A5J
  CCTOOLS-0410261002

 47 48  0  0  1  0  0  0  0  0999 V2000
   -4.0960    3.1180   -1.0680 N   0  3  0  0  0
   -4.4740   -0.1690    0.6910 C   0  0  0  0  0
   -5.7030    0.0360    1.3010 C   0  0  0  0  0
   -6.2420   -0.9430    2.0700 O   0  0  0  0  0
   -6.3550    1.1760    1.1420 N   0  0  0  0  0
   -5.8650    2.1580    0.3990 C   0  0  0  0  0
   -6.5830    3.3390    0.2580 N   0  0  0  0  0
   -4.6390    2.0180   -0.2400 C   0  0  0  0  0
   -3.9300    0.8360   -0.0930 C   0  0  0  0  0
   -3.7350   -1.4680    0.8830 C   0  0  0  0  0
   -4.1890   -2.5150   -0.1670 C   0  0  0  0  0
   -2.9610   -3.4550   -0.2380 C   0  0  0  0  0
   -3.1670   -4.6090    0.5800 O   0  0  0  0  0
   -1.8000   -2.6030    0.3090 C   0  0  0  0  0
   -2.3280   -1.2990    0.6080 O   0  0  0  0  0
   -0.6960   -2.4910   -0.7450 C   0  0  0  0  0
    0.4240   -1.7990   -0.1890 O   0  0  0  0  0
   -4.8460    3.7930   -1.7510 O   0  0  0  0  0
   -2.9010    3.3510   -1.0630 O   0  5  0  0  0
    1.4300   -0.7800   -2.2670 O   0  0  0  0  0
    3.4740    1.7850   -0.9900 O   0  0  0  0  0
    6.6010    2.3650    0.3410 O   0  0  0  0  0
    2.4960   -2.8900   -1.3840 O   0  0  0  0  0
    4.8400   -0.2690   -1.5230 O   0  0  0  0  0
    6.5540    1.4600    2.6970 O   0  0  0  0  0
    2.7600   -0.5950   -0.1300 O   0  0  0  0  0
    4.9000    0.5730    0.8560 O   0  0  0  0  0
    7.4650    0.0200    0.6940 O   0  0  0  0  0
    1.7700   -1.5000   -1.0200 P   0  0  0  0  0
    4.0120    0.3600   -0.4700 P   0  0  0  0  0
    6.3850    1.1310    1.1300 P   0  0  0  0  0
   -5.9900   -0.8950    3.0020 H   0  0  0  0  0
   -7.4860    3.4020    0.6070 H   0  0  0  0  0
   -6.1810    4.1010   -0.1890 H   0  0  0  0  0
   -2.9750    0.7020   -0.5790 H   0  0  0  0  0
   -3.8860   -1.8480    1.8930 H   0  0  0  0  0
   -5.0720   -3.0530    0.1780 H   0  0  0  0  0
   -4.3750   -2.0430   -1.1310 H   0  0  0  0  0
   -2.7660   -3.7500   -1.2690 H   0  0  0  0  0
   -3.9230   -5.1510    0.3130 H   0  0  0  0  0
   -1.4030   -3.0570    1.2170 H   0  0  0  0  0
   -0.3890   -3.4890   -1.0570 H   0  0  0  0  0
   -1.0720   -1.9400   -1.6070 H   0  0  0  0  0
    2.9220    2.2550   -0.3500 H   0  0  0  0  0
    2.7480   -3.4160   -0.6130 H   0  0  0  0  0
    7.4270    1.8010    2.9350 H   0  0  0  0  0
    7.3820   -0.8170    1.1720 H   0  0  0  0  0
  1  8  1  0  0  0
  1 18  2  0  0  0
  2  3  1  0  0  0
  3  4  1  0  0  0
  3  5  2  0  0  0
  4 32  1  0  0  0
  6  5  1  0  0  0
  6  7  1  0  0  0
  7 33  1  0  0  0
  7 34  1  0  0  0
  8  6  2  0  0  0
  9  2  2  0  0  0
  9  8  1  0  0  0
  9 35  1  0  0  0
 10  2  1  0  0  0
 10 36  1  0  0  0
 11 10  1  0  0  0
 11 37  1  0  0  0
 11 38  1  0  0  0
 12 11  1  0  0  0
 12 39  1  0  0  0
 13 12  1  0  0  0
 13 40  1  0  0  0
 14 12  1  0  0  0
 14 15  1  0  0  0
 14 41  1  0  0  0
 15 10  1  0  0  0
 16 17  1  0  0  0
 16 14  1  0  0  0
 16 42  1  0  0  0
 16 43  1  0  0  0
 19  1  1  0  0  0
 20 29  2  0  0  0
 21 44  1  0  0  0
 22 31  2  0  0  0
 23 45  1  0  0  0
 24 30  2  0  0  0
 25 31  1  0  0  0
 25 46  1  0  0  0
 27 30  1  0  0  0
 28 47  1  0  0  0
 29 26  1  0  0  0
 29 23  1  0  0  0
 29 17  1  0  0  0
 30 21  1  0  0  0
 30 26  1  0  0  0
 31 28  1  0  0  0
 31 27  1  0  0  0
M  CHG  1   1   1
M  CHG  1  19  -1
M  END
$$$$
