C12H10N2
APtclcactv03231719493D 0   0.00000     0.00000
 
 24 26  0  0  0  0  0  0  0  0999 V2000
   -2.4017   -1.3878   -0.0447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5888   -0.6910   -0.1914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5888    0.6909   -0.1917 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4017    1.3878   -0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2104    0.6976    0.1016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2105   -0.6975    0.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -1.3918    0.2500 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2103   -0.6975    0.1012 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4015   -1.3878   -0.0460 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5887   -0.6911   -0.1921 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5890    0.6908   -0.1908 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4019    1.3877   -0.0441 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2104    0.6976    0.1014 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001    1.3920    0.2488 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4052   -2.4677   -0.0402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5181   -1.2292   -0.3064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5181    1.2290   -0.3069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4047    2.4678   -0.0463 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.3404    0.4530 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4044   -2.4678   -0.0465 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5179   -1.2293   -0.3071 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5185    1.2289   -0.3042 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4052    2.4677   -0.0429 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001    2.3408    0.4506 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
  8 13  2  0  0  0  0
 13 14  1  0  0  0  0
  5 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3 17  1  0  0  0  0
  4 18  1  0  0  0  0
  7 19  1  0  0  0  0
  9 20  1  0  0  0  0
 10 21  1  0  0  0  0
 11 22  1  0  0  0  0
 12 23  1  0  0  0  0
 14 24  1  0  0  0  0
M  END
> <UNIQUE_SMILES>
N1C2=C(NC3=C1C=CC=C3)C=CC=C2

> <USER_SUPPLIED_SMILES>
C1=CC=CC2=C1NC=3C=CC=CC3N2

$$$$
