AOV
  CCTOOLS-0807261402

 49 51  0  0  1  0  0  0  0  0999 V2000
    5.1190    0.0010    2.8600 P   0  0  0  0  0
    5.9560   -0.3750    1.6530 O   0  0  0  0  0
    5.9320    0.7130    3.9240 O   0  5  0  0  0
    4.3610   -1.1900    3.4250 O   0  5  0  0  0
    3.6690    1.7030    0.9100 P   0  0  0  0  0
    2.6650    2.7780    1.1140 O   0  0  0  0  0
    4.9160    2.0230    0.1700 O   0  5  0  0  0
    4.0320    1.0880    2.3440 O   0  0  0  0  0
    2.9790    0.4120    0.2660 O   0  0  0  0  0
    2.3490    0.5620   -1.0310 C   0  0  0  0  0
    1.4040   -0.5950   -1.2510 C   0  0  0  0  0
    0.3940   -0.5760   -0.2220 O   0  0  0  0  0
    0.6120   -0.5900   -2.5630 C   0  0  0  0  0
    1.4000   -1.1840   -3.5890 O   0  0  0  0  0
   -0.6480   -1.3960   -2.2060 C   0  0  0  0  0
   -0.4840   -2.7860   -2.4170 O   0  0  0  0  0
   -0.8450   -1.0770   -0.7160 C   0  0  0  0  0
   -1.8860   -0.0930   -0.3950 N   0  0  0  0  0
   -2.1090    1.1400   -0.9600 C   0  0  0  0  0
   -3.1230    1.7870   -0.4410 N   0  0  0  0  0
   -3.5940    0.9320    0.5450 C   0  0  0  0  0
   -4.6580    1.0510    1.4590 C   0  0  0  0  0
   -5.4600    2.1140    1.5280 N   0  0  0  0  0
   -4.8620    0.0190    2.3140 N   0  0  0  0  0
   -4.0520   -1.0430    2.2400 C   0  0  0  0  0
   -3.0270   -1.2620    1.4230 N   0  0  0  0  0
   -2.8410   -0.2260    0.5860 C   0  0  0  0  0
    2.4720   -0.9700    3.8970 V   0  0  0  0  0
    3.0070    0.4540    5.0980 O   0  6  0  0  0
    2.1820   -2.2000    4.8950 O   0  5  0  0  0
    2.0680   -1.7180    2.1660 O   0  5  0  0  0
    0.7660   -0.0750    3.7740 O   0  5  0  0  0
    5.5710    1.6290    0.1770 H   0  0  0  0  0
    4.0600   -3.1400   -0.1020 H   0  0  0  0  0
    3.0400    0.5710   -1.7430 H   0  0  0  0  0
    1.8460    1.4170   -1.0690 H   0  0  0  0  0
    1.9250   -1.4370   -1.1800 H   0  0  0  0  0
    0.3580    0.3340   -2.8260 H   0  0  0  0  0
   -1.0450   -1.9430   -0.2250 H   0  0  0  0  0
    1.0290   -1.0910   -4.3390 H   0  0  0  0  0
   -1.4230   -1.0600   -2.7240 H   0  0  0  0  0
   -1.2220   -3.1850   -2.3560 H   0  0  0  0  0
   -1.5870    1.4820   -1.6660 H   0  0  0  0  0
   -6.1130    2.1400    2.1200 H   0  0  0  0  0
   -5.3380    2.7930    0.9810 H   0  0  0  0  0
   -4.2360   -1.7370    2.8560 H   0  0  0  0  0
    1.3500   -2.4320    4.8330 H   0  0  0  0  0
    1.2790   -2.0760    2.1820 H   0  0  0  0  0
    0.1320   -0.6650    3.7490 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 33  1  0  0  0
  4 28  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 34  1  0  0  0
  9 10  1  0  0  0
 10 11  1  0  0  0
 10 35  1  0  0  0
 10 36  1  0  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 11 37  1  0  0  0
 12 17  1  0  0  0
 13 14  1  0  0  0
 13 15  1  0  0  0
 13 38  1  0  0  0
 14 40  1  0  0  0
 15 16  1  0  0  0
 15 17  1  0  0  0
 15 41  1  0  0  0
 16 42  1  0  0  0
 17 18  1  0  0  0
 17 39  1  0  0  0
 18 19  1  0  0  0
 18 27  1  0  0  0
 19 20  2  0  0  0
 19 43  1  0  0  0
 20 21  1  0  0  0
 21 22  1  0  0  0
 21 27  2  0  0  0
 22 23  1  0  0  0
 22 24  2  0  0  0
 23 44  1  0  0  0
 23 45  1  0  0  0
 24 25  1  0  0  0
 25 26  2  0  0  0
 25 46  1  0  0  0
 26 27  1  0  0  0
 28 29  2  0  0  0
 28 30  1  0  0  0
 28 31  1  0  0  0
 28 32  1  0  0  0
 30 47  1  0  0  0
 31 48  1  0  0  0
 32 49  1  0  0  0
M  CHG  1   3  -1
M  CHG  1   4  -1
M  CHG  1   7  -1
M  CHG  1  29  -2
M  CHG  1  30  -1
M  CHG  1  31  -1
M  CHG  1  32  -1
M  END
$$$$
