A1JTN
  CCTOOLS-0807261402

 30 33  0  0  0  0  0  0  0  0999 V2000
    0.0280    0.8720    0.1240 RH  0  0  0  0  0
    1.7720   -0.6110   -0.3270 RH  0  0  0  0  0
    2.8290    0.2710    1.2330 O   0  0  0  0  0
    2.5460    0.8010   -1.6410 O   0  0  0  0  0
   -0.7780   -0.5530    1.4260 O   0  5  0  0  0
   -0.9940    0.0740   -1.5170 O   0  5  0  0  0
    2.0340    0.8110    2.0370 C   0  0  0  0  0
    2.1380    1.9400   -1.3130 C   0  0  0  0  0
   -0.5430   -1.0000   -1.9880 C   0  0  0  0  0
   -0.2780   -1.6990    1.3180 C   0  0  0  0  0
   -1.5050   -1.8950   -2.7200 C   0  0  0  0  0
    0.6450   -1.3960   -1.9020 O   0  0  0  0  0
    2.1430    0.4550    3.4940 C   0  0  0  0  0
    1.1480    1.6330    1.7050 O   0  5  0  0  0
    3.1560    3.0220   -1.0840 C   0  0  0  0  0
    0.9300    2.2360   -1.1640 O   0  5  0  0  0
   -1.1810   -2.8830    1.5280 C   0  0  0  0  0
    0.9240   -1.9390    1.0480 O   0  0  0  0  0
   -2.3870   -1.4930   -2.7280 H   0  0  0  0  0
   -1.5490   -2.7560   -2.2780 H   0  0  0  0  0
   -1.2030   -2.0190   -3.6330 H   0  0  0  0  0
    2.8610   -0.1830    3.6220 H   0  0  0  0  0
    1.3100    0.0630    3.7960 H   0  0  0  0  0
    2.3270    1.2530    4.0110 H   0  0  0  0  0
    4.0470    2.6700   -1.2290 H   0  0  0  0  0
    3.0850    3.3470   -0.1740 H   0  0  0  0  0
    2.9960    3.7540   -1.6980 H   0  0  0  0  0
   -2.0800   -2.5780    1.7280 H   0  0  0  0  0
   -0.8530   -3.4160    2.2680 H   0  0  0  0  0
   -1.1990   -3.4260    0.7260 H   0  0  0  0  0
  1  2  1  0  0  0
  1  5  1  0  0  0
  1  6  1  0  0  0
  1 14  1  0  0  0
  1 16  1  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  2 18  1  0  0  0
  2 12  1  0  0  0
  3  7  2  0  0  0
  4  8  2  0  0  0
  5 10  1  0  0  0
  6  9  1  0  0  0
  7 13  1  0  0  0
  7 14  1  0  0  0
  8 15  1  0  0  0
  8 16  1  0  0  0
  9 11  1  0  0  0
  9 12  2  0  0  0
 10 17  1  0  0  0
 10 18  2  0  0  0
 11 19  1  0  0  0
 11 20  1  0  0  0
 11 21  1  0  0  0
 13 22  1  0  0  0
 13 23  1  0  0  0
 13 24  1  0  0  0
 15 25  1  0  0  0
 15 26  1  0  0  0
 15 27  1  0  0  0
 17 28  1  0  0  0
 17 29  1  0  0  0
 17 30  1  0  0  0
M  CHG  1   5  -1
M  CHG  1   6  -1
M  CHG  1  14  -1
M  CHG  1  16  -1
M  END
$$$$
