MDPI-ZINC03852568
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.4250    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6260   -0.6180    1.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2060    0.1390    2.0470 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8420   -0.4920    3.1070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8950   -1.8800    3.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3150   -2.6300    2.1540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6770   -2.0040    1.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0510   -2.8120    0.0290 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0960   -4.0280    0.0790 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5070   -2.2610   -0.9020 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.4290    0.2670    4.1220 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8020    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.7860   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7760    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1640    1.2170    2.0050 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3900   -2.3720    3.9820 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3570   -3.7090    2.1940 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3920    1.2360    4.0860 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8730   -0.1740    4.8630 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  2  0  0  0  0
  6 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 19  1  0  0  0  0
 12 20  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END