LM42OS -OEChem-05032301342D 27 28 0 0 0 0 0 0 0999 V2000 5.5116 1.4921 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2419 3.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9329 3.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1105 1.5141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7919 2.0659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2401 2.7473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 11 2 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 3 19 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 20 1 0 0 0 0 5 14 1 0 0 0 0 5 16 2 0 0 0 0 6 8 2 0 0 0 0 7 9 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 18 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 15 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$