50J
  CCTOOLS-0919241034

 65 69  0  0  0  0  0  0  0  0999 V2000
    9.9650    0.6870    0.6240 C   0  0  0  0  0
    7.6370    0.4680   -0.0610 C   0  0  0  0  0
    7.7050    1.5830   -0.5420 O   0  0  0  0  0
    5.1200   -2.2860    0.3350 C   0  0  0  0  0
    4.0090   -1.7280   -0.2910 C   0  0  0  0  0
    1.6370   -1.8090   -0.2670 C   0  0  0  0  0
    0.3770   -2.5830   -0.2430 C   0  0  0  0  0
    0.4110   -3.9770   -0.3170 C   0  0  0  0  0
   -0.7650   -4.7000   -0.2940 C   0  0  0  0  0
   -1.9800   -4.0500   -0.1980 C   0  0  0  0  0
   -2.0270   -2.6590   -0.1240 C   0  0  0  0  0
   -4.4790   -2.6950   -0.0020 C   0  0  0  0  0
   -6.9770   -2.5000    0.1310 C   0  0  0  0  0
   -7.7680   -1.4060    0.2310 C   0  0  0  0  0
   -6.9920   -0.3220    0.2540 N   0  0  0  0  0
   -5.7270   -0.6920    0.1710 C   0  0  0  0  0
   -4.5140    1.4140    0.2070 N   0  0  0  0  0
   -3.3070    2.1180    0.2870 C   0  0  0  0  0
   -0.9130    3.5070    0.4470 C   0  0  0  0  0
    1.3320    3.5570    1.2320 C   0  0  0  0  0
   -1.9950    4.0610   -0.2310 C   0  0  0  0  0
   -3.0280    5.7900   -1.4960 C   0  0  0  0  0
    8.7140   -0.0710    0.5450 N   0  0  0  0  0
    6.3760   -0.2950   -0.1410 C   0  0  0  0  0
    6.2970   -1.5760    0.4120 C   0  0  0  0  0
    2.8190   -2.4480   -0.3670 N   0  0  0  0  0
    1.6060   -0.5960   -0.1980 O   0  0  0  0  0
   -0.8460   -1.9230   -0.1400 C   0  0  0  0  0
   -3.3340   -1.9640   -0.0220 C   0  0  0  0  0
   -5.6890   -2.0610    0.0930 N   0  0  0  0  0
   -4.5060    0.0300    0.1420 C   0  0  0  0  0
   -2.2240    1.5660    0.9590 C   0  0  0  0  0
   -1.0310    2.2600    1.0380 C   0  0  0  0  0
    0.2620    4.1880    0.5250 O   0  0  0  0  0
   -1.8780    5.2830   -0.8160 O   0  0  0  0  0
   -3.1900    3.3660   -0.3110 C   0  0  0  0  0
   -3.3650   -0.6220    0.0500 N   0  0  0  0  0
    4.0850   -0.4520   -0.8420 C   0  0  0  0  0
    5.2590    0.2620   -0.7690 C   0  0  0  0  0
   10.3160    0.9140   -0.3820 H   0  0  0  0  0
    9.7940    1.6150    1.1690 H   0  0  0  0  0
   10.7170    0.0940    1.1460 H   0  0  0  0  0
    5.0570   -3.2740    0.7650 H   0  0  0  0  0
    1.3580   -4.4900   -0.3920 H   0  0  0  0  0
   -0.7340   -5.7780   -0.3520 H   0  0  0  0  0
   -2.8960   -4.6220   -0.1820 H   0  0  0  0  0
   -4.4360   -3.7720   -0.0640 H   0  0  0  0  0
   -7.3060   -3.5280    0.0900 H   0  0  0  0  0
   -8.8470   -1.4100    0.2840 H   0  0  0  0  0
   -5.3560    1.8950    0.1980 H   0  0  0  0  0
    1.0290    3.3760    2.2630 H   0  0  0  0  0
    1.5750    2.6090    0.7520 H   0  0  0  0  0
    2.2080    4.2050    1.2190 H   0  0  0  0  0
   -2.8000    6.7690   -1.9160 H   0  0  0  0  0
   -3.3060    5.1060   -2.2990 H   0  0  0  0  0
   -3.8560    5.8800   -0.7930 H   0  0  0  0  0
    8.6600   -0.9600    0.9290 H   0  0  0  0  0
    7.1590   -2.0100    0.8980 H   0  0  0  0  0
    2.8410   -3.4100   -0.4910 H   0  0  0  0  0
   -0.8780   -0.8450   -0.0770 H   0  0  0  0  0
   -2.3150    0.5940    1.4200 H   0  0  0  0  0
   -0.1900    1.8290    1.5610 H   0  0  0  0  0
   -4.0300    3.7950   -0.8360 H   0  0  0  0  0
    3.2210   -0.0230   -1.3280 H   0  0  0  0  0
    5.3170    1.2520   -1.1970 H   0  0  0  0  0
  1 40  1  0  0  0
  1 41  1  0  0  0
  1 42  1  0  0  0
  2  3  2  0  0  0
  4 25  2  0  0  0
  4  5  1  0  0  0
  4 43  1  0  0  0
  5 38  2  0  0  0
  6  7  1  0  0  0
  6 26  1  0  0  0
  7 28  2  0  0  0
  8  9  2  0  0  0
  8  7  1  0  0  0
  8 44  1  0  0  0
  9 10  1  0  0  0
  9 45  1  0  0  0
 10 11  2  0  0  0
 10 46  1  0  0  0
 11 29  1  0  0  0
 12 30  1  0  0  0
 12 47  1  0  0  0
 13 14  2  0  0  0
 13 48  1  0  0  0
 14 15  1  0  0  0
 14 49  1  0  0  0
 16 15  2  0  0  0
 17 50  1  0  0  0
 18 17  1  0  0  0
 18 32  2  0  0  0
 19 33  2  0  0  0
 20 51  1  0  0  0
 20 52  1  0  0  0
 20 53  1  0  0  0
 21 36  2  0  0  0
 21 19  1  0  0  0
 22 35  1  0  0  0
 22 54  1  0  0  0
 22 55  1  0  0  0
 22 56  1  0  0  0
 23  2  1  0  0  0
 23  1  1  0  0  0
 23 57  1  0  0  0
 24 39  2  0  0  0
 24  2  1  0  0  0
 25 24  1  0  0  0
 25 58  1  0  0  0
 26  5  1  0  0  0
 26 59  1  0  0  0
 27  6  2  0  0  0
 28 11  1  0  0  0
 28 60  1  0  0  0
 29 12  2  0  0  0
 29 37  1  0  0  0
 30 13  1  0  0  0
 30 16  1  0  0  0
 31 16  1  0  0  0
 31 17  1  0  0  0
 32 61  1  0  0  0
 33 32  1  0  0  0
 33 62  1  0  0  0
 34 19  1  0  0  0
 34 20  1  0  0  0
 35 21  1  0  0  0
 36 18  1  0  0  0
 36 63  1  0  0  0
 37 31  2  0  0  0
 38 39  1  0  0  0
 38 64  1  0  0  0
 39 65  1  0  0  0
M  END
$$$$
