B6SAQ5 -OEChem-04042107233D 18 19 0 0 0 0 0 0 0999 V2000 -3.7508 0.6178 0.0008 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1856 -1.5033 -0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7668 -1.5379 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.1421 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8801 -0.2861 0.0002 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8322 -0.5713 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2034 0.7858 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5085 0.0794 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5205 -0.9036 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2082 1.7604 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1426 1.4171 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -1.1608 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4194 0.1602 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7844 -1.9603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4817 2.8137 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8754 2.2195 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7896 -1.9587 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4553 0.4746 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 2 5 2 0 0 0 0 3 6 2 0 0 0 0 3 12 1 0 0 0 0 4 7 2 0 0 0 0 4 13 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 M CHG 2 1 -1 5 1 M END $$$$