OJT
  CCTOOLS-0919241027

 84 89  0  0  1  0  0  0  0  0999 V2000
   -0.2710    3.1040   -1.3090 C   0  0  0  0  0
   -1.5840    2.8380   -0.5700 C   0  0  0  0  0
   -1.3600    2.9720    0.9150 C   0  0  0  0  0
   -1.4340    4.2190    1.5180 C   0  0  0  0  0
   -1.7080    5.3210    0.7720 O   0  0  0  0  0
   -1.7690    6.5720    1.4610 C   0  0  0  0  0
   -1.2280    4.3390    2.8850 C   0  0  0  0  0
   -0.9500    3.2160    3.6410 C   0  0  0  0  0
   -0.8770    1.9750    3.0370 C   0  0  0  0  0
   -1.0870    1.8520    1.6760 C   0  0  0  0  0
    0.6770    2.0880   -0.9770 O   0  0  0  0  0
    1.9850    2.4400   -0.9910 C   0  0  0  0  0
    2.3450    3.6750   -1.3020 N   0  0  0  0  0
    3.6160    4.0320   -1.3200 C   0  0  0  0  0
    4.5830    3.1900   -1.0340 N   0  0  0  0  0
    4.3180    1.9190   -0.7070 C   0  0  0  0  0
    2.9870    1.4930   -0.6680 C   0  0  0  0  0
    2.8680    0.0910   -0.2970 C   0  0  0  0  0
    4.0560   -0.5210   -0.0650 C   0  0  0  0  0
    5.3910    0.5940   -0.2830 S   0  0  0  0  0
    4.2040   -1.9360    0.3250 C   0  0  0  0  0
    3.5480   -2.9350   -0.3980 C   0  0  0  0  0
    3.6920   -4.2580   -0.0270 C   0  0  0  0  0
    2.8780   -5.5020   -0.9230 CL  0  0  0  0  0
    4.4840   -4.5940    1.0580 C   0  0  0  0  0
    5.1360   -3.6080    1.7780 C   0  0  0  0  0
    5.0060   -2.2840    1.4150 C   0  0  0  0  0
    1.5670   -0.6060   -0.1840 C   0  0  0  0  0
    0.8860   -0.6210    1.0340 C   0  0  0  0  0
    1.4740    0.0710    2.2370 C   0  0  0  0  0
   -0.3270   -1.2710    1.1350 C   0  0  0  0  0
   -1.1760   -1.2910    2.6490 CL  0  0  0  0  0
   -0.8700   -1.9090    0.0270 C   0  0  0  0  0
   -2.0660   -2.5470    0.1300 O   0  0  0  0  0
   -2.5660   -3.1820   -1.0490 C   0  0  0  0  0
   -3.9110   -3.8430   -0.7400 C   0  0  0  0  0
   -4.8990   -2.8090   -0.4070 N   0  0  0  0  0
   -6.1310   -3.4100    0.1230 C   0  0  0  0  0
   -7.1020   -2.3000    0.5320 C   0  0  0  0  0
   -7.3920   -1.4520   -0.6330 N   0  0  0  0  0
   -8.3800   -0.4190   -0.2990 C   0  0  0  0  0
   -6.1600   -0.8510   -1.1630 C   0  0  0  0  0
   -5.1890   -1.9620   -1.5720 C   0  0  0  0  0
   -0.1950   -1.8940   -1.1860 C   0  0  0  0  0
    1.0160   -1.2430   -1.2960 C   0  0  0  0  0
   -0.5210    3.0920   -2.7950 C   0  0  0  0  0
   -1.3040    4.0290   -3.3520 O   0  0  0  0  0
   -0.0160    2.2380   -3.4850 O   0  0  0  0  0
    0.1210    4.0780   -1.0150 H   0  0  0  0  0
   -2.3350    3.5600   -0.8900 H   0  0  0  0  0
   -1.9300    1.8290   -0.7950 H   0  0  0  0  0
   -0.8090    6.7720    1.9360 H   0  0  0  0  0
   -1.9950    7.3670    0.7500 H   0  0  0  0  0
   -2.5490    6.5310    2.2200 H   0  0  0  0  0
   -1.2850    5.3080    3.3570 H   0  0  0  0  0
   -0.7900    3.3090    4.7060 H   0  0  0  0  0
   -0.6590    1.0990    3.6310 H   0  0  0  0  0
   -1.0340    0.8810    1.2070 H   0  0  0  0  0
    3.8700    5.0490   -1.5790 H   0  0  0  0  0
    2.9300   -2.6740   -1.2440 H   0  0  0  0  0
    4.5940   -5.6290    1.3430 H   0  0  0  0  0
    5.7560   -3.8770    2.6200 H   0  0  0  0  0
    5.5160   -1.5160    1.9780 H   0  0  0  0  0
    1.1290    1.1050    2.2650 H   0  0  0  0  0
    1.1560   -0.4430    3.1430 H   0  0  0  0  0
    2.5620    0.0530    2.1710 H   0  0  0  0  0
   -2.6980   -2.4380   -1.8340 H   0  0  0  0  0
   -1.8560   -3.9400   -1.3820 H   0  0  0  0  0
   -4.2490   -4.4020   -1.6130 H   0  0  0  0  0
   -3.7960   -4.5230    0.1040 H   0  0  0  0  0
   -6.5920   -4.0320   -0.6450 H   0  0  0  0  0
   -5.8920   -4.0230    0.9930 H   0  0  0  0  0
   -8.0280   -2.7430    0.8980 H   0  0  0  0  0
   -6.6520   -1.6950    1.3190 H   0  0  0  0  0
   -7.9920    0.2100    0.5020 H   0  0  0  0  0
   -8.5760    0.1940   -1.1790 H   0  0  0  0  0
   -9.3060   -0.8930    0.0270 H   0  0  0  0  0
   -6.3990   -0.2390   -2.0320 H   0  0  0  0  0
   -5.6990   -0.2300   -0.3950 H   0  0  0  0  0
   -4.2630   -1.5180   -1.9380 H   0  0  0  0  0
   -5.6390   -2.5670   -2.3590 H   0  0  0  0  0
   -0.6200   -2.3910   -2.0460 H   0  0  0  0  0
    1.5400   -1.2330   -2.2400 H   0  0  0  0  0
   -1.4340    3.9800   -4.3090 H   0  0  0  0  0
  1  2  1  0  0  0
  1 49  1  0  0  0
  2  3  1  0  0  0
  2 50  1  0  0  0
  2 51  1  0  0  0
  3 10  2  0  0  0
  3  4  1  0  0  0
  4  7  2  0  0  0
  5  4  1  0  0  0
  5  6  1  0  0  0
  6 52  1  0  0  0
  6 53  1  0  0  0
  6 54  1  0  0  0
  7  8  1  0  0  0
  7 55  1  0  0  0
  8 56  1  0  0  0
  9  8  2  0  0  0
  9 57  1  0  0  0
 10  9  1  0  0  0
 10 58  1  0  0  0
 11  1  1  0  0  0
 12 11  1  0  0  0
 13 12  1  0  0  0
 14 13  2  0  0  0
 14 59  1  0  0  0
 15 16  2  0  0  0
 15 14  1  0  0  0
 16 17  1  0  0  0
 17 18  1  0  0  0
 17 12  2  0  0  0
 18 28  1  0  0  0
 19 18  2  0  0  0
 20 16  1  0  0  0
 20 19  1  0  0  0
 21 19  1  0  0  0
 21 22  2  0  0  0
 22 60  1  0  0  0
 23 22  1  0  0  0
 23 24  1  0  0  0
 25 23  2  0  0  0
 25 61  1  0  0  0
 26 27  2  0  0  0
 26 25  1  0  0  0
 26 62  1  0  0  0
 27 21  1  0  0  0
 27 63  1  0  0  0
 28 29  2  0  0  0
 29 31  1  0  0  0
 29 30  1  0  0  0
 30 64  1  0  0  0
 30 65  1  0  0  0
 30 66  1  0  0  0
 31 32  1  0  0  0
 33 34  1  0  0  0
 33 31  2  0  0  0
 35 34  1  0  0  0
 35 36  1  0  0  0
 35 67  1  0  0  0
 35 68  1  0  0  0
 36 37  1  0  0  0
 36 69  1  0  0  0
 36 70  1  0  0  0
 37 38  1  0  0  0
 37 43  1  0  0  0
 38 39  1  0  0  0
 38 71  1  0  0  0
 38 72  1  0  0  0
 39 40  1  0  0  0
 39 73  1  0  0  0
 39 74  1  0  0  0
 40 41  1  0  0  0
 41 75  1  0  0  0
 41 76  1  0  0  0
 41 77  1  0  0  0
 42 40  1  0  0  0
 42 78  1  0  0  0
 42 79  1  0  0  0
 43 42  1  0  0  0
 43 80  1  0  0  0
 43 81  1  0  0  0
 44 33  1  0  0  0
 44 82  1  0  0  0
 45 44  2  0  0  0
 45 28  1  0  0  0
 45 83  1  0  0  0
 46  1  1  0  0  0
 47 46  1  0  0  0
 47 84  1  0  0  0
 48 46  2  0  0  0
M  END
$$$$
