X43
  CCTOOLS-0919241033

 41 43  0  0  0  0  0  0  0  0999 V2000
    0.5750   -0.5920   -0.2750 N   0  0  0  0  0
   -0.5120   -1.3080   -0.4420 C   0  0  0  0  0
   -0.4920   -2.6560   -0.7590 N   0  0  0  0  0
   -1.6810   -0.5870   -0.2730 C   0  0  0  0  0
   -2.9900   -1.0890   -0.3900 C   0  0  0  0  0
   -4.1440   -0.1630   -0.3480 C   0  0  0  0  0
   -5.3890   -0.6150    0.0930 C   0  0  0  0  0
   -6.4600    0.2540    0.1310 C   0  0  0  0  0
   -6.3030    1.5690   -0.2680 C   0  0  0  0  0
   -5.0710    2.0230   -0.7070 C   0  0  0  0  0
   -3.9910    1.1660   -0.7430 C   0  0  0  0  0
   -3.1740   -2.2870   -0.5260 O   0  0  0  0  0
   -1.2340    1.0720    0.1170 S   0  0  0  0  0
    0.4230    0.6660    0.0210 C   0  0  0  0  0
    1.4570    1.5510    0.2290 N   0  0  0  0  0
    2.7800    1.1030    0.1830 C   0  0  0  0  0
   -7.7810   -0.2230    0.5980 N   0  3  0  0  0
   -7.9210   -1.3810    0.9490 O   0  0  0  0  0
   -8.7280    0.5420    0.6320 O   0  5  0  0  0
    3.7890    1.9550   -0.2480 C   0  0  0  0  0
    5.0960    1.5090   -0.2920 C   0  0  0  0  0
    5.3990    0.2160    0.0910 C   0  0  0  0  0
    4.3970   -0.6350    0.5200 C   0  0  0  0  0
    3.0900   -0.1940    0.5730 C   0  0  0  0  0
    7.0670   -0.3500    0.0320 S   0  0  0  0  0
    7.0080   -1.7660   -0.0700 O   0  0  0  0  0
    7.7360    0.4700   -0.9170 O   0  0  0  0  0
    7.7510   -0.0150    1.5030 N   0  0  0  0  0
    0.3550   -3.1160   -0.8680 H   0  0  0  0  0
   -1.3240   -3.1410   -0.8720 H   0  0  0  0  0
   -5.5130   -1.6410    0.4040 H   0  0  0  0  0
   -7.1450    2.2440   -0.2380 H   0  0  0  0  0
   -4.9550    3.0510   -1.0170 H   0  0  0  0  0
   -3.0290    1.5230   -1.0820 H   0  0  0  0  0
    1.2680    2.4860    0.4070 H   0  0  0  0  0
    3.5530    2.9660   -0.5470 H   0  0  0  0  0
    5.8810    2.1710   -0.6260 H   0  0  0  0  0
    4.6380   -1.6450    0.8180 H   0  0  0  0  0
    2.3080   -0.8570    0.9120 H   0  0  0  0  0
    7.2260    0.4170    2.1940 H   0  0  0  0  0
    8.6760   -0.2520    1.6730 H   0  0  0  0  0
  1  2  1  0  0  0
  1 14  2  0  0  0
  2  3  1  0  0  0
  2  4  2  0  0  0
  3 29  1  0  0  0
  3 30  1  0  0  0
  4  5  1  0  0  0
  4 13  1  0  0  0
  5  6  1  0  0  0
  5 12  2  0  0  0
  6  7  2  0  0  0
  6 11  1  0  0  0
  7  8  1  0  0  0
  7 31  1  0  0  0
  8  9  2  0  0  0
  8 17  1  0  0  0
  9 10  1  0  0  0
  9 32  1  0  0  0
 10 11  2  0  0  0
 10 33  1  0  0  0
 11 34  1  0  0  0
 13 14  1  0  0  0
 14 15  1  0  0  0
 15 16  1  0  0  0
 15 35  1  0  0  0
 16 20  2  0  0  0
 16 24  1  0  0  0
 17 18  2  0  0  0
 17 19  1  0  0  0
 20 21  1  0  0  0
 20 36  1  0  0  0
 21 22  2  0  0  0
 21 37  1  0  0  0
 22 23  1  0  0  0
 22 25  1  0  0  0
 23 24  2  0  0  0
 23 38  1  0  0  0
 24 39  1  0  0  0
 25 26  2  0  0  0
 25 27  2  0  0  0
 25 28  1  0  0  0
 28 40  1  0  0  0
 28 41  1  0  0  0
M  CHG  1  17   1
M  CHG  1  19  -1
M  END
$$$$
