RZJ
  CCTOOLS-0919241044

 29 30  0  0  0  0  0  0  0  0999 V2000
    0.0050   -0.6010   -0.1770 C   0  0  0  0  0
   -1.8330   -2.4970    0.3180 C   0  0  0  0  0
   -3.6130   -0.8620    0.2380 C   0  0  0  0  0
   -4.0290    0.4700   -0.3980 C   0  0  0  0  0
   -3.1050    1.5620    0.1460 C   0  0  0  0  0
   -1.6720    1.0980    0.0690 C   0  0  0  0  0
   -0.6700    2.0470    0.1980 C   0  0  0  0  0
    0.6580    1.6770    0.1350 C   0  0  0  0  0
    0.9950    0.3490   -0.0520 C   0  0  0  0  0
   -1.3400   -0.2310   -0.1240 C   0  0  0  0  0
   -2.2950   -1.2360   -0.2790 N   0  0  0  0  0
    3.1700   -0.4790    1.4170 N   0  0  0  0  0
    2.7290   -1.3540   -0.8480 O   0  0  0  0  0
    3.4150    1.0280   -0.5220 O   0  0  0  0  0
    2.6900   -0.1290   -0.1280 S   0  0  0  0  0
    0.2710   -1.6380   -0.3230 H   0  0  0  0  0
   -2.6050   -3.2580    0.2010 H   0  0  0  0  0
   -0.9210   -2.8230   -0.1810 H   0  0  0  0  0
   -1.6320   -2.3440    1.3790 H   0  0  0  0  0
   -3.5630   -0.7500    1.3210 H   0  0  0  0  0
   -4.3380   -1.6350   -0.0180 H   0  0  0  0  0
   -3.9290    0.4080   -1.4820 H   0  0  0  0  0
   -5.0620    0.6970   -0.1360 H   0  0  0  0  0
   -3.2250    2.4680   -0.4480 H   0  0  0  0  0
   -3.3630    1.7710    1.1840 H   0  0  0  0  0
   -0.9310    3.0850    0.3440 H   0  0  0  0  0
    1.4330    2.4220    0.2350 H   0  0  0  0  0
    2.5410   -0.3990    2.1510 H   0  0  0  0  0
    4.0810   -0.7650    1.5890 H   0  0  0  0  0
  1 16  1  0  0  0
  2 17  1  0  0  0
  2 18  1  0  0  0
  2 19  1  0  0  0
  3 11  1  0  0  0
  3 20  1  0  0  0
  3 21  1  0  0  0
  4  5  1  0  0  0
  4  3  1  0  0  0
  4 22  1  0  0  0
  4 23  1  0  0  0
  5  6  1  0  0  0
  5 24  1  0  0  0
  5 25  1  0  0  0
  6 10  2  0  0  0
  7  8  2  0  0  0
  7  6  1  0  0  0
  7 26  1  0  0  0
  8  9  1  0  0  0
  8 27  1  0  0  0
  9 15  1  0  0  0
  9  1  2  0  0  0
 10  1  1  0  0  0
 10 11  1  0  0  0
 11  2  1  0  0  0
 12 15  1  0  0  0
 12 28  1  0  0  0
 12 29  1  0  0  0
 14 15  2  0  0  0
 15 13  2  0  0  0
M  END
$$$$
