MTT
  CCTOOLS-0919241036

 87 90  0  0  1  0  0  0  0  0999 V2000
   -7.3620   -2.3420   -0.0960 C   0  0  0  0  0
   -7.4220   -1.3250    1.0470 C   0  0  0  0  0
   -6.5850   -0.0980    0.6720 C   0  0  0  0  0
   -5.1530   -0.5440    0.3660 C   0  0  0  0  0
   -5.1810   -1.5910   -0.7510 C   0  0  0  0  0
   -3.7590   -2.0860   -1.0220 C   0  0  0  0  0
   -7.9350   -1.7690   -1.2740 O   0  0  0  0  0
   -8.7780   -0.9300    1.2650 O   0  0  0  0  0
   -6.5750    0.8270    1.7620 O   0  0  0  0  0
   -4.3810    0.5820   -0.0550 O   0  0  0  0  0
   -6.0000   -2.6910   -0.3510 O   0  0  0  0  0
   -3.7720   -2.9910   -2.1280 O   0  0  0  0  0
   -3.8190    1.3370    1.0210 C   0  0  0  0  0
   -3.2850    2.6680    0.4860 C   0  0  0  0  0
   -2.1660    2.3930   -0.5220 C   0  0  0  0  0
   -1.0750    1.5590    0.1570 C   0  0  0  0  0
   -1.6930    0.2710    0.7050 C   0  0  0  0  0
   -0.6210   -0.5380    1.4380 C   0  0  0  0  0
   -4.3420    3.3840   -0.1560 O   0  0  0  0  0
   -1.6120    3.6310   -0.9720 O   0  0  0  0  0
   -0.0600    1.2350   -0.7950 O   0  0  0  0  0
   -2.7480    0.5980    1.6120 O   0  0  0  0  0
   -1.1740   -1.7840    1.8670 O   0  0  0  0  0
    0.9360    2.2490   -0.9520 C   0  0  0  0  0
    1.7830    1.9440   -2.1900 C   0  0  0  0  0
    2.5060    0.6090   -1.9880 C   0  0  0  0  0
    3.3490    0.6850   -0.7110 C   0  0  0  0  0
    2.4420    1.0390    0.4700 C   0  0  0  0  0
    3.2870    1.1760    1.7390 C   0  0  0  0  0
    0.9380    1.8600   -3.3390 O   0  0  0  0  0
    3.3570    0.3520   -3.1070 O   0  0  0  0  0
    3.9710   -0.5790   -0.4740 O   0  0  0  0  0
    1.7760    2.2750    0.2040 O   0  0  0  0  0
    2.4310    1.4170    2.8570 O   0  0  0  0  0
    5.2030   -0.7620   -1.1750 C   0  0  0  0  0
    5.6680   -2.2120   -1.0200 C   0  0  0  0  0
    5.9290   -2.5000    0.4620 C   0  0  0  0  0
    6.9600   -1.4990    0.9920 C   0  0  0  0  0
    6.4460   -0.0760    0.7590 C   0  0  0  0  0
    7.4980    0.9300    1.2310 C   0  0  0  0  0
    4.6550   -3.0940   -1.5070 O   0  0  0  0  0
    6.4330   -3.8290    0.6090 O   0  0  0  0  0
    7.1570   -1.7120    2.3910 O   0  0  0  0  0
    6.1930    0.1150   -0.6350 O   0  0  0  0  0
    6.9740    2.2540    1.1220 O   0  0  0  0  0
   -7.9210   -3.2350    0.1820 H   0  0  0  0  0
   -7.0220   -1.7750    1.9560 H   0  0  0  0  0
   -7.0140    0.3810   -0.2080 H   0  0  0  0  0
   -4.7060   -0.9780    1.2600 H   0  0  0  0  0
   -5.5890   -1.1450   -1.6580 H   0  0  0  0  0
   -3.1160   -1.2370   -1.2560 H   0  0  0  0  0
   -3.3780   -2.5980   -0.1390 H   0  0  0  0  0
   -7.9310   -2.3590   -2.0400 H   0  0  0  0  0
   -9.3660   -1.6590    1.5060 H   0  0  0  0  0
   -7.4510    1.1510    2.0110 H   0  0  0  0  0
   -2.9020   -3.3460   -2.3570 H   0  0  0  0  0
   -4.5870    1.5270    1.7700 H   0  0  0  0  0
   -2.8930    3.2610    1.3130 H   0  0  0  0  0
   -2.5680    1.8430   -1.3740 H   0  0  0  0  0
   -0.6370    2.1310    0.9760 H   0  0  0  0  0
   -2.0930   -0.3200   -0.1190 H   0  0  0  0  0
   -0.2720    0.0230    2.3050 H   0  0  0  0  0
    0.2170   -0.7240    0.7660 H   0  0  0  0  0
   -5.0860    3.5930    0.4250 H   0  0  0  0  0
   -2.2490    4.2100   -1.4120 H   0  0  0  0  0
   -0.5480   -2.3500    2.3400 H   0  0  0  0  0
    0.4520    3.2180   -1.0710 H   0  0  0  0  0
    2.5160    2.7370   -2.3330 H   0  0  0  0  0
    1.7740   -0.1930   -1.8950 H   0  0  0  0  0
    4.1150    1.4520   -0.8250 H   0  0  0  0  0
    1.7030    0.2500    0.6100 H   0  0  0  0  0
    3.8490    0.2570    1.9020 H   0  0  0  0  0
    3.9800    2.0100    1.6250 H   0  0  0  0  0
    0.4490    2.6730   -3.5270 H   0  0  0  0  0
    2.8880    0.2910   -3.9510 H   0  0  0  0  0
    2.9000    1.5150    3.6970 H   0  0  0  0  0
    5.0560   -0.5380   -2.2310 H   0  0  0  0  0
    6.5860   -2.3630   -1.5870 H   0  0  0  0  0
    5.0000   -2.3990    1.0240 H   0  0  0  0  0
    7.9050   -1.6360    0.4660 H   0  0  0  0  0
    5.5230    0.0740    1.3190 H   0  0  0  0  0
    7.7560    0.7250    2.2700 H   0  0  0  0  0
    8.3910    0.8400    0.6110 H   0  0  0  0  0
    4.4390   -2.9670   -2.4410 H   0  0  0  0  0
    5.8310   -4.5160    0.2930 H   0  0  0  0  0
    7.4810   -2.5960    2.6130 H   0  0  0  0  0
    7.5880    2.9450    1.4040 H   0  0  0  0  0
  1  7  1  0  0  0
  1 11  1  0  0  0
  1 46  1  0  0  0
  2  3  1  0  0  0
  2  1  1  0  0  0
  2 47  1  0  0  0
  3  4  1  0  0  0
  3 48  1  0  0  0
  4 10  1  0  0  0
  4  5  1  0  0  0
  4 49  1  0  0  0
  5  6  1  0  0  0
  5 50  1  0  0  0
  6 51  1  0  0  0
  6 52  1  0  0  0
  7 53  1  0  0  0
  8  2  1  0  0  0
  8 54  1  0  0  0
  9  3  1  0  0  0
  9 55  1  0  0  0
 11  5  1  0  0  0
 12  6  1  0  0  0
 12 56  1  0  0  0
 13 14  1  0  0  0
 13 10  1  0  0  0
 13 22  1  0  0  0
 13 57  1  0  0  0
 14 15  1  0  0  0
 14 58  1  0  0  0
 15 20  1  0  0  0
 15 16  1  0  0  0
 15 59  1  0  0  0
 16 21  1  0  0  0
 16 60  1  0  0  0
 17 16  1  0  0  0
 17 18  1  0  0  0
 17 61  1  0  0  0
 18 63  1  0  0  0
 18 62  1  0  0  0
 19 14  1  0  0  0
 19 64  1  0  0  0
 20 65  1  0  0  0
 21 24  1  0  0  0
 22 17  1  0  0  0
 23 18  1  0  0  0
 23 66  1  0  0  0
 24 33  1  0  0  0
 24 25  1  0  0  0
 24 67  1  0  0  0
 25 26  1  0  0  0
 25 68  1  0  0  0
 26 27  1  0  0  0
 26 31  1  0  0  0
 26 69  1  0  0  0
 27 32  1  0  0  0
 27 70  1  0  0  0
 28 29  1  0  0  0
 28 27  1  0  0  0
 28 71  1  0  0  0
 29 34  1  0  0  0
 29 72  1  0  0  0
 29 73  1  0  0  0
 30 25  1  0  0  0
 30 74  1  0  0  0
 31 75  1  0  0  0
 32 35  1  0  0  0
 33 28  1  0  0  0
 34 76  1  0  0  0
 35 44  1  0  0  0
 35 36  1  0  0  0
 35 77  1  0  0  0
 36 37  1  0  0  0
 36 78  1  0  0  0
 37 38  1  0  0  0
 37 42  1  0  0  0
 37 79  1  0  0  0
 38 43  1  0  0  0
 38 80  1  0  0  0
 39 40  1  0  0  0
 39 38  1  0  0  0
 39 81  1  0  0  0
 40 45  1  0  0  0
 40 82  1  0  0  0
 40 83  1  0  0  0
 41 36  1  0  0  0
 41 84  1  0  0  0
 42 85  1  0  0  0
 43 86  1  0  0  0
 44 39  1  0  0  0
 45 87  1  0  0  0
M  END
$$$$
