A1JMZ
  CCTOOLS-0116261006

 48 52  0  0  1  0  0  0  0  0999 V2000
    6.6990   -0.0780    1.0030 C   0  0  0  0  0
    4.5560   -0.4090    0.2400 C   0  0  0  0  0
    6.7860   -3.1440   -0.8330 N   0  0  0  0  0
    2.8520   -1.3720   -0.7760 C   0  0  0  0  0
    4.9700   -1.6050   -0.3710 C   0  0  0  0  0
    2.3390    0.8020    0.3970 C   0  0  0  0  0
    7.1350   -1.1910    0.4420 N   0  0  0  0  0
    0.1750    1.5690    0.3640 C   0  0  0  0  0
   -1.2420    1.2570   -0.1220 C   0  0  0  0  0
    6.3190   -1.9800   -0.2490 C   0  0  0  0  0
    0.9640    0.3610    0.4240 O   0  0  0  0  0
   -3.7110    0.0620    0.4310 C   0  0  0  0  0
   -3.9760    0.5580   -0.8530 C   0  0  0  0  0
   -5.1870    0.3640   -1.4390 C   0  0  0  0  0
   -6.1920   -0.3430   -0.7570 C   0  0  0  0  0
   -7.4530   -0.5580   -1.3400 C   0  0  0  0  0
   -8.4050   -1.2460   -0.6520 C   0  0  0  0  0
   -8.1500   -1.7430    0.6250 C   0  0  0  0  0
   -6.9420   -1.5540    1.2210 C   0  0  0  0  0
   -5.9330   -0.8480    0.5420 C   0  0  0  0  0
   -4.6750   -0.6350    1.1280 C   0  0  0  0  0
    0.9080    2.4690   -0.6560 C   0  0  0  0  0
    2.3640    1.9530   -0.6340 C   0  0  0  0  0
    5.4440    0.3130    0.9150 N   0  0  0  0  0
    3.2170   -0.2890   -0.0330 N   0  0  0  0  0
    3.8840   -2.1410   -0.9770 N   0  0  0  0  0
    0.8550    3.8370   -0.2450 O   0  0  0  0  0
    3.2550    2.9860   -0.2090 O   0  0  0  0  0
   -2.1280    0.3250    1.1580 S   0  0  0  0  0
    7.3950    0.5310    1.5590 H   0  0  0  0  0
    6.1800   -3.7120   -1.3340 H   0  0  0  0  0
    7.7190   -3.3930   -0.7410 H   0  0  0  0  0
    1.8570   -1.5620   -1.1490 H   0  0  0  0  0
    2.6400    1.1660    1.3790 H   0  0  0  0  0
    0.1430    2.0510    1.3410 H   0  0  0  0  0
   -1.7700    2.1880   -0.3240 H   0  0  0  0  0
   -1.1900    0.6630   -1.0340 H   0  0  0  0  0
   -3.2080    1.1020   -1.3820 H   0  0  0  0  0
   -5.3760    0.7530   -2.4290 H   0  0  0  0  0
   -7.6650   -0.1780   -2.3280 H   0  0  0  0  0
   -9.3720   -1.4100   -1.1040 H   0  0  0  0  0
   -8.9240   -2.2850    1.1490 H   0  0  0  0  0
   -6.7590   -1.9440    2.2120 H   0  0  0  0  0
   -4.4640   -1.0140    2.1170 H   0  0  0  0  0
    0.4740    2.3520   -1.6490 H   0  0  0  0  0
    2.6520    1.5810   -1.6170 H   0  0  0  0  0
    1.3000    4.4460   -0.8500 H   0  0  0  0  0
    3.2650    3.7600   -0.7890 H   0  0  0  0  0
  1 24  1  0  0  0
  1 30  1  0  0  0
  2 25  1  0  0  0
  3 10  1  0  0  0
  3 31  1  0  0  0
  3 32  1  0  0  0
  4 26  2  0  0  0
  4 33  1  0  0  0
  5 10  2  0  0  0
  5  2  1  0  0  0
  6 11  1  0  0  0
  6 34  1  0  0  0
  7  1  2  0  0  0
  8  9  1  0  0  0
  8 22  1  0  0  0
  8 35  1  0  0  0
  9 29  1  0  0  0
  9 36  1  0  0  0
  9 37  1  0  0  0
 10  7  1  0  0  0
 11  8  1  0  0  0
 12 13  1  0  0  0
 13 14  2  0  0  0
 13 38  1  0  0  0
 14 15  1  0  0  0
 14 39  1  0  0  0
 15 16  1  0  0  0
 16 17  2  0  0  0
 16 40  1  0  0  0
 17 18  1  0  0  0
 17 41  1  0  0  0
 18 19  2  0  0  0
 18 42  1  0  0  0
 19 20  1  0  0  0
 19 43  1  0  0  0
 20 21  1  0  0  0
 20 15  2  0  0  0
 21 12  2  0  0  0
 21 44  1  0  0  0
 22 27  1  0  0  0
 22 23  1  0  0  0
 22 45  1  0  0  0
 23 28  1  0  0  0
 23  6  1  0  0  0
 23 46  1  0  0  0
 24  2  2  0  0  0
 25  4  1  0  0  0
 25  6  1  0  0  0
 26  5  1  0  0  0
 27 47  1  0  0  0
 28 48  1  0  0  0
 29 12  1  0  0  0
M  END
$$$$
