B85PNA -OEChem-04022101072D 26 27 0 0 0 0 0 0 0999 V2000 3.2733 0.9139 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 0.6048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.3261 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 1.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 0.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 2.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -1.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6717 2.3095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 3.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6685 3.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -0.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -0.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -2.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -2.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -3.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 3.1860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 1.9528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 7 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 5 7 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 11 13 2 0 0 0 0 11 20 1 0 0 0 0 12 14 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 M END $$$$