BJ2SP4 -OEChem-04022113163D 22 22 0 1 0 0 0 0 0999 V2000 -2.5771 -0.1625 0.1527 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.6498 0.5589 -0.8032 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3676 0.8263 1.4031 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7606 -1.6175 0.4359 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -0.3396 -0.2449 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7169 1.3369 0.7274 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5987 -1.8333 0.1475 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2339 0.1775 0.0388 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0070 -0.0514 -0.7734 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3341 1.2897 -0.7932 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -0.4733 -0.3866 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7363 0.2882 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1403 0.2567 1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9432 -0.6533 -1.6714 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8036 2.1188 -0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 1.5768 -1.7007 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5758 -0.5115 -1.4817 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4473 -2.2834 -0.1945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8242 -2.3877 -0.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5978 0.5503 -0.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0571 0.8713 2.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6817 0.1504 0.0724 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 5 12 1 0 0 0 0 5 22 1 0 0 0 0 6 12 2 0 0 0 0 7 11 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 M END $$$$