RESIDUE   MR4     31
CONECT      CAA    4 CAL  HAA1 HAA2 HAA3
CONECT      CAL    3 CAA  CAH  CAO 
CONECT      CAH    3 CAL  CAN  HAH 
CONECT      CAO    3 CAL  OAC  CAM 
CONECT      OAC    2 CAO  HOAC
CONECT      CAM    3 CAO  CAB  CAI 
CONECT      CAB    4 CAM  HAB1 HAB2 HAB3
CONECT      CAI    3 CAM  CAN  HAI 
CONECT      CAN    3 CAH  CAI  CAP 
CONECT      CAP    3 CAN  OAK  NAJ 
CONECT      OAK    2 CAP  CAR 
CONECT      CAR    3 OAK  CAG  CAQ 
CONECT      CAG    3 CAR  CAE  HAG 
CONECT      CAE    3 CAG  CAD  HAE 
CONECT      CAD    3 CAE  CAF  HAD 
CONECT      CAF    3 CAD  CAQ  HAF 
CONECT      CAQ    3 CAR  CAF  NAJ 
CONECT      NAJ    2 CAP  CAQ 
CONECT      HAA1   1 CAA 
CONECT      HAA2   1 CAA 
CONECT      HAA3   1 CAA 
CONECT      HAH    1 CAH 
CONECT      HOAC   1 OAC 
CONECT      HAB1   1 CAB 
CONECT      HAB2   1 CAB 
CONECT      HAB3   1 CAB 
CONECT      HAI    1 CAI 
CONECT      HAG    1 CAG 
CONECT      HAE    1 CAE 
CONECT      HAD    1 CAD 
CONECT      HAF    1 CAF 
END   
HET    MR4             31
HETNAM     MR4 4-(1,3-BENZOXAZOL-2-YL)-2,6-DIMETHYLPHENOL
FORMUL      MR4    C15 H13 N1 O2