22 26  0  0  0  0  0  0  0  0999 V2000
   19.6700  -17.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6700  -18.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8824  -19.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0949  -18.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0949  -17.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8824  -16.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4576  -19.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4576  -20.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6700  -21.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8824  -20.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3073  -19.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5197  -18.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5197  -17.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3073  -16.4500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   25.7322  -19.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9446  -18.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9446  -17.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7322  -16.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.1570  -16.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.1570  -15.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9446  -14.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7322  -15.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  1  6  1  0     0  0
  2  7  1  0     0  0
  7  8  2  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
  3 10  1  0     0  0
  4 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
  5 14  1  0     0  0
 12 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  2  0     0  0
 13 18  1  0     0  0
 17 19  1  0     0  0
 19 20  2  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 18 22  1  0     0  0
M  END
> <ID>
CHEBI:82310

> <NAME>
Dibenz[a,h]acridine

> <STAR>
2

> <FORMULA>
C21H13N

> <MASS>
279.33460

> <MONOISOTOPIC_MASS>
279.10480

> <CHARGE>
0

> <SMILES>
c1ccc2c(c1)ccc1nc3c(ccc4ccccc34)cc21

> <INCHI>
InChI=1S/C21H13N/c1-3-7-17-14(5-1)11-12-20-19(17)13-16-10-9-15-6-2-4-8-18(15)21(16)22-20/h1-13H

> <INCHIKEY>
JNCSIWAONQTVCF-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
226-36-8

> <KEGG_COMPOUND_ACCESSION>
C19219

$$$$