LE0MS5 -OEChem-05022322282D 38 41 0 1 0 0 0 0 0999 V2000 2.3660 0.2649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4962 1.7924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6244 3.2890 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.2649 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 -0.6011 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2320 0.7649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.7649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 0.7649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.7649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 0.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 2.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7641 1.7857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7641 0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6282 2.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2056 0.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4649 -0.7616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -0.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 2.0749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8509 -0.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8509 2.9195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2998 0.4320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0319 2.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4985 1.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1601 3.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4 1 1 1 0 0 0 5 1 1 1 0 0 0 2 22 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 22 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 9 14 2 0 0 0 0 9 26 1 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 11 17 1 0 0 0 0 11 27 1 0 0 0 0 12 18 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 29 1 0 0 0 0 15 21 2 0 0 0 0 15 30 1 0 0 0 0 16 19 2 0 0 0 0 16 31 1 0 0 0 0 17 20 2 0 0 0 0 17 32 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$