B3KQC2 -OEChem-04022106232D 30 32 0 1 0 0 0 0 0999 V2000 5.2026 3.3263 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.8318 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0116 1.9251 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5342 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3660 0.3318 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3660 0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6808 2.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4649 -0.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2056 0.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 0.9424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7834 0.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 0.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 2.4144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6215 1.7241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4329 4.1006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2974 2.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 5 2 1 6 0 0 0 2 8 1 0 0 0 0 2 21 1 0 0 0 0 3 11 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 12 1 0 0 0 0 9 24 1 0 0 0 0 10 13 2 0 0 0 0 10 25 1 0 0 0 0 12 14 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 M END $$$$