A1EQU
  CCTOOLS-0403261050

 72 77  0  0  1  0  0  0  0  0999 V2000
   -4.1050    0.6650    0.7100 C   0  0  0  0  0
   -1.3500   -0.2730    0.7780 C   0  0  0  0  0
    1.1370    0.7520   -1.5730 C   0  0  0  0  0
    3.2900    0.7190   -0.5160 C   0  0  0  0  0
    2.4660    0.3880   -1.5860 C   0  0  0  0  0
    6.8130    0.3140    0.5300 C   0  0  0  0  0
    8.9690    0.2760    1.5790 C   0  0  0  0  0
    8.6610   -0.7530   -0.5640 C   0  0  0  0  0
   -1.2220    3.0530   -1.0620 C   0  0  0  0  0
   -3.4310    2.6750   -0.4990 C   0  0  0  0  0
   -3.0960    1.4450    0.1200 C   0  0  0  0  0
   -1.7530    1.0270    0.1320 C   0  0  0  0  0
   -0.8110    1.8490   -0.4700 C   0  0  0  0  0
   -4.7740    3.0920   -0.5100 C   0  0  0  0  0
   -5.7290    2.3140    0.0640 C   0  0  0  0  0
   -5.3990    1.1000    0.6750 C   0  0  0  0  0
   -7.7110    0.8530    1.1720 C   0  0  0  0  0
   -0.8190   -1.2310   -0.2900 C   0  0  0  0  0
    0.6190    1.4570   -0.4870 C   0  0  0  0  0
    1.4480    1.7930    0.5830 C   0  0  0  0  0
    2.7770    1.4270    0.5650 C   0  0  0  0  0
    7.6380    0.6430    1.5980 C   0  0  0  0  0
    9.4810   -0.4180    0.4990 C   0  0  0  0  0
    7.3290   -0.3890   -0.5510 C   0  0  0  0  0
   -0.5140   -2.5890    0.3480 C   0  0  0  0  0
   -1.3370   -2.2810   -2.4110 C   0  0  0  0  0
   -1.0460   -3.6690   -1.8330 C   0  0  0  0  0
   -1.3730   -3.6610   -0.3350 C   0  0  0  0  0
   -3.0910   -1.9100   -0.7830 C   0  0  0  0  0
   -2.8510   -3.2880   -0.1590 C   0  0  0  0  0
   -3.1890   -3.2420    1.3090 C   0  0  0  0  0
   -4.1140   -4.0340    1.7930 C   0  0  0  0  0
   -2.4770    3.4240   -1.0620 N   0  0  0  0  0
    4.6350    0.3500   -0.5320 N   0  0  0  0  0
    5.4660    0.6830    0.5460 N   0  0  0  0  0
   -1.8310   -1.4020   -1.3410 N   0  0  0  0  0
   -6.3770    0.3450    1.2410 O   0  0  0  0  0
   -0.3290   -0.0260    1.7470 O   0  0  0  0  0
   -3.8590   -0.2740    1.1830 H   0  0  0  0  0
   -2.2160   -0.7190    1.2680 H   0  0  0  0  0
    0.4980    0.4950   -2.4040 H   0  0  0  0  0
    2.8690   -0.1540   -2.4290 H   0  0  0  0  0
    9.6110    0.5320    2.4090 H   0  0  0  0  0
    9.0640   -1.2980   -1.4040 H   0  0  0  0  0
   -0.4840    3.6890   -1.5290 H   0  0  0  0  0
   -5.0460    4.0270   -0.9780 H   0  0  0  0  0
   -6.7590    2.6400    0.0520 H   0  0  0  0  0
   -8.3910    0.1550    1.6600 H   0  0  0  0  0
   -7.7590    1.8180    1.6760 H   0  0  0  0  0
   -8.0010    0.9730    0.1280 H   0  0  0  0  0
    0.0920   -0.8200   -0.7260 H   0  0  0  0  0
    1.0500    2.3430    1.4230 H   0  0  0  0  0
    3.4190    1.6870    1.3930 H   0  0  0  0  0
    7.2390    1.1860    2.4420 H   0  0  0  0  0
   10.5230   -0.7040    0.4860 H   0  0  0  0  0
    6.6900   -0.6500   -1.3810 H   0  0  0  0  0
    0.5410   -2.8270    0.2130 H   0  0  0  0  0
   -0.7470   -2.5540    1.4120 H   0  0  0  0  0
   -0.4230   -1.8630   -2.8320 H   0  0  0  0  0
   -2.0930   -2.3620   -3.1920 H   0  0  0  0  0
   -1.6650   -4.4110   -2.3380 H   0  0  0  0  0
    0.0070   -3.9110   -1.9780 H   0  0  0  0  0
   -1.1780   -4.6370    0.1090 H   0  0  0  0  0
   -3.8330   -1.9950   -1.5770 H   0  0  0  0  0
   -3.4540   -1.2230   -0.0190 H   0  0  0  0  0
   -3.4760   -4.0290   -0.6560 H   0  0  0  0  0
   -2.6680   -2.5570    1.9620 H   0  0  0  0  0
   -4.6340   -4.7190    1.1400 H   0  0  0  0  0
   -4.3560   -4.0020    2.8450 H   0  0  0  0  0
    4.9960   -0.1370   -1.2890 H   0  0  0  0  0
    5.1060    1.1700    1.3040 H   0  0  0  0  0
    0.5460    0.1260    1.3660 H   0  0  0  0  0
  1 39  1  0  0  0
  2 38  1  0  0  0
  2 40  1  0  0  0
  3  5  1  0  0  0
  3 41  1  0  0  0
  4 34  1  0  0  0
  4  5  2  0  0  0
  5 42  1  0  0  0
  6 35  1  0  0  0
  7 22  1  0  0  0
  7 43  1  0  0  0
  8 24  2  0  0  0
  8 44  1  0  0  0
  9 13  2  0  0  0
  9 45  1  0  0  0
 10 11  1  0  0  0
 11  1  1  0  0  0
 11 12  2  0  0  0
 12  2  1  0  0  0
 13 12  1  0  0  0
 13 19  1  0  0  0
 14 15  2  0  0  0
 14 10  1  0  0  0
 14 46  1  0  0  0
 15 16  1  0  0  0
 15 47  1  0  0  0
 16 37  1  0  0  0
 16  1  2  0  0  0
 17 48  1  0  0  0
 17 49  1  0  0  0
 17 50  1  0  0  0
 18 36  1  0  0  0
 18  2  1  0  0  0
 18 51  1  0  0  0
 19  3  2  0  0  0
 20 21  2  0  0  0
 20 19  1  0  0  0
 20 52  1  0  0  0
 21  4  1  0  0  0
 21 53  1  0  0  0
 22  6  2  0  0  0
 22 54  1  0  0  0
 23  7  2  0  0  0
 23  8  1  0  0  0
 23 55  1  0  0  0
 24  6  1  0  0  0
 24 56  1  0  0  0
 25 18  1  0  0  0
 25 57  1  0  0  0
 25 58  1  0  0  0
 26 36  1  0  0  0
 26 59  1  0  0  0
 26 60  1  0  0  0
 27 26  1  0  0  0
 27 61  1  0  0  0
 27 62  1  0  0  0
 28 30  1  0  0  0
 28 27  1  0  0  0
 28 25  1  0  0  0
 28 63  1  0  0  0
 29 36  1  0  0  0
 29 64  1  0  0  0
 29 65  1  0  0  0
 30 29  1  0  0  0
 30 66  1  0  0  0
 31 30  1  0  0  0
 31 67  1  0  0  0
 32 31  2  0  0  0
 32 68  1  0  0  0
 32 69  1  0  0  0
 33 10  2  0  0  0
 33  9  1  0  0  0
 34 70  1  0  0  0
 35 34  1  0  0  0
 35 71  1  0  0  0
 37 17  1  0  0  0
 38 72  1  0  0  0
M  END
$$$$
