File: github7669_1.rxn

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$RXN V3000

      Mrv2401  100720240457

M  V30 COUNTS 1 1
M  V30 BEGIN REACTANT
M  V30 BEGIN CTAB
M  V30 COUNTS 16 17 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C -17.5833 8.8333 0 1
M  V30 2 C -16.2497 9.6033 0 2
M  V30 3 C -18.917 9.6033 0 3
M  V30 4 C -20.2507 8.8333 0 4
M  V30 5 C -20.2507 7.2933 0 5
M  V30 6 C -18.917 6.5233 0 6
M  V30 7 C -17.5833 7.2933 0 7
M  V30 8 C -14.916 11.9134 0 8
M  V30 9 C -16.2497 11.1434 0 9
M  V30 10 C -14.916 8.8333 0 10
M  V30 11 C -13.5823 9.6033 0 11
M  V30 12 C -13.5823 11.1434 0 12
M  V30 13 C -18.917 11.1433 0 13
M  V30 14 F -16.2496 6.5233 0 14
M  V30 15 F -14.916 7.2933 0 15
M  V30 16 O -14.916 13.4534 0 16
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 7 1
M  V30 3 2 3 1
M  V30 4 2 9 2
M  V30 5 1 3 4
M  V30 6 1 3 13
M  V30 7 2 4 5
M  V30 8 1 5 6
M  V30 9 2 6 7
M  V30 10 1 7 14
M  V30 11 1 8 9
M  V30 12 2 8 12
M  V30 13 1 8 16
M  V30 14 2 10 11
M  V30 15 1 10 15
M  V30 16 1 11 12
M  V30 17 1 2 10
M  V30 END BOND
M  V30 END CTAB
M  V30 END REACTANT
M  V30 BEGIN PRODUCT
M  V30 BEGIN CTAB
M  V30 COUNTS 16 17 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C -4.7085 10.1437 0 1
M  V30 2 C -3.3749 10.9137 0 2
M  V30 3 C -6.0422 10.9137 0 3
M  V30 4 C -7.3759 10.1437 0 4
M  V30 5 C -7.3759 8.6037 0 5
M  V30 6 C -6.0422 7.8337 0 6
M  V30 7 C -4.7085 8.6037 0 7
M  V30 8 C -2.0412 13.2238 0 8
M  V30 9 C -3.3749 12.4538 0 9
M  V30 10 C -2.0412 10.1437 0 10
M  V30 11 C -0.7075 10.9137 0 11
M  V30 12 C -0.7075 12.4538 0 12
M  V30 13 C -6.0422 12.4537 0 13
M  V30 14 F -3.3748 7.8337 0 14
M  V30 15 F -2.0412 8.6037 0 15
M  V30 16 N -2.0412 14.7638 0 16
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 7 1
M  V30 3 2 3 1
M  V30 4 2 9 2
M  V30 5 1 3 4
M  V30 6 1 3 13
M  V30 7 2 4 5
M  V30 8 1 5 6
M  V30 9 2 6 7
M  V30 10 1 7 14
M  V30 11 1 8 9
M  V30 12 2 8 12
M  V30 13 1 8 16
M  V30 14 2 10 11
M  V30 15 1 10 15
M  V30 16 1 11 12
M  V30 17 1 2 10 CFG=1
M  V30 END BOND
M  V30 END CTAB
M  V30 END PRODUCT
M  END