A1IDZ
  CCTOOLS-1115241517

 50 52  0  0  1  0  0  0  0  0999 V2000
    4.0870    0.6790    2.1890 C   0  0  0  0  0
    2.4000   -0.8680    1.7140 C   0  0  0  0  0
    2.2560   -3.4070    0.0750 C   0  0  0  0  0
    1.0100   -4.0830   -0.5470 C   0  0  0  0  0
    1.4300   -1.4980    2.0880 O   0  0  0  0  0
   -1.2660   -3.1030   -0.1190 C   0  0  0  0  0
    0.0600   -2.9090   -0.8580 C   0  0  0  0  0
    4.6420    1.4350    2.9640 O   0  0  0  0  0
    2.1250   -1.9500   -0.4370 C   0  0  0  0  0
    3.9220   -0.3510   -0.0160 C   0  0  0  0  0
    4.5820    0.5170    0.8120 C   0  0  0  0  0
    5.7530    1.2690    0.3380 C   0  0  0  0  0
    6.5230    2.1610    1.0060 C   0  0  0  0  0
    7.6400    2.8060    0.3810 C   0  0  0  0  0
    7.9830    2.5660   -0.8910 C   0  0  0  0  0
    3.0070   -0.0340    2.5750 N   0  0  0  0  0
    2.8320   -1.0250    0.4520 N   0  0  0  0  0
    1.3610   -4.7730   -1.7480 O   0  0  0  0  0
   -2.1800   -2.0750   -0.5040 O   0  0  0  0  0
   -3.6280   -1.9310    1.5590 O   0  0  0  0  0
   -4.5310   -3.2470   -0.3970 O   0  0  0  0  0
   -4.3720   -0.6240   -0.4680 O   0  0  0  0  0
   -5.5580    0.4570    1.4810 O   0  0  0  0  0
   -6.9960   -0.4920   -0.3630 O   0  0  0  0  0
   -5.5830    1.6970   -0.7170 O   0  0  0  0  0
   -7.6300    2.9420    0.0770 O   0  0  0  0  0
   -5.3800    3.8880    0.7210 O   0  0  0  0  0
   -6.2620    4.0160   -1.7520 O   0  0  0  0  0
    0.7020   -1.7070   -0.4020 O   0  0  0  0  0
   -3.6770   -1.9680    0.0800 P   0  0  0  0  0
   -5.6260    0.2640    0.0150 P   0  0  0  0  0
   -6.2440    3.1320   -0.4070 P   0  0  0  0  0
    6.6230    1.2350   -1.4420 SE  0  0  0  0  0
    2.2150   -3.4420    1.1630 H   0  0  0  0  0
    3.1730   -3.8690   -0.2930 H   0  0  0  0  0
    0.5510   -4.7680    0.1660 H   0  0  0  0  0
   -1.6850   -4.0760   -0.3750 H   0  0  0  0  0
   -1.0930   -3.0530    0.9560 H   0  0  0  0  0
   -0.1190   -2.8520   -1.9320 H   0  0  0  0  0
    2.5040   -1.8660   -1.4560 H   0  0  0  0  0
    4.2560   -0.4950   -1.0320 H   0  0  0  0  0
    6.2890    2.3920    2.0350 H   0  0  0  0  0
    8.2240    3.5110    0.9550 H   0  0  0  0  0
    8.7950    2.9870   -1.4660 H   0  0  0  0  0
    2.6680    0.0560    3.4800 H   0  0  0  0  0
    2.0030   -5.4850   -1.6180 H   0  0  0  0  0
   -4.6050   -3.3350   -1.3570 H   0  0  0  0  0
   -7.1080   -0.6520   -1.3110 H   0  0  0  0  0
   -4.4590    4.0460    0.4720 H   0  0  0  0  0
   -6.6480    4.8960   -1.6400 H   0  0  0  0  0
  1 16  1  0  0  0
  2  5  2  0  0  0
  2 17  1  0  0  0
  3  4  1  0  0  0
  3 34  1  0  0  0
  3 35  1  0  0  0
  4 18  1  0  0  0
  4  7  1  0  0  0
  4 36  1  0  0  0
  6 19  1  0  0  0
  6 37  1  0  0  0
  6 38  1  0  0  0
  7  6  1  0  0  0
  7 29  1  0  0  0
  7 39  1  0  0  0
  8  1  2  0  0  0
  9  3  1  0  0  0
  9 40  1  0  0  0
 10 11  2  0  0  0
 10 41  1  0  0  0
 11 12  1  0  0  0
 11  1  1  0  0  0
 12 13  2  0  0  0
 13 14  1  0  0  0
 13 42  1  0  0  0
 14 15  2  0  0  0
 14 43  1  0  0  0
 15 33  1  0  0  0
 15 44  1  0  0  0
 16  2  1  0  0  0
 16 45  1  0  0  0
 17  9  1  0  0  0
 17 10  1  0  0  0
 18 46  1  0  0  0
 19 30  1  0  0  0
 21 47  1  0  0  0
 22 31  1  0  0  0
 24 48  1  0  0  0
 25 32  1  0  0  0
 27 49  1  0  0  0
 28 50  1  0  0  0
 29  9  1  0  0  0
 30 20  2  0  0  0
 30 21  1  0  0  0
 30 22  1  0  0  0
 31 23  2  0  0  0
 31 24  1  0  0  0
 31 25  1  0  0  0
 32 26  2  0  0  0
 32 27  1  0  0  0
 32 28  1  0  0  0
 33 12  1  0  0  0
M  END
$$$$
