REP
  CCTOOLS-0807261402

 29 32  0  0  0  0  0  0  0  0999 V2000
   -1.0580    0.4230   -0.0070 RE  0  0  0  0  0
    0.1090   -1.3120   -0.0110 N   0  0  0  0  0
    0.8240    1.3360    0.0190 N   0  0  0  0  0
   -1.0280    0.4500   -3.1600 O   0  0  0  0  0
   -1.0870    0.3960    3.1470 O   0  0  0  0  0
   -3.6760   -1.3350   -0.0460 O   0  0  0  0  0
   -1.0370    0.4420   -2.1560 C   0  0  0  0  0
   -1.0780    0.4050    2.1430 C   0  0  0  0  0
   -2.8430   -0.7750   -0.0330 C   0  0  0  0  0
   -0.2370   -2.6570   -0.0200 C   0  0  0  0  0
    0.7000   -3.6220   -0.0240 C   0  0  0  0  0
    2.0760   -3.3150   -0.0170 C   0  0  0  0  0
    2.4830   -1.9880   -0.0030 C   0  0  0  0  0
    1.4520   -0.9390    0.0020 C   0  0  0  0  0
    1.7970    0.3380    0.0160 C   0  0  0  0  0
    3.2160    0.7250    0.0290 C   0  0  0  0  0
    3.5320    2.0770    0.0450 C   0  0  0  0  0
    2.4970    3.0350    0.0490 C   0  0  0  0  0
    1.2010    2.6730    0.0360 C   0  0  0  0  0
    3.8930   -1.6140    0.0070 C   0  0  0  0  0
    4.2460   -0.3070    0.0230 C   0  0  0  0  0
   -1.2840   -2.9360   -0.0250 H   0  0  0  0  0
    0.3890   -4.6600   -0.0330 H   0  0  0  0  0
    2.8080   -4.1080   -0.0220 H   0  0  0  0  0
    4.5630    2.3940    0.0560 H   0  0  0  0  0
    2.7500    4.0880    0.0630 H   0  0  0  0  0
    0.4370    3.4400    0.0390 H   0  0  0  0  0
    4.6550   -2.3790    0.0020 H   0  0  0  0  0
    5.2890   -0.0290    0.0300 H   0  0  0  0  0
  1  2  1  0  0  0
  1  3  1  0  0  0
  1  7  1  0  0  0
  1  8  1  0  0  0
  1  9  1  0  0  0
  2 10  1  0  0  0
  2 14  2  0  0  0
  3 15  2  0  0  0
  3 19  1  0  0  0
  4  7  3  0  0  0
  5  8  3  0  0  0
  6  9  3  0  0  0
 10 11  2  0  0  0
 10 22  1  0  0  0
 11 12  1  0  0  0
 11 23  1  0  0  0
 12 13  2  0  0  0
 12 24  1  0  0  0
 13 14  1  0  0  0
 13 20  1  0  0  0
 14 15  1  0  0  0
 15 16  1  0  0  0
 16 17  2  0  0  0
 16 21  1  0  0  0
 17 18  1  0  0  0
 17 25  1  0  0  0
 18 19  2  0  0  0
 18 26  1  0  0  0
 19 27  1  0  0  0
 20 21  2  0  0  0
 20 28  1  0  0  0
 21 29  1  0  0  0
M  END
$$$$
