ADP
  CCTOOLS-1017250959

 42 44  0  0  1  0  0  0  0  0999 V2000
    1.1620   -0.2210   -5.6850 P   0  0  0  0  0
    1.7250    1.1330   -5.4920 O   0  0  0  0  0
    2.1900   -1.1120   -6.5460 O   0  0  0  0  0
   -0.2400   -0.1130   -6.4670 O   0  0  0  0  0
   -0.1050    0.0250   -3.4460 P   0  0  0  0  0
    0.4760    1.3760   -3.2880 O   0  0  0  0  0
   -1.4870    0.1290   -4.2660 O   0  0  0  0  0
    0.9250   -0.9130   -4.2500 O   0  0  0  0  0
   -0.3890   -0.6090   -1.9940 O   0  0  0  0  0
   -1.3070    0.2640   -1.3330 C   0  0  0  0  0
   -1.6200   -0.2840    0.0590 C   0  0  0  0  0
   -0.4170   -0.3480    0.8570 O   0  0  0  0  0
   -2.5500    0.6830    0.8250 C   0  0  0  0  0
   -3.9070    0.2450    0.7390 O   0  0  0  0  0
   -2.0470    0.6110    2.2860 C   0  0  0  0  0
   -3.0800    0.1290    3.1480 O   0  0  0  0  0
   -0.8710   -0.3880    2.2270 C   0  0  0  0  0
    0.2010    0.0310    3.1320 N   0  0  0  0  0
    1.2310    0.8700    2.8270 C   0  0  0  0  0
    2.0000    1.0270    3.8650 N   0  0  0  0  0
    1.5090    0.3050    4.9020 C   0  0  0  0  0
    1.9100    0.0870    6.2310 C   0  0  0  0  0
    3.0440    0.6970    6.7380 N   0  0  0  0  0
    1.1710   -0.7140    6.9910 N   0  0  0  0  0
    0.0880   -1.3000    6.5160 C   0  0  0  0  0
   -0.3210   -1.1300    5.2770 N   0  0  0  0  0
    0.3530   -0.3460    4.4420 C   0  0  0  0  0
    2.3040   -0.6640   -7.3960 H   0  0  0  0  0
   -0.5720   -1.0160   -6.5710 H   0  0  0  0  0
   -1.8330   -0.7700   -4.3460 H   0  0  0  0  0
   -2.2270    0.3300   -1.9130 H   0  0  0  0  0
   -0.8620    1.2550   -1.2420 H   0  0  0  0  0
   -2.0780   -1.2700   -0.0150 H   0  0  0  0  0
   -2.4510    1.6960    0.4350 H   0  0  0  0  0
   -4.4390    0.8840    1.2330 H   0  0  0  0  0
   -1.6990    1.5890    2.6180 H   0  0  0  0  0
   -3.8070    0.7640    3.0940 H   0  0  0  0  0
   -1.2120   -1.3910    2.4850 H   0  0  0  0  0
    1.3870    1.3350    1.8650 H   0  0  0  0  0
    3.3080    0.5420    7.6580 H   0  0  0  0  0
    3.5770    1.2770    6.1720 H   0  0  0  0  0
   -0.4820   -1.9440    7.1690 H   0  0  0  0  0
  1  2  2  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  1  8  1  0  0  0
  3 28  1  0  0  0
  4 29  1  0  0  0
  5  6  2  0  0  0
  5  7  1  0  0  0
  5  8  1  0  0  0
  5  9  1  0  0  0
  7 30  1  0  0  0
  9 10  1  0  0  0
 10 11  1  0  0  0
 10 31  1  0  0  0
 10 32  1  0  0  0
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 24 25  1  0  0  0
 25 26  2  0  0  0
 25 42  1  0  0  0
 26 27  1  0  0  0
M  END
$$$$
