.3290    2.2100 H   0  0  0  0  0
    5.0600   -0.3160    0.8270 H   0  0  0  0  0
    0.5650    1.2780    1.1670 H   0  0  0  0  0
    1.0430   -2.9410   -1.3310 H   0  0  0  0  0
   -1.1400   -2.3110   -0.3840 H   0  0  0  0  0
   -1.0790    0.2310    2.9140 H   0  0  0  0  0
   -1.4410    2.4400   -0.4480 H   0  0  0  0  0
   -3.1110    3.2800   -2.0530 H   0  0  0  0  0
   -5.1630    1.9950   -2.4880 H   0  0  0  0  0
   -5.5600   -0.1350   -1.3260 H   0  0  0  0  0
   -2.2860   -1.9960    1.9610 H   0  0  0  0  0
  2  3  2  0  0  0
  2  1  2  0  0  0
  4  2  1  0  0  0
  4 23  1  0  0  0
  4 24  1  0  0  0
  5  6  1  0  0  0
  5  2  1  0  0  0
  6 25  1  0  0  0
  7  5  2  0  0  0
  8  7  1  0  0  0
  9 10  2  0  0  0
  9  7  1  0  0  0
  9 26  1  0  0  0
 10 11  1  0  0  0
 10 27  1  0  0  0
 11 12  1  0  0  0
 11  6  2  0  0  0
 12 22  1  0  0  0
 12 13  1  0  0  0
 13 28  1  0  0  0
 14 12  1  0  0  0
 15 14  2  0  0  0
 15 29  1  0  0  0
 16 15  1  0  0  0
 16 30  1  0  0  0
 17 16  2  0  0  0
 17 18  1  0  0  0
 17 31  1  0  0  0
 18 19  2  0  0  0
 18 32  1  0  0  0
 19 14  1  0  0  0
 19 20  1  0  0  0
 20 21  2  0  0  0
 20 22  1  0  0  0
 22 33  1  0  0  0
M  END
$$$$
